X5DRG1_HUMAN Loading...

Glycosyltransferase-like protein isoform C

AlphaFold DB , UniProt , Accession X5DRG1, Species HUMAN (Homo sapiens, Human), Gene LARGE, Length 465 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	49.9	Very low	53.2	Low	239 Å²	239	153.7 Å²	153.7	100%	1.177	76%	0.755	S	S	*	*				0	56.2	0	-81.5	-92	-143.6	0	0	112.2
2	L	49.9	Very low	53.9	Low	161 Å²	161	150.3 Å²	150.3	84%	0.843	74%	0.741	S	S	*	*			trans	-144.4	2.5	174.9	-98.5	158.2	0	0	0	114.4
3	G	50.4	Low	54.3	Low	67 Å²	67	143.1 Å²	143.1	69%	0.691	72%	0.72	S	S	*	*	S	Bend	trans	-89.1	-18	-179.7	0	0	0	0	0	115.6
4	I	51.5	Low	54.8	Low	145 Å²	145	136.6 Å²	136.6	74%	0.744	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-16.2	-168.7	-64	172.7	0	0	0	112.9
5	C	54.2	Low	55.2	Low	98 Å²	98	131.5 Å²	131.5	66%	0.662	68%	0.681	S	S	*	*	H	α-helix	trans	-87.9	-7.8	-178.1	-67.1	0	0	0	0	115.1
6	R	52.1	Low	55.4	Low	206 Å²	206	130.1 Å²	130.1	78%	0.777	67%	0.674	S	S	*	*	H	α-helix	trans	-89.5	-26	-178	-99.3	177.3	155.3	153.2	-6.1	114.5
7	G	51.7	Low	55.7	Low	45 Å²	45	126.2 Å²	126.2	46%	0.464	66%	0.661	S	S	.	*	H	α-helix	trans	-75.4	-40.1	178.8	0	0	0	0	0	113.7	R9 K10 F11	G7-R9 PolarHBondContact O-N 3.06Å; G7-K10 PolarHBondContact O-N 2.89Å; G7-F11 PolarHBondContact O-N 3.3Å
8	R	55.3	Low	55.9	Low	199 Å²	199	126.8 Å²	126.8	75%	0.751	66%	0.664	S	S	*	*	H	α-helix	trans	-67.8	-33.8	-177.9	-84	179.8	161.8	179.5	-5.6	114.2	L12	R8-L12 PolarHBondContact O-N 3.28Å; R8-L12 VanDerWaalsContact O-N 3.16Å
9	R	55.5	Low	56.1	Low	206 Å²	206	127.3 Å²	127.3	78%	0.777	67%	0.666	S	S	*	*	H	α-helix	trans	-70.4	-32.9	177.4	-77.2	-175.9	178.4	-178	-0.4	113.2	G7 A13	G7-R9 PolarHBondContact O-N 3.06Å; R9-A13 WeakPolarHBondContact O-CB 3.29Å; R9-A13 PolarHBondContact O-N 3.15Å
10	K	55.4	Low	56.4	Low	163 Å²	163	123.9 Å²	123.9	71%	0.709	65%	0.653	S	S	*	*	H	α-helix	trans	-73.5	-35.2	177.3	-68.2	-175.1	177.6	-173.7	0	112.1	G7 A14	G7-K10 PolarHBondContact O-N 2.89Å; K10-A14 WeakPolarHBondContact O-CB 3.49Å; K10-A14 PolarHBondContact O-N 3.3Å
11	F	59.8	Low	56.7	Low	162 Å²	162	123.5 Å²	123.5	71%	0.711	65%	0.65	S	S	*	*	H	α-helix	trans	-67.2	-46.3	173.8	-108.6	-90.7	0	0	0	112.2	G7 A13 A14 S15	G7-F11 PolarHBondContact O-N 3.3Å; F11-A13 PolarHBondContact O-N 3.27Å; F11-A14 PolarHBondContact O-N 3.43Å; F11-S15 PolarHBondContact O-N 3.38Å; F11-S15 PolarHBondContact O-OG 2.92Å
12	L	60.6	Low	57.3	Low	112 Å²	112	115.6 Å²	115.6	59%	0.586	62%	0.617	S	S	*	*	H	α-helix	trans	-60.8	-40	177	-91.8	151.6	0	0	0	113.4	R8 S15 L16	R8-L12 PolarHBondContact O-N 3.28Å; R8-L12 VanDerWaalsContact O-N 3.16Å; L12-S15 PolarHBondContact O-N 3.41Å; L12-L16 WeakPolarHBondContact O-CD1 3.48Å; L12-L16 PolarHBondContact O-N 2.87Å; L12-L16 VanDerWaalsContact O-N 3.07Å
13	A	59.1	Low	58	Low	57 Å²	57	110.3 Å²	110.3	47%	0.471	60%	0.596	S	S	.	*	H	α-helix	trans	-68.5	-36.5	177.5	0	0	0	0	0	112.9	R9 F11 S17	R9-A13 WeakPolarHBondContact O-CB 3.29Å; R9-A13 PolarHBondContact O-N 3.15Å; F11-A13 PolarHBondContact O-N 3.27Å; A13-S17 PolarHBondContact O-N 3.13Å; A13-S17 PolarHBondContact O-OG 3.03Å
14	A	61.8	Low	58.7	Low	53 Å²	53	112.7 Å²	112.7	44%	0.438	59%	0.592	S	S	.	*	H	α-helix	trans	-68.9	-38.9	174.9	0	0	0	0	0	111.8	K10 F11 S17 L18	K10-A14 WeakPolarHBondContact O-CB 3.49Å; K10-A14 PolarHBondContact O-N 3.3Å; F11-A14 PolarHBondContact O-N 3.43Å; A14-S17 PolarHBondContact O-N 3.45Å; A14-L18 PolarHBondContact O-N 2.8Å
15	S	61.4	Low	59.2	Low	60 Å²	60	109.3 Å²	109.3	42%	0.42	58%	0.579	S	S	.	*	H	α-helix	trans	-67.5	-38	177.4	-54.6	0	0	0	0	113.2	F11 L12	F11-S15 PolarHBondContact O-N 3.38Å; F11-S15 PolarHBondContact O-OG 2.92Å; L12-S15 PolarHBondContact O-N 3.41Å
16	L	57.7	Low	59.4	Low	108 Å²	108	113.4 Å²	113.4	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-68.1	-34.4	174.5	-101.5	119.2	0	0	0	112.5	L12 L19 C20	L12-L16 WeakPolarHBondContact O-CD1 3.48Å; L12-L16 PolarHBondContact O-N 2.87Å; L12-L16 VanDerWaalsContact O-N 3.07Å; L16-L19 PolarHBondContact O-N 3.37Å; L16-C20 WeakPolarHBondContact O-CB 3.26Å; L16-C20 PolarHBondContact O-N 3.43Å; L16-C20 VanDerWaalsContact O-N 3.07Å; L16-C20 PolarHBondContact O-SG 3.39Å; L16-C20 VanDerWaalsContact O-SG 3.35Å
17	S	59.9	Low	59.9	Low	64 Å²	64	109.5 Å²	109.5	45%	0.448	57%	0.573	S	S	.	*	H	α-helix	trans	-68.5	-35.5	178.9	-56.1	0	0	0	0	112.3	A13 A14 L19 I21	A13-S17 PolarHBondContact O-N 3.13Å; A13-S17 PolarHBondContact O-OG 3.03Å; A14-S17 PolarHBondContact O-N 3.45Å; S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 3.26Å; S17-I21 VanDerWaalsContact O-CD1 3.3Å; S17-I21 WeakPolarHBondContact O-CD1 3.38Å; S17-I21 WeakPolarHBondContact O-CG1 3.33Å; S17-I21 PolarHBondContact O-N 3.1Å
18	L	60.6	Low	60.3	Low	138 Å²	138	116.3 Å²	116.3	72%	0.723	59%	0.586	S	S	*	*	H	α-helix	trans	-72	-23	177.8	-91.5	148.6	0	0	0	114	A14 P22	A14-L18 PolarHBondContact O-N 2.8Å; L18-P22 WeakPolarHBondContact O-CD 3.22Å; L18-P22 WeakPolarHBondContact O-CG 3.39Å
19	L	59.9	Low	59.9	Low	135 Å²	135	112.8 Å²	112.8	71%	0.707	58%	0.582	S	S	*	*	H	α-helix	trans	-95	-34.4	179.3	-84.4	158.3	0	0	0	113.4	L16 S17	L16-L19 PolarHBondContact O-N 3.37Å; S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 3.26Å
20	C	61.4	Low	59.5	Low	60 Å²	60	109.9 Å²	109.9	41%	0.405	58%	0.575	S	S	.	*	H	α-helix	trans	-82.1	-30.5	-175.7	-66.8	0	0	0	0	113.6	L16 I24	L16-C20 WeakPolarHBondContact O-CB 3.26Å; L16-C20 PolarHBondContact O-N 3.43Å; L16-C20 VanDerWaalsContact O-N 3.07Å; L16-C20 PolarHBondContact O-SG 3.39Å; L16-C20 VanDerWaalsContact O-SG 3.35Å; C20-I24 WeakPolarHBondContact O-CD1 3.25Å; C20-I24 VanDerWaalsContact O-CG1 3.3Å; C20-I24 WeakPolarHBondContact O-CG1 3.41Å; C20-I24 PolarHBondContact O-N 2.88Å
21	I	62.6	Low	59.1	Low	115 Å²	115	106.7 Å²	106.7	59%	0.59	57%	0.573	S	S	*	*	H	α-helix	trans	-66.1	-47.3	-177.5	-65.6	171.1	0	0	0	111.9	S17 A23 I24 T25	S17-I21 VanDerWaalsContact O-CD1 3.3Å; S17-I21 WeakPolarHBondContact O-CD1 3.38Å; S17-I21 WeakPolarHBondContact O-CG1 3.33Å; S17-I21 PolarHBondContact O-N 3.1Å; I21-A23 VanDerWaalsContact C-N 3.33Å; I21-A23 PolarHBondContact O-N 3.26Å; I21-I24 PolarHBondContact O-N 3.47Å; I21-T25 PolarHBondContact O-N 3.18Å; I21-T25 VanDerWaalsContact O-N 3.17Å; I21-T25 PolarHBondContact O-OG1 2.93Å
22	P	63	Low	58.2	Low	74 Å²	74	102.1 Å²	102.1	48%	0.481	57%	0.572	S	S	.	*	H	α-helix	trans	-65	-34.1	178.7	-19.5	31.6	0	0	0	113.5	L18 T25 W26	L18-P22 WeakPolarHBondContact O-CD 3.22Å; L18-P22 WeakPolarHBondContact O-CG 3.39Å; P22-T25 WeakPolarHBondContact CA-OG1 3.48Å; P22-T25 PolarHBondContact O-N 3.39Å; P22-T25 PolarHBondContact O-OG1 2.96Å; P22-W26 WeakPolarHBondContact O-CB 3.49Å; P22-W26 PolarHBondContact O-N 3Å
23	A	63.4	Low	57.2	Low	49 Å²	49	101.3 Å²	101.3	41%	0.405	58%	0.575	S	S	.	*	H	α-helix	trans	-68.7	-37.5	179.6	0	0	0	0	0	112	I21 W26 I27	I21-A23 VanDerWaalsContact C-N 3.33Å; I21-A23 PolarHBondContact O-N 3.26Å; A23-W26 PolarHBondContact O-N 3.2Å; A23-I27 WeakPolarHBondContact O-CG1 3.32Å; A23-I27 PolarHBondContact O-N 2.95Å; A23-I27 VanDerWaalsContact O-N 3.11Å
24	I	65.6	Low	55.9	Low	117 Å²	117	107.6 Å²	107.6	60%	0.6	59%	0.593	S	S	*	*	H	α-helix	trans	-72.1	-38.1	177.4	-65.7	168	0	0	0	110.6	C20 I21 W26 I27 Y28	C20-I24 WeakPolarHBondContact O-CD1 3.25Å; C20-I24 VanDerWaalsContact O-CG1 3.3Å; C20-I24 WeakPolarHBondContact O-CG1 3.41Å; C20-I24 PolarHBondContact O-N 2.88Å; I21-I24 PolarHBondContact O-N 3.47Å; I24-W26 VanDerWaalsContact C-N 3.34Å; I24-I27 PolarHBondContact O-N 3.35Å; I24-Y28 WeakPolarHBondContact O-CB 3.48Å; I24-Y28 PolarHBondContact O-N 2.87Å
25	T	61.9	Low	54.8	Low	75 Å²	75	114.4 Å²	114.4	46%	0.46	62%	0.615	S	S	.	*	H	α-helix	trans	-66.9	-33.7	172.2	16.5	0	0	0	0	112.7	I21 P22 Y28 L29	I21-T25 PolarHBondContact O-N 3.18Å; I21-T25 VanDerWaalsContact O-N 3.17Å; I21-T25 PolarHBondContact O-OG1 2.93Å; P22-T25 WeakPolarHBondContact CA-OG1 3.48Å; P22-T25 PolarHBondContact O-N 3.39Å; P22-T25 PolarHBondContact O-OG1 2.96Å; T25-Y28 PolarHBondContact O-N 2.99Å; T25-L29 WeakPolarHBondContact O-CB 3.39Å; T25-L29 WeakPolarHBondContact O-CG 3.4Å; T25-L29 PolarHBondContact O-N 2.95Å
26	W	58.5	Low	53.5	Low	183 Å²	183	118.9 Å²	118.9	69%	0.693	64%	0.635	S	S	*	*	H	α-helix	trans	-66.9	-41.3	175.8	-130.4	59.5	0	0	0	112.4	P22 A23 I24 Y28 L29 F30	P22-W26 WeakPolarHBondContact O-CB 3.49Å; P22-W26 PolarHBondContact O-N 3Å; A23-W26 PolarHBondContact O-N 3.2Å; I24-W26 VanDerWaalsContact C-N 3.34Å; W26-Y28 VanDerWaalsContact C-N 3.34Å; W26-L29 PolarHBondContact O-N 3.22Å; W26-F30 HydrophobicContact CZ2-CE2 4.49Å; W26-F30 PolarHBondContact O-N 3.03Å; W26-F30 VanDerWaalsContact O-N 3.1Å
27	I	62.9	Low	52.3	Low	124 Å²	124	116.8 Å²	116.8	64%	0.636	64%	0.639	S	S	*	*	H	α-helix	trans	-66.5	-37.6	175.2	-67.4	166.5	0	0	0	111.1	A23 I24 S31	A23-I27 WeakPolarHBondContact O-CG1 3.32Å; A23-I27 PolarHBondContact O-N 2.95Å; A23-I27 VanDerWaalsContact O-N 3.11Å; I24-I27 PolarHBondContact O-N 3.35Å; I27-S31 WeakPolarHBondContact O-CB 3.28Å; I27-S31 PolarHBondContact O-N 3.13Å; I27-S31 PolarHBondContact O-OG 3.41Å
28	Y	59.1	Low	51	Low	189 Å²	189	123.4 Å²	123.4	74%	0.741	66%	0.659	S	S	*	*	H	α-helix	trans	-69.8	-33	177.9	-158.4	-94.8	0	0	0	112.8	I24 T25 W26 S31	I24-Y28 WeakPolarHBondContact O-CB 3.48Å; I24-Y28 PolarHBondContact O-N 2.87Å; T25-Y28 PolarHBondContact O-N 2.99Å; W26-Y28 VanDerWaalsContact C-N 3.34Å; Y28-S31 PolarHBondContact O-OG 3.11Å
29	L	47.6	Very low	49.9	Very low	124 Å²	124	122.5 Å²	122.5	65%	0.649	66%	0.662	S	S	*	*	H	α-helix	trans	-79	-29.6	177.3	-74.7	165.6	0	0	0	113.3	T25 W26	T25-L29 WeakPolarHBondContact O-CB 3.39Å; T25-L29 WeakPolarHBondContact O-CG 3.4Å; T25-L29 PolarHBondContact O-N 2.95Å; W26-L29 PolarHBondContact O-N 3.22Å
30	F	46.7	Very low	48.6	Very low	146 Å²	146	122.8 Å²	122.8	64%	0.64	67%	0.669	S	S	*	*	H	α-helix	trans	-86.2	-18.2	179	-105.7	-89.4	0	0	0	114.6	W26 G32	W26-F30 HydrophobicContact CZ2-CE2 4.49Å; W26-F30 PolarHBondContact O-N 3.03Å; W26-F30 VanDerWaalsContact O-N 3.1Å; F30-G32 VanDerWaalsContact C-N 3.25Å; F30-G32 PolarHBondContact O-N 3.45Å
31	S	46.8	Very low	46.9	Very low	95 Å²	95	125.5 Å²	125.5	66%	0.664	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-4.8	175.5	41.6	0	0	0	0	113.8	I27 Y28	I27-S31 WeakPolarHBondContact O-CB 3.28Å; I27-S31 PolarHBondContact O-N 3.13Å; I27-S31 PolarHBondContact O-OG 3.41Å; Y28-S31 PolarHBondContact O-OG 3.11Å
32	G	41.5	Very low	45.5	Very low	66 Å²	66	127.6 Å²	127.6	68%	0.68	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	0.7	178.1	0	0	0	0	0	116.1	F30	F30-G32 VanDerWaalsContact C-N 3.25Å; F30-G32 PolarHBondContact O-N 3.45Å
33	S	39.1	Very low	44	Very low	95 Å²	95	129.3 Å²	129.3	66%	0.664	71%	0.714	S	S	*	*			trans	-120.4	75.4	-178.1	-73.5	0	0	0	0	111.7
34	F	33.5	Very low	42.8	Very low	190 Å²	190	133 Å²	133	83%	0.833	73%	0.733	S	S	*	*			trans	-139.5	75.5	158.2	-109.4	-87.4	0	0	0	107.8
35	E	37.2	Very low	41	Very low	196 Å²	196	134.5 Å²	134.5	92%	0.916	74%	0.742	S	S	*	*			trans	-94.4	109.5	156.7	-75.4	-152.5	142.8	0	0	107.9	G37	E35-G37 PolarHBondContact O-N 3.01Å
36	D	35	Very low	39.5	Very low	154 Å²	154	138.8 Å²	138.8	82%	0.824	76%	0.757	S	S	*	*			trans	-76	112.7	169.4	-98.7	-33.1	0	0	0	109.3
37	G	31.7	Very low	38	Very low	63 Å²	63	135.9 Å²	135.9	65%	0.649	77%	0.765	S	S	*	*			trans	-91.8	140.4	169.4	0	0	0	0	0	112.4	E35	E35-G37 PolarHBondContact O-N 3.01Å
38	K	33.9	Very low	36.6	Very low	203 Å²	203	138.8 Å²	138.8	88%	0.883	78%	0.775	S	S	*	*			trans	153.1	162.3	138	-86.4	174.8	-175.9	-179	0	111.7
39	P	36.1	Very low	35.2	Very low	120 Å²	120	134.3 Å²	134.3	78%	0.779	78%	0.777	S	S	*	*				-126.5	170.4	-57.2	34	-15.6	0	0	0	111.9
40	V	32.7	Very low	34.7	Very low	140 Å²	140	137.1 Å²	137.1	85%	0.848	79%	0.787	S	S	*	*			trans	-63.8	137.6	175.2	174.7	0	0	0	0	111.9
41	S	26.8	Very low	34	Very low	118 Å²	118	135.1 Å²	135.1	83%	0.825	79%	0.791	S	S	*	*			trans	-137.7	142.2	159.1	-170.1	0	0	0	0	110.4
42	L	31.8	Very low	33.5	Very low	159 Å²	159	135.8 Å²	135.8	83%	0.832	79%	0.793	S	S	*	*			trans	-80	150.5	-168.2	-70	155.4	0	0	0	113.3
43	S	33	Very low	33	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	81%	0.805	S	S	*	*			trans	-61.5	171.6	-179.7	-33.6	0	0	0	0	115.1
44	P	38.3	Very low	33.3	Very low	125 Å²	125	148 Å²	148	81%	0.812	81%	0.806	S	S	*	*				-151	150.6	91.2	38	-18.7	0	0	0	118.7
45	L	27.4	Very low	33.8	Very low	149 Å²	149	145.2 Å²	145.2	78%	0.78	80%	0.804	S	S	*	*			trans	69.6	111.2	141	-132.4	72.7	0	0	0	123.9
46	E	30.9	Very low	34.2	Very low	165 Å²	165	140.1 Å²	140.1	77%	0.771	80%	0.795	S	S	*	*			trans	35.6	128	140.1	-65.3	177.8	138.6	0	0	123.5
47	S	26.5	Very low	35.4	Very low	123 Å²	123	134.9 Å²	134.9	86%	0.86	77%	0.771	S	S	*	*				-153.9	127.4	115.7	48.1	0	0	0	0	111.1
48	Q	32.5	Very low	37.5	Very low	184 Å²	184	134.6 Å²	134.6	86%	0.86	76%	0.759	S	S	*	*			trans	-82	135.6	169.1	-83.1	174.9	-20.9	0	0	110
49	A	30.4	Very low	39.5	Very low	95 Å²	95	132 Å²	132	79%	0.785	75%	0.75	S	S	*	*			trans	-158.3	140.6	146.1	0	0	0	0	0	110.3
50	H	37.3	Very low	41.3	Very low	184 Å²	184	136 Å²	136	85%	0.852	75%	0.75	S	S	*	*			trans	-66.5	125.7	-162	-61.8	-87	0	0	0	115
51	S	31.2	Very low	43.4	Very low	103 Å²	103	134.9 Å²	134.9	72%	0.72	74%	0.735	S	S	*	*			trans	-160.1	146.1	157.6	-83	0	0	0	0	108.2	R53	S51-R53 PolarHBondContact O-N 2.78Å
52	P	37.1	Very low	45.8	Very low	110 Å²	110	136.2 Å²	136.2	71%	0.714	72%	0.722	S	S	*	*			trans	-60.6	116.3	177.1	24.1	-29.8	0	0	0	108.4	Y54	P52-Y54 PolarHBondContact O-N 3.06Å
53	R	31.8	Very low	48.3	Very low	245 Å²	245	133.3 Å²	133.3	93%	0.925	70%	0.704	S	S	*	*			trans	-64.6	93	177.5	-80.6	179.4	175.8	172.4	-1.6	108.9	S51 T55	S51-R53 PolarHBondContact O-N 2.78Å; R53-T55 PolarHBondContact O-N 3.17Å
54	Y	45.1	Very low	50.7	Low	173 Å²	173	131.9 Å²	131.9	68%	0.678	69%	0.694	S	S	*	*			trans	-69	110.1	146.4	-75.3	-88.3	0	0	0	105.7	P52 A56	P52-Y54 PolarHBondContact O-N 3.06Å; Y54-A56 PolarHBondContact O-N 3.14Å; Y54-A56 VanDerWaalsContact O-N 3.1Å
55	T	44.3	Very low	52.7	Low	130 Å²	130	131.4 Å²	131.4	80%	0.798	68%	0.684	S	S	*	*			trans	-47.9	121.3	167.4	41.5	0	0	0	0	107.7	R53 S57	R53-T55 PolarHBondContact O-N 3.17Å; T55-S57 PolarHBondContact O-N 3.15Å
56	A	43.6	Very low	55.4	Low	89 Å²	89	129.3 Å²	129.3	74%	0.736	67%	0.67	S	S	*	*			trans	-53.5	110.9	178.4	0	0	0	0	0	108.1	Y54 S58	Y54-A56 PolarHBondContact O-N 3.14Å; Y54-A56 VanDerWaalsContact O-N 3.1Å; A56-S58 PolarHBondContact O-N 3.35Å
57	S	61.1	Low	58.1	Low	45 Å²	45	125.3 Å²	125.3	32%	0.315	66%	0.657	S	S	.	*			trans	-48.8	131	174.5	58.4	0	0	0	0	108.5	T55 E61 R62	T55-S57 PolarHBondContact O-N 3.15Å; S57-E61 WeakPolarHBondContact CA-OE2 3.42Å; S57-E61 WeakPolarHBondContact CB-OE2 3.37Å; S57-R62 VanDerWaalsContact OG-CG 3.22Å; S57-R62 WeakPolarHBondContact OG-CG 3.48Å; S57-R62 PolarHBondContact OG-NE 3.03Å
58	S	74.8	Confident	60.8	Low	56 Å²	56	123.2 Å²	123.2	39%	0.392	63%	0.63	S	S	.	*			trans	-56.8	150	179	73.1	0	0	0	0	109.6	A56 R60 E61 R62	A56-S58 PolarHBondContact O-N 3.35Å; S58-R60 PolarHBondContact O-N 3.18Å; S58-R60 VanDerWaalsContact O-N 3.07Å; S58-E61 PolarHBondContact N-OE2 3.06Å; S58-E61 WeakPolarHBondContact O-CB 3.46Å; S58-E61 PolarHBondContact O-N 2.64Å; S58-E61 WeakPolarHBondContact OG-CG 3.39Å; S58-E61 PolarHBondContact OG-N 3.18Å; S58-R62 PolarHBondContact O-N 3.36Å
59	Q	76.4	Confident	63.2	Low	149 Å²	149	119.8 Å²	119.8	70%	0.696	62%	0.615	S	S	*	*	H	α-helix	trans	-54.1	-33.3	179.1	-174.7	170.9	-19.6	0	0	111.9	R62 E63	Q59-R62 PolarHBondContact O-N 3.46Å; Q59-E63 PolarHBondContact NE2-OE1 2.9Å; Q59-E63 WeakPolarHBondContact O-CG 3.49Å; Q59-E63 PolarHBondContact O-N 3Å
60	R	75.1	Confident	65.9	Low	205 Å²	205	122.6 Å²	122.6	77%	0.774	61%	0.606	S	S	*	*	H	α-helix	trans	-64	-38.6	173.7	-65.2	-174.9	-168.7	-179.2	4.3	113.6	S58 S64	S58-R60 PolarHBondContact O-N 3.18Å; S58-R60 VanDerWaalsContact O-N 3.07Å; R60-S64 VanDerWaalsContact O-CB 3.31Å; R60-S64 WeakPolarHBondContact O-CB 3.23Å; R60-S64 PolarHBondContact O-N 2.85Å
61	E	76.1	Confident	68.3	Low	115 Å²	115	118 Å²	118	54%	0.537	59%	0.585	S	S	.	*	H	α-helix	trans	-67.1	-38.5	176.3	-74.9	165	177.9	0	0	111.5	S57 S58 S64 L65	S57-E61 WeakPolarHBondContact CA-OE2 3.42Å; S57-E61 WeakPolarHBondContact CB-OE2 3.37Å; S58-E61 PolarHBondContact N-OE2 3.06Å; S58-E61 WeakPolarHBondContact O-CB 3.46Å; S58-E61 PolarHBondContact O-N 2.64Å; S58-E61 WeakPolarHBondContact OG-CG 3.39Å; S58-E61 PolarHBondContact OG-N 3.18Å; E61-S64 PolarHBondContact O-N 3.16Å; E61-L65 WeakPolarHBondContact O-CB 3.37Å; E61-L65 PolarHBondContact O-N 2.79Å
62	R	77.4	Confident	70.9	Confident	146 Å²	146	115.2 Å²	115.2	55%	0.551	56%	0.563	S	S	*	*	H	α-helix	trans	-64.5	-48.1	175.1	-67.2	-174.3	178	170	-0.2	111.7	S57 S58 Q59 S64 L65 E66	S57-R62 VanDerWaalsContact OG-CG 3.22Å; S57-R62 WeakPolarHBondContact OG-CG 3.48Å; S57-R62 PolarHBondContact OG-NE 3.03Å; S58-R62 PolarHBondContact O-N 3.36Å; Q59-R62 PolarHBondContact O-N 3.46Å; R62-S64 VanDerWaalsContact C-N 3.31Å; R62-S64 PolarHBondContact O-N 3.02Å; R62-L65 PolarHBondContact O-N 3.38Å; R62-E66 WeakPolarHBondContact O-CG 3.38Å; R62-E66 PolarHBondContact O-N 3.26Å
63	E	84.1	Confident	73.2	Confident	99 Å²	99	113.9 Å²	113.9	46%	0.463	55%	0.547	S	S	.	.	H	α-helix	trans	-60.2	-42.2	176.7	-72.1	169.3	-171.8	0	0	111.3	Q59 L65 E66 V67	Q59-E63 PolarHBondContact NE2-OE1 2.9Å; Q59-E63 WeakPolarHBondContact O-CG 3.49Å; Q59-E63 PolarHBondContact O-N 3Å; E63-L65 PolarHBondContact O-N 3.4Å; E63-E66 PolarHBondContact O-N 3.04Å; E63-V67 WeakPolarHBondContact O-CG2 3.42Å; E63-V67 PolarHBondContact O-N 3.27Å
64	S	83	Confident	75.9	Confident	79 Å²	79	107.7 Å²	107.7	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-62.5	-42.2	175.3	-179	0	0	0	0	112.4	R60 E61 R62 R68	R60-S64 VanDerWaalsContact O-CB 3.31Å; R60-S64 WeakPolarHBondContact O-CB 3.23Å; R60-S64 PolarHBondContact O-N 2.85Å; E61-S64 PolarHBondContact O-N 3.16Å; R62-S64 VanDerWaalsContact C-N 3.31Å; R62-S64 PolarHBondContact O-N 3.02Å; S64-R68 WeakPolarHBondContact O-CB 3.46Å; S64-R68 PolarHBondContact O-N 3.31Å
65	L	80.4	Confident	77.9	Confident	116 Å²	116	103.7 Å²	103.7	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-66.6	-40.2	177.6	-172.8	67.6	0	0	0	111.7	E61 R62 E63 R68 M69	E61-L65 WeakPolarHBondContact O-CB 3.37Å; E61-L65 PolarHBondContact O-N 2.79Å; R62-L65 PolarHBondContact O-N 3.38Å; E63-L65 PolarHBondContact O-N 3.4Å; L65-R68 PolarHBondContact O-N 3.23Å; L65-M69 WeakPolarHBondContact O-CB 3.49Å; L65-M69 PolarHBondContact O-N 3.18Å
66	E	84.4	Confident	79.8	Confident	104 Å²	104	99.5 Å²	99.5	49%	0.486	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-44.6	176.6	-77.2	-178.4	-166.7	0	0	112.2	R62 E63 R68 M69 R70	R62-E66 WeakPolarHBondContact O-CG 3.38Å; R62-E66 PolarHBondContact O-N 3.26Å; E63-E66 PolarHBondContact O-N 3.04Å; E66-R68 VanDerWaalsContact C-N 3.29Å; E66-R68 PolarHBondContact O-N 2.83Å; E66-M69 PolarHBondContact O-N 2.75Å; E66-R70 WeakPolarHBondContact O-CG 3.38Å; E66-R70 PolarHBondContact O-N 3.41Å
67	V	87.4	Confident	81.9	Confident	82 Å²	82	101 Å²	101	50%	0.497	48%	0.476	S	S	.	.	H	α-helix	trans	-58.8	-46	174	171.6	0	0	0	0	109.9	E63 M69 R70 E71	E63-V67 WeakPolarHBondContact O-CG2 3.42Å; E63-V67 PolarHBondContact O-N 3.27Å; V67-M69 VanDerWaalsContact C-N 3.34Å; V67-M69 PolarHBondContact O-N 2.92Å; V67-R70 PolarHBondContact O-N 3.46Å; V67-E71 WeakPolarHBondContact O-CG 3.4Å; V67-E71 PolarHBondContact O-N 3.44Å
68	R	83.2	Confident	83.1	Confident	79 Å²	79	100.3 Å²	100.3	30%	0.298	47%	0.473	S	S	.	.	H	α-helix	trans	-64	-38.8	179.6	-170.7	58.6	172.4	-179.9	2.3	112.8	S64 L65 E66 R70 E71 V72 N148	S64-R68 WeakPolarHBondContact O-CB 3.46Å; S64-R68 PolarHBondContact O-N 3.31Å; L65-R68 PolarHBondContact O-N 3.23Å; E66-R68 VanDerWaalsContact C-N 3.29Å; E66-R68 PolarHBondContact O-N 2.83Å; R68-R70 VanDerWaalsContact C-N 3.34Å; R68-E71 VanDerWaalsContact CD-OE2 3.28Å; R68-E71 WeakPolarHBondContact CD-OE2 3.31Å; R68-E71 IonicContact CZ-OE2 3.09Å; R68-E71 IonicContact NE-OE2 3.6Å; R68-E71 IonicContact NH1-OE2 3.76Å; R68-E71 PolarHBondContact NH1-OE2 2.96Å; R68-E71 PolarHBondContact O-N 2.82Å; R68-V72 WeakPolarHBondContact O-CG2 3.36Å; R68-V72 PolarHBondContact O-N 3.48Å; R68-N148 PolarHBondContact NH2-OD1 2.94Å
69	M	83.5	Confident	83.5	Confident	111 Å²	111	98.9 Å²	98.9	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-62.1	-42.9	176	-170.9	173.4	72.6	0	0	111	L65 E66 V67 V72 E73	L65-M69 WeakPolarHBondContact O-CB 3.49Å; L65-M69 PolarHBondContact O-N 3.18Å; E66-M69 PolarHBondContact O-N 2.75Å; V67-M69 VanDerWaalsContact C-N 3.34Å; V67-M69 PolarHBondContact O-N 2.92Å; M69-V72 PolarHBondContact O-N 3.36Å; M69-E73 WeakPolarHBondContact O-CG 3.45Å; M69-E73 PolarHBondContact O-N 3.15Å
70	R	87.6	Confident	83.7	Confident	154 Å²	154	97.5 Å²	97.5	58%	0.581	45%	0.449	S	S	*	.	H	α-helix	trans	-62.4	-43.7	174.8	-68.6	179.3	-169.8	179.2	7.2	112.3	E66 V67 R68 V72 E73 E74	E66-R70 WeakPolarHBondContact O-CG 3.38Å; E66-R70 PolarHBondContact O-N 3.41Å; V67-R70 PolarHBondContact O-N 3.46Å; R68-R70 VanDerWaalsContact C-N 3.34Å; R70-V72 VanDerWaalsContact C-N 3.32Å; R70-V72 PolarHBondContact O-N 2.78Å; R70-E73 PolarHBondContact O-N 3.35Å; R70-E74 WeakPolarHBondContact O-CG 3.48Å; R70-E74 PolarHBondContact O-N 3.41Å
71	E	87.4	Confident	84.1	Confident	88 Å²	88	95.3 Å²	95.3	41%	0.411	44%	0.441	S	S	.	.	H	α-helix	trans	-57.2	-46.5	175.4	-71.1	177.3	172.2	0	0	111.5	V67 R68 E73 E74 E75	V67-E71 WeakPolarHBondContact O-CG 3.4Å; V67-E71 PolarHBondContact O-N 3.44Å; R68-E71 VanDerWaalsContact CD-OE2 3.28Å; R68-E71 WeakPolarHBondContact CD-OE2 3.31Å; R68-E71 IonicContact CZ-OE2 3.09Å; R68-E71 IonicContact NE-OE2 3.6Å; R68-E71 IonicContact NH1-OE2 3.76Å; R68-E71 PolarHBondContact NH1-OE2 2.96Å; R68-E71 PolarHBondContact O-N 2.82Å; E71-E73 PolarHBondContact O-N 2.97Å; E71-E74 PolarHBondContact O-N 3.31Å; E71-E75 WeakPolarHBondContact O-CB 3.25Å; E71-E75 PolarHBondContact O-N 3.43Å
72	V	84.1	Confident	84.1	Confident	44 Å²	44	94.6 Å²	94.6	27%	0.267	44%	0.438	S	S	.	.	H	α-helix	trans	-64	-41.6	178.8	170	0	0	0	0	111.4	R68 M69 R70 E75 N76	R68-V72 WeakPolarHBondContact O-CG2 3.36Å; R68-V72 PolarHBondContact O-N 3.48Å; M69-V72 PolarHBondContact O-N 3.36Å; R70-V72 VanDerWaalsContact C-N 3.32Å; R70-V72 PolarHBondContact O-N 2.78Å; V72-E75 PolarHBondContact O-N 2.97Å; V72-N76 WeakPolarHBondContact O-CB 3.35Å; V72-N76 VanDerWaalsContact O-CG 3.28Å; V72-N76 PolarHBondContact O-N 2.9Å; V72-N76 PolarHBondContact O-ND2 2.94Å
73	E	86	Confident	83.7	Confident	82 Å²	82	88.7 Å²	88.7	38%	0.383	42%	0.417	S	S	.	.	H	α-helix	trans	-64	-41.2	175.5	-76	-177.3	-172.4	0	0	112.8	M69 R70 E71 E75 N76 R77	M69-E73 WeakPolarHBondContact O-CG 3.45Å; M69-E73 PolarHBondContact O-N 3.15Å; R70-E73 PolarHBondContact O-N 3.35Å; E71-E73 PolarHBondContact O-N 2.97Å; E73-E75 VanDerWaalsContact C-N 3.32Å; E73-N76 PolarHBondContact O-N 2.98Å; E73-R77 VanDerWaalsContact O-CG 3.32Å; E73-R77 WeakPolarHBondContact O-CG 3.37Å; E73-R77 PolarHBondContact O-N 2.99Å; E73-R77 IonicContact OE2-NH2 3.54Å; E73-R77 PolarHBondContact OE2-NH2 3.36Å; E73-R77 VanDerWaalsContact OE2-NH2 3.08Å
74	E	89.6	Confident	83.2	Confident	115 Å²	115	87.2 Å²	87.2	54%	0.537	42%	0.418	S	S	.	.	H	α-helix	trans	-64.6	-39.9	176.1	-76	-176.2	178.5	0	0	111.5	R70 E71 R77 A78	R70-E74 WeakPolarHBondContact O-CG 3.48Å; R70-E74 PolarHBondContact O-N 3.41Å; E71-E74 PolarHBondContact O-N 3.31Å; E74-R77 CarbonylContact O-C 3.59Å; E74-R77 PolarHBondContact O-N 3.21Å; E74-A78 WeakPolarHBondContact O-CB 3.33Å; E74-A78 PolarHBondContact O-N 3.11Å
75	E	86	Confident	82.5	Confident	90 Å²	90	88.8 Å²	88.8	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-63.4	-45.5	174.4	-158.3	-168.9	139.8	0	0	111.1	E71 V72 E73 R77 A78 L79 R151	E71-E75 WeakPolarHBondContact O-CB 3.25Å; E71-E75 PolarHBondContact O-N 3.43Å; V72-E75 PolarHBondContact O-N 2.97Å; E73-E75 VanDerWaalsContact C-N 3.32Å; E75-R77 VanDerWaalsContact C-N 3.32Å; E75-R77 PolarHBondContact O-N 2.98Å; E75-A78 WeakPolarHBondContact O-CB 3.33Å; E75-A78 PolarHBondContact O-N 2.94Å; E75-A78 VanDerWaalsContact O-N 3.09Å; E75-L79 WeakPolarHBondContact O-CG 3.39Å; E75-L79 PolarHBondContact O-N 2.99Å; E75-R151 IonicContact OE1-CZ 3.08Å; E75-R151 IonicContact OE1-NH1 3.3Å; E75-R151 PolarHBondContact OE1-NH1 3.08Å; E75-R151 IonicContact OE1-NH2 2.69Å; E75-R151 IonicContact OE2-CZ 3.15Å; E75-R151 IonicContact OE2-NH1 3.43Å; E75-R151 PolarHBondContact OE2-NH1 3.4Å
76	N	85.6	Confident	81.6	Confident	41 Å²	41	84.6 Å²	84.6	22%	0.219	40%	0.401	C	S	.	.	H	α-helix	trans	-57	-45	172.8	-73.3	-18.8	0	0	0	111.3	V72 E73 A78 L79 R80 R151 L405	V72-N76 WeakPolarHBondContact O-CB 3.35Å; V72-N76 VanDerWaalsContact O-CG 3.28Å; V72-N76 PolarHBondContact O-N 2.9Å; V72-N76 PolarHBondContact O-ND2 2.94Å; E73-N76 PolarHBondContact O-N 2.98Å; N76-A78 VanDerWaalsContact C-N 3.32Å; N76-A78 PolarHBondContact O-N 3.1Å; N76-L79 PolarHBondContact O-N 3.29Å; N76-R80 WeakPolarHBondContact O-CG 3.34Å; N76-R80 PolarHBondContact O-N 3.3Å; N76-R151 PolarHBondContact OD1-NH2 2.99Å; N76-L405 WeakPolarHBondContact OD1-CD2 3.37Å
77	R	87.2	Confident	80.5	Confident	120 Å²	120	84.3 Å²	84.3	45%	0.453	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-36.5	175.2	-72.8	-179.5	-125.2	166.5	-0.5	112.2	E73 E74 E75 R81	E73-R77 VanDerWaalsContact O-CG 3.32Å; E73-R77 WeakPolarHBondContact O-CG 3.37Å; E73-R77 PolarHBondContact O-N 2.99Å; E73-R77 IonicContact OE2-NH2 3.54Å; E73-R77 PolarHBondContact OE2-NH2 3.36Å; E73-R77 VanDerWaalsContact OE2-NH2 3.08Å; E74-R77 CarbonylContact O-C 3.59Å; E74-R77 PolarHBondContact O-N 3.21Å; E75-R77 VanDerWaalsContact C-N 3.32Å; E75-R77 PolarHBondContact O-N 2.98Å; R77-R81 WeakPolarHBondContact O-CG 3.43Å; R77-R81 PolarHBondContact O-N 3.48Å; R77-R81 VanDerWaalsContact O-N 3.11Å; R77-R81 PolarHBondContact O-NE 2.85Å
78	A	85.8	Confident	78.9	Confident	32 Å²	32	83.8 Å²	83.8	26%	0.264	41%	0.411	S	S	.	.	H	α-helix	trans	-67.7	-43.5	176.4	0	0	0	0	0	111.6	E74 E75 N76 R80 R81 Q82	E74-A78 WeakPolarHBondContact O-CB 3.33Å; E74-A78 PolarHBondContact O-N 3.11Å; E75-A78 WeakPolarHBondContact O-CB 3.33Å; E75-A78 PolarHBondContact O-N 2.94Å; E75-A78 VanDerWaalsContact O-N 3.09Å; N76-A78 VanDerWaalsContact C-N 3.32Å; N76-A78 PolarHBondContact O-N 3.1Å; A78-R80 VanDerWaalsContact C-N 3.34Å; A78-R80 PolarHBondContact O-N 2.91Å; A78-R81 PolarHBondContact O-N 2.99Å; A78-Q82 WeakPolarHBondContact O-CG 3.37Å; A78-Q82 PolarHBondContact O-N 2.95Å
79	L	83.1	Confident	77.4	Confident	26 Å²	26	90 Å²	90	14%	0.136	43%	0.434	C	S	.	.	H	α-helix	trans	-59	-44.8	175.2	-70	178.1	0	0	0	111.6	E75 N76 R81 Q82 L83 L387 L402 L405	E75-L79 WeakPolarHBondContact O-CG 3.39Å; E75-L79 PolarHBondContact O-N 2.99Å; N76-L79 PolarHBondContact O-N 3.29Å; L79-R81 PolarHBondContact O-N 3.37Å; L79-Q82 PolarHBondContact O-N 3.26Å; L79-L83 PolarHBondContact O-N 2.7Å; L79-L83 VanDerWaalsContact O-N 3.1Å; L79-L387 HydrophobicContact CD1-CD1 4Å; L79-L387 HydrophobicContact CD2-CD1 3.7Å; L79-L387 HydrophobicContact CG-CD1 4.37Å; L79-L402 HydrophobicContact CB-CD2 4.16Å; L79-L405 HydrophobicContact CD1-CD2 4.14Å
80	R	81.4	Confident	75.4	Confident	120 Å²	120	88 Å²	88	45%	0.453	44%	0.435	S	S	.	.	H	α-helix	trans	-57.5	-46.4	173.8	-71.9	172.7	176.1	176	-3.4	112.7	N76 A78 Q82 L83 S84 E406	N76-R80 WeakPolarHBondContact O-CG 3.34Å; N76-R80 PolarHBondContact O-N 3.3Å; A78-R80 VanDerWaalsContact C-N 3.34Å; A78-R80 PolarHBondContact O-N 2.91Å; R80-Q82 PolarHBondContact O-N 2.69Å; R80-L83 WeakPolarHBondContact O-CB 3.48Å; R80-L83 PolarHBondContact O-N 3.03Å; R80-S84 PolarHBondContact O-N 3.4Å; R80-E406 WeakPolarHBondContact CG-OE1 3.44Å; R80-E406 IonicContact CZ-OE1 2.63Å; R80-E406 IonicContact CZ-OE2 3.43Å; R80-E406 VanDerWaalsContact NE-CD 3.34Å; R80-E406 IonicContact NE-OE1 3.08Å; R80-E406 PolarHBondContact NE-OE1 2.9Å; R80-E406 IonicContact NE-OE2 2.71Å; R80-E406 IonicContact NH2-OE1 2.58Å; R80-E406 PolarHBondContact NH2-OE1 3.28Å; R80-E406 IonicContact NH2-OE2 3.31Å; R80-E406 PolarHBondContact NH2-OE2 3.5Å
81	R	83.1	Confident	73.1	Confident	158 Å²	158	86 Å²	86	60%	0.596	44%	0.442	S	S	*	.	H	α-helix	trans	-65	-38.4	179.3	-76.5	-175.1	-73.9	-168.4	-0.6	112.4	R77 A78 L79 L83 S84 L85	R77-R81 WeakPolarHBondContact O-CG 3.43Å; R77-R81 PolarHBondContact O-N 3.48Å; R77-R81 VanDerWaalsContact O-N 3.11Å; R77-R81 PolarHBondContact O-NE 2.85Å; A78-R81 PolarHBondContact O-N 2.99Å; L79-R81 PolarHBondContact O-N 3.37Å; R81-L83 VanDerWaalsContact C-N 3.28Å; R81-L83 PolarHBondContact O-N 3.31Å; R81-S84 PolarHBondContact O-N 3.03Å; R81-S84 PolarHBondContact O-OG 3.02Å; R81-S84 VanDerWaalsContact O-OG 3.06Å; R81-L85 WeakPolarHBondContact O-CB 3.23Å; R81-L85 VanDerWaalsContact O-CG 3.26Å; R81-L85 WeakPolarHBondContact O-CG 3.18Å; R81-L85 PolarHBondContact O-N 2.97Å; R81-L85 VanDerWaalsContact O-N 3.12Å
82	Q	75.6	Confident	70.6	Confident	100 Å²	100	87.3 Å²	87.3	47%	0.467	46%	0.461	S	S	.	.	H	α-helix	trans	-63.4	-38.4	175.6	-73	-179	6.6	0	0	111.4	A78 L79 R80 A86	A78-Q82 WeakPolarHBondContact O-CG 3.37Å; A78-Q82 PolarHBondContact O-N 2.95Å; L79-Q82 PolarHBondContact O-N 3.26Å; R80-Q82 PolarHBondContact O-N 2.69Å; Q82-A86 WeakPolarHBondContact O-CB 3.38Å; Q82-A86 PolarHBondContact O-N 3.01Å
83	L	68.8	Low	68.4	Low	23 Å²	23	94 Å²	94	12%	0.12	49%	0.49	C	S	.	.	H	α-helix	trans	-66.8	-47.4	176.3	-172	72.8	0	0	0	112.1	L79 R80 R81 L85 A86 Q87 E395 R398 N399 L402	L79-L83 PolarHBondContact O-N 2.7Å; L79-L83 VanDerWaalsContact O-N 3.1Å; R80-L83 WeakPolarHBondContact O-CB 3.48Å; R80-L83 PolarHBondContact O-N 3.03Å; R81-L83 VanDerWaalsContact C-N 3.28Å; R81-L83 PolarHBondContact O-N 3.31Å; L83-L85 VanDerWaalsContact C-N 3.27Å; L83-L85 PolarHBondContact O-N 2.87Å; L83-A86 PolarHBondContact O-N 3.46Å; L83-Q87 HydrophobicContact CG-CG 4.43Å; L83-Q87 WeakPolarHBondContact O-CG 3.42Å; L83-Q87 PolarHBondContact O-N 3.25Å; L83-E395 WeakPolarHBondContact CD1-OE2 3.38Å; L83-R398 HydrophobicContact CD1-CB 3.86Å; L83-N399 WeakPolarHBondContact CD1-OD1 3.42Å; L83-N399 WeakPolarHBondContact CD2-OD1 3.46Å; L83-L402 HydrophobicContact CB-CD1 3.96Å; L83-L402 HydrophobicContact CD1-CD1 4.22Å; L83-L402 HydrophobicContact CD2-CD1 3.35Å; L83-L402 HydrophobicContact CG-CD1 4.02Å
84	S	73.4	Confident	65.9	Low	68 Å²	68	101.7 Å²	101.7	48%	0.476	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-36.4	-179.9	66.5	0	0	0	0	112.4	R80 R81 G88	R80-S84 PolarHBondContact O-N 3.4Å; R81-S84 PolarHBondContact O-N 3.03Å; R81-S84 PolarHBondContact O-OG 3.02Å; R81-S84 VanDerWaalsContact O-OG 3.06Å; S84-G88 PolarHBondContact O-N 3.45Å; S84-G88 VanDerWaalsContact O-N 3.08Å
85	L	69.6	Low	63.3	Low	112 Å²	112	107.9 Å²	107.9	59%	0.586	53%	0.533	S	S	*	.	H	α-helix	trans	-70.6	-32.3	174.3	-69.7	170.9	0	0	0	113.1	R81 L83 R89	R81-L85 WeakPolarHBondContact O-CB 3.23Å; R81-L85 VanDerWaalsContact O-CG 3.26Å; R81-L85 WeakPolarHBondContact O-CG 3.18Å; R81-L85 PolarHBondContact O-N 2.97Å; R81-L85 VanDerWaalsContact O-N 3.12Å; L83-L85 VanDerWaalsContact C-N 3.27Å; L83-L85 PolarHBondContact O-N 2.87Å; L85-R89 WeakPolarHBondContact O-CG 3.37Å
86	A	60.7	Low	60.6	Low	27 Å²	27	107 Å²	107	22%	0.223	55%	0.548	C	S	.	.	H	α-helix	trans	-71.5	-40.1	174.9	0	0	0	0	0	111.4	Q82 L83 R89 E395	Q82-A86 WeakPolarHBondContact O-CB 3.38Å; Q82-A86 PolarHBondContact O-N 3.01Å; L83-A86 PolarHBondContact O-N 3.46Å; A86-R89 PolarHBondContact O-N 3.42Å; A86-E395 WeakPolarHBondContact CB-OE1 3.31Å
87	Q	60.9	Low	58.2	Low	99 Å²	99	112.2 Å²	112.2	46%	0.463	58%	0.576	S	S	.	*	H	α-helix	trans	-66	-36.3	176	-69.7	175.7	-5.1	0	0	112.7	L83 R89 N399	L83-Q87 HydrophobicContact CG-CG 4.43Å; L83-Q87 WeakPolarHBondContact O-CG 3.42Å; L83-Q87 PolarHBondContact O-N 3.25Å; Q87-R89 PolarHBondContact O-N 3.15Å; Q87-N399 PolarHBondContact NE2-OD1 3.24Å
88	G	54.8	Low	55.7	Low	70 Å²	70	115.5 Å²	115.5	72%	0.722	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-7	176.9	0	0	0	0	0	115.7	S84	S84-G88 PolarHBondContact O-N 3.45Å; S84-G88 VanDerWaalsContact O-N 3.08Å
89	R	52	Low	53.1	Low	209 Å²	209	119.1 Å²	119.1	79%	0.789	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	1.2	-179.2	-73.3	179.6	177.8	-175.2	0.4	114.1	L85 A86 Q87	L85-R89 WeakPolarHBondContact O-CG 3.37Å; A86-R89 PolarHBondContact O-N 3.42Å; Q87-R89 PolarHBondContact O-N 3.15Å
90	A	40.1	Very low	50.6	Low	69 Å²	69	126.6 Å²	126.6	57%	0.57	65%	0.651	S	S	*	*	S	Bend	trans	-75.4	127.9	173.2	0	0	0	0	0	110.1	S92	A90-S92 PolarHBondContact O-N 3.01Å
91	P	40.8	Very low	48	Very low	113 Å²	113	126.6 Å²	126.6	73%	0.734	66%	0.664	S	S	*	*			trans	-62.7	131.8	173.6	24.1	-29.2	0	0	0	109.2	H93	P91-H93 PolarHBondContact O-N 2.9Å
92	S	34.3	Very low	45.3	Very low	116 Å²	116	129.7 Å²	129.7	81%	0.811	68%	0.678	S	S	*	*			trans	-56.9	100.3	176.3	41.4	0	0	0	0	110.3	A90 R94	A90-S92 PolarHBondContact O-N 3.01Å; S92-R94 PolarHBondContact O-N 2.87Å
93	H	37.6	Very low	43	Very low	185 Å²	185	129.6 Å²	129.6	86%	0.856	69%	0.688	S	S	*	*			trans	-61.4	115.2	162.7	-90.3	-72.9	0	0	0	107.5	P91 R95	P91-H93 PolarHBondContact O-N 2.9Å; H93-R95 PolarHBondContact O-N 2.74Å
94	R	33.9	Very low	41.1	Very low	242 Å²	242	137.8 Å²	137.8	91%	0.913	73%	0.728	S	S	*	*			trans	-46	121.7	178.3	-73.6	179.4	173.1	-179.1	-2.7	109.9	S92 G96	S92-R94 PolarHBondContact O-N 2.87Å; R94-G96 PolarHBondContact O-N 3.14Å
95	R	34.2	Very low	39.1	Very low	245 Å²	245	143.4 Å²	143.4	93%	0.925	75%	0.747	S	S	*	*			trans	-48.1	104.2	164.4	-104.7	176.3	170	177.1	-3.1	109.2	H93	H93-R95 PolarHBondContact O-N 2.74Å
96	G	30.2	Very low	37.3	Very low	71 Å²	71	147 Å²	147	73%	0.732	76%	0.76	S	S	*	*			trans	-82.2	119.4	157.1	0	0	0	0	0	108.2	R94 H98	R94-G96 PolarHBondContact O-N 3.14Å; G96-H98 PolarHBondContact O-N 3.06Å; G96-H98 VanDerWaalsContact O-N 3.09Å
97	N	34.4	Very low	35.8	Very low	151 Å²	151	149.7 Å²	149.7	81%	0.807	79%	0.791	S	S	*	*			trans	-59.8	105.1	176.1	-96.4	-9.4	0	0	0	111.2
98	H	34.5	Very low	34.4	Very low	190 Å²	190	151.6 Å²	151.6	88%	0.88	81%	0.809	S	S	*	*			trans	-129.9	88.2	151.2	-82.7	-26.9	0	0	0	108.9	G96 K100	G96-H98 PolarHBondContact O-N 3.06Å; G96-H98 VanDerWaalsContact O-N 3.09Å; H98-K100 PolarHBondContact O-N 3.02Å
99	S	32.5	Very low	33.3	Very low	107 Å²	107	151.4 Å²	151.4	75%	0.748	81%	0.808	S	S	*	*			trans	-68.3	106.1	162.2	-177.1	0	0	0	0	108
100	K	30	Very low	32.2	Very low	184 Å²	184	149.4 Å²	149.4	80%	0.8	81%	0.813	S	S	*	*			trans	-127.3	99	153.2	-84.5	-171.6	176.6	-179.4	0	107	H98 Y102	H98-K100 PolarHBondContact O-N 3.02Å; K100-Y102 PolarHBondContact O-N 3.38Å
101	T	27.4	Very low	31.8	Very low	119 Å²	119	151.5 Å²	151.5	73%	0.73	82%	0.823	S	S	*	*			trans	-56.3	114.2	170.1	-24.9	0	0	0	0	108.7
102	Y	26.6	Very low	31.7	Very low	224 Å²	224	155.1 Å²	155.1	88%	0.878	83%	0.83	S	S	*	*			trans	-106.2	101.6	160.7	-98.4	-86.7	0	0	0	106.6	K100	K100-Y102 PolarHBondContact O-N 3.38Å
103	S	26.2	Very low	31.9	Very low	97 Å²	97	156.6 Å²	156.6	68%	0.678	83%	0.829	S	S	*	*			trans	-72.4	129.1	169.6	-60.7	0	0	0	0	108.6	E105	S103-E105 PolarHBondContact O-N 2.9Å
104	M	29.9	Very low	31.6	Very low	196 Å²	196	155.6 Å²	155.6	97%	0.966	83%	0.829	S	S	*	*			trans	-72.2	116.9	162.1	-85.5	-161.6	167.3	0	0	107.9
105	E	31.1	Very low	31.6	Very low	186 Å²	186	155.9 Å²	155.9	87%	0.869	83%	0.83	S	S	*	*			trans	-104.6	139.9	159.4	-74.3	-165.9	164.9	0	0	109.8	S103	S103-E105 PolarHBondContact O-N 2.9Å
106	E	31.4	Very low	31.7	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	83%	0.83	S	S	*	*			trans	-63.1	132	-171.3	-66.2	168.1	132.4	0	0	112.3	T108	E106-T108 PolarHBondContact O-N 3.28Å
107	G	29.7	Very low	31.8	Very low	84 Å²	84	149.3 Å²	149.3	87%	0.866	83%	0.828	S	S	*	*			trans	-73.7	111	171.7	0	0	0	0	0	111.1
108	T	31.4	Very low	31.7	Very low	139 Å²	139	150.3 Å²	150.3	85%	0.853	83%	0.832	S	S	*	*			trans	-108	151.1	158	43.3	0	0	0	0	109	E106	E106-T108 PolarHBondContact O-N 3.28Å
109	G	30.3	Very low	32.2	Very low	67 Å²	67	148 Å²	148	69%	0.691	83%	0.831	S	S	*	*			trans	-76.1	-177.9	-157	0	0	0	0	0	117.6
110	D	30.5	Very low	32.3	Very low	167 Å²	167	147.5 Å²	147.5	89%	0.893	83%	0.833	S	S	*	*			trans	74.6	100.6	161.1	-55.4	-18.7	0	0	0	118
111	S	32	Very low	32.5	Very low	113 Å²	113	142.3 Å²	142.3	79%	0.79	83%	0.831	S	S	*	*			trans	-173.1	64.9	145.9	168.1	0	0	0	0	111.4
112	E	38.5	Very low	33.1	Very low	188 Å²	188	144.9 Å²	144.9	88%	0.879	84%	0.841	S	S	*	*			trans	-90.7	98.2	150.1	-79.8	-160.9	152.2	0	0	107.6
113	N	37	Very low	33.6	Very low	148 Å²	148	139.4 Å²	139.4	79%	0.791	84%	0.835	S	S	*	*			trans	161	75.1	154.3	-86.4	-25	0	0	0	109.4
114	L	31.3	Very low	34.4	Very low	164 Å²	164	140 Å²	140	86%	0.859	84%	0.84	S	S	*	*			trans	-169.1	94.6	149	-129.3	83.9	0	0	0	109.7
115	R	34.3	Very low	34.8	Very low	248 Å²	248	140 Å²	140	94%	0.936	84%	0.837	S	S	*	*			trans	168.5	64.3	142.3	-91.3	166	-175.8	-167	3	110.3
116	A	36.2	Very low	35.4	Very low	110 Å²	110	136.8 Å²	136.8	91%	0.909	83%	0.834	S	S	*	*			trans	-80.2	121.9	146.9	0	0	0	0	0	107.3
117	G	32.1	Very low	36	Very low	68 Å²	68	130.8 Å²	130.8	70%	0.701	82%	0.822	S	S	*	*			trans	100.8	83	162.7	0	0	0	0	0	116.8
118	I	33.5	Very low	36.9	Very low	171 Å²	171	135.8 Å²	135.8	88%	0.877	82%	0.823	S	S	*	*				-146.7	108.1	129.6	-57.3	-172.5	0	0	0	107.3
119	V	44	Very low	38.1	Very low	143 Å²	143	134.3 Å²	134.3	87%	0.867	81%	0.806	S	S	*	*			trans	-90.9	122.3	166	172.6	0	0	0	0	107.4
120	A	35.2	Very low	39.8	Very low	96 Å²	96	133.3 Å²	133.3	79%	0.793	79%	0.788	S	S	*	*			trans	160.4	126.3	137.5	0	0	0	0	0	111.6
121	G	33.4	Very low	42.2	Very low	74 Å²	74	131.1 Å²	131.1	76%	0.763	78%	0.78	S	S	*	*	S	Bend	trans	111.2	102.5	147.9	0	0	0	0	0	117.3
122	N	40.5	Very low	45	Very low	173 Å²	173	126.5 Å²	126.5	93%	0.925	75%	0.747	S	S	*	*			trans	56.8	85.2	155.9	-75.3	-6.1	0	0	0	118.3
123	S	38	Very low	47.6	Very low	110 Å²	110	124.1 Å²	124.1	77%	0.769	74%	0.736	S	S	*	*			trans	-115.1	117.5	149.9	56.1	0	0	0	0	108.7	E125	S123-E125 PolarHBondContact O-N 3.24Å
124	S	41.3	Very low	50.1	Low	110 Å²	110	122.7 Å²	122.7	77%	0.769	72%	0.723	S	S	*	*			trans	-31.7	129.4	161.2	47.2	0	0	0	0	111.7	C126	S124-C126 PolarHBondContact O-N 2.92Å
125	E	38.9	Very low	53	Low	195 Å²	195	117.5 Å²	117.5	91%	0.911	70%	0.699	S	S	*	*			trans	-57.3	86.7	169.3	-77.7	-178	146.3	0	0	109.6	S123 G127	S123-E125 PolarHBondContact O-N 3.24Å; E125-G127 PolarHBondContact O-N 3.47Å
126	C	43.3	Very low	56	Low	118 Å²	118	108.2 Å²	108.2	80%	0.797	67%	0.667	S	S	*	*			trans	-71.1	94.2	156.3	-156.9	0	0	0	0	104	S124 Q128	S124-C126 PolarHBondContact O-N 2.92Å; C126-Q128 PolarHBondContact O-N 3.18Å
127	G	44.3	Very low	58.9	Low	61 Å²	61	105.1 Å²	105.1	63%	0.629	64%	0.637	S	S	*	*			trans	-46.1	117.2	-172.3	0	0	0	0	0	110.5	E125 Q129	E125-G127 PolarHBondContact O-N 3.47Å; G127-Q129 PolarHBondContact O-N 3.35Å
128	Q	49.3	Very low	62.1	Low	189 Å²	189	101.9 Å²	101.9	88%	0.883	60%	0.603	S	S	*	*			trans	-56.8	112.1	178.3	-69.1	-177.6	-13	0	0	107.3	C126	C126-Q128 PolarHBondContact O-N 3.18Å
129	Q	55.9	Low	65.2	Low	107 Å²	107	95.5 Å²	95.5	50%	0.5	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-63.1	142.6	172.4	-68.8	-151.5	0.5	0	0	108	G127 V131	G127-Q129 PolarHBondContact O-N 3.35Å; Q129-V131 PolarHBondContact O-N 2.95Å
130	P	66.1	Low	67.8	Low	47 Å²	47	88.7 Å²	88.7	31%	0.305	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-53.5	118	174.7	-18.6	28.5	0	0	0	108.5	A256 H259	P130-A256 HydrophobicContact CB-CB 4.43Å; P130-A256 VanDerWaalsContact O-CB 3.29Å; P130-A256 WeakPolarHBondContact O-CB 3.47Å; P130-H259 HydrophobicContact CB-CB 3.97Å; P130-H259 HydrophobicContact CG-CB 3.98Å
131	V	80.6	Confident	70.8	Confident	120 Å²	120	84.1 Å²	84.1	73%	0.727	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-80.5	126.8	-178.8	-176.7	0	0	0	0	107.3	Q129	Q129-V131 PolarHBondContact O-N 2.95Å
132	V	91.5	Very high	73.9	Confident	16 Å²	16	80.7 Å²	80.7	10%	0.097	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-75.4	127.6	168.7	-178.1	0	0	0	0	107.3	K134 E136 A252 W255 A256	V132-K134 PolarHBondContact O-N 2.93Å; V132-E136 HydrophobicContact CG1-CB 4.04Å; V132-E136 HydrophobicContact CG1-CG 4.49Å; V132-A252 HydrophobicContact CB-CB 4.35Å; V132-A252 HydrophobicContact CG2-CB 4.23Å; V132-A252 VanDerWaalsContact CG2-O 3.25Å; V132-A252 WeakPolarHBondContact CG2-O 3.15Å; V132-W255 HydrophobicContact CG2-CB 4.39Å; V132-A256 HydrophobicContact CG2-CB 3.88Å
133	E	92.4	Very high	76.7	Confident	138 Å²	138	73.2 Å²	73.2	65%	0.645	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-59.2	136.4	179	-71	-60.7	150.4	0	0	110	C135 E136 N166	E133-C135 PolarHBondContact O-N 2.96Å; E133-E136 HydrophobicContact CB-CB 4.12Å; E133-E136 VanDerWaalsContact O-CB 3.27Å; E133-E136 WeakPolarHBondContact O-CB 3.29Å; E133-E136 PolarHBondContact O-N 2.88Å; E133-N166 PolarHBondContact O-ND2 3.09Å
134	K	89.4	Confident	79.5	Confident	118 Å²	118	68 Å²	68	51%	0.513	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-37.9	-170.4	-178.2	-174.6	174.2	-165.8	0	113.4	V132 N166 P167 G418	V132-K134 PolarHBondContact O-N 2.93Å; K134-N166 PolarHBondContact O-ND2 3.38Å; K134-P167 WeakPolarHBondContact O-CD 3.27Å; K134-G418 PolarHBondContact NZ-O 2.96Å
135	C	93.8	Very high	82	Confident	55 Å²	55	63.8 Å²	63.8	37%	0.372	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	12	-177.4	-61.7	0	0	0	0	113.9	E133 T137 C419	E133-C135 PolarHBondContact O-N 2.96Å; C135-T137 PolarHBondContact O-N 2.83Å; C135-C419 WeakPolarHBondContact CA-SG 3.41Å; C135-C419 HydrophobicContact CB-CB 3.78Å; C135-C419 WeakPolarHBondContact CB-SG 3.25Å; C135-C419 WeakPolarHBondContact SG-CA 3.44Å; C135-C419 WeakPolarHBondContact SG-CB 3.41Å; C135-C419 CovalentContact SG-SG 2.05Å; C135-C419 PolarHBondContact SG-SG 2.91Å
136	E	95.6	Very high	84.6	Confident	53 Å²	53	55.2 Å²	55.2	25%	0.248	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-67.6	128.8	167.4	-170.2	-178.1	163	0	0	109.9	V132 E133 R237 W255	V132-E136 HydrophobicContact CG1-CB 4.04Å; V132-E136 HydrophobicContact CG1-CG 4.49Å; E133-E136 HydrophobicContact CB-CB 4.12Å; E133-E136 VanDerWaalsContact O-CB 3.27Å; E133-E136 WeakPolarHBondContact O-CB 3.29Å; E133-E136 PolarHBondContact O-N 2.88Å; E136-R237 IonicContact OE1-CZ 2.87Å; E136-R237 IonicContact OE1-NE 2.64Å; E136-R237 IonicContact OE1-NH2 3.8Å; E136-R237 PolarHBondContact OE1-NH2 2.81Å; E136-R237 IonicContact OE2-NH2 3.66Å; E136-W255 PolarHBondContact OE1-NE1 3.12Å
137	T	97.6	Very high	86.8	Confident	45 Å²	45	55 Å²	55	28%	0.276	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-78.2	125.1	176.2	-60.4	0	0	0	0	110.3	C135 H139 P167 H169	C135-T137 PolarHBondContact O-N 2.83Å; T137-H139 PolarHBondContact O-CD2 2.8Å; T137-P167 WeakPolarHBondContact CA-O 3.45Å; T137-H169 HydrophobicContact CG2-CB 3.67Å
138	I	98.6	Very high	88.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	123.7	173.8	-60.5	174.3	0	0	0	108.7	V140 N166 P167 L168 H169 I239 I251 A252 W255	I138-V140 HydrophobicContact CG2-CG2 4.25Å; I138-N166 HydrophobicContact CD1-CB 3.71Å; I138-N166 HydrophobicContact CG1-CB 4.1Å; I138-P167 PolarHBondContact N-O 3.33Å; I138-L168 HydrophobicContact CB-CD2 3.75Å; I138-L168 HydrophobicContact CD1-CD2 4.42Å; I138-L168 HydrophobicContact CG2-CD2 4.16Å; I138-L168 WeakPolarHBondContact O-CA 3.28Å; I138-H169 PolarHBondContact O-N 3.25Å; I138-I239 HydrophobicContact CG2-CD1 4.26Å; I138-I251 HydrophobicContact CD1-CG2 4.04Å; I138-I251 HydrophobicContact CG2-CG1 4.49Å; I138-I251 HydrophobicContact CG2-CG2 4.36Å; I138-A252 VanDerWaalsContact CD1-CA 3.47Å; I138-A252 HydrophobicContact CD1-CB 3.71Å; I138-W255 HydrophobicContact CB-CD2 4.36Å; I138-W255 HydrophobicContact CB-CE3 4.47Å; I138-W255 HydrophobicContact CD1-CB 4.15Å; I138-W255 HydrophobicContact CD1-CG 4.36Å; I138-W255 HydrophobicContact CG1-CB 4.24Å; I138-W255 HydrophobicContact CG1-CD2 4.17Å; I138-W255 HydrophobicContact CG1-CG 3.94Å; I138-W255 HydrophobicContact CG2-CB 4.31Å; I138-W255 HydrophobicContact CG2-CD2 3.94Å; I138-W255 HydrophobicContact CG2-CE3 3.68Å; I138-W255 HydrophobicContact CG2-CG 4.24Å; I138-W255 HydrophobicContact CG2-CZ3 4.18Å
139	H	98.9	Very high	90.9	Very high	38 Å²	38	49.1 Å²	49.1	18%	0.176	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.5	-179.7	-66.4	-98.9	0	0	0	111.2	T137 H169 H171 L235 V238 I239 W255	T137-H139 PolarHBondContact O-CD2 2.8Å; H139-H169 WeakPolarHBondContact CA-O 3.32Å; H139-H169 AromaticContact CE1-ND1 3.63Å; H139-H169 AromaticContact ND1-CG 3.88Å; H139-H169 AromaticContact ND1-ND1 3.73Å; H139-H171 AromaticContact CE1-NE2 3.92Å; H139-H171 AromaticContact CG-NE2 3.85Å; H139-H171 AromaticContact ND1-CD2 3.9Å; H139-H171 AromaticContact ND1-CE1 3.94Å; H139-H171 AromaticContact ND1-NE2 2.94Å; H139-H171 PolarHBondContact ND1-NE2 3.28Å; H139-L235 HydrophobicContact CB-CD1 3.96Å; H139-L235 HydrophobicContact CB-CD2 4.42Å; H139-L235 VanDerWaalsContact CG-CD1 3.41Å; H139-L235 WeakPolarHBondContact ND1-CD1 3.12Å; H139-V238 HydrophobicContact CB-CB 4.49Å; H139-V238 HydrophobicContact CB-CG2 4.11Å; H139-V238 WeakPolarHBondContact O-CG2 3.3Å; H139-I239 PolarHBondContact O-N 3.33Å; H139-W255 HydrophobicContact CB-CH2 3.97Å; H139-W255 HydrophobicContact CB-CZ3 4.31Å; H139-W255 WeakPolarHBondContact O-CZ3 3.33Å
140	V	98.9	Very high	92.8	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.4	-177.4	-176.1	0	0	0	0	109.6	I138 I142 H169 F170 H171 I239 L241 I251	I138-V140 HydrophobicContact CG2-CG2 4.25Å; V140-I142 HydrophobicContact CG1-CD1 4.38Å; V140-I142 HydrophobicContact CG1-CG1 4.22Å; V140-H169 PolarHBondContact N-O 2.71Å; V140-F170 HydrophobicContact CB-CD1 3.87Å; V140-F170 HydrophobicContact CB-CE1 4.07Å; V140-F170 HydrophobicContact CG1-CD1 4.06Å; V140-F170 HydrophobicContact CG1-CE1 4.1Å; V140-F170 HydrophobicContact CG2-CE1 4.39Å; V140-F170 CarbonylContact O-C 3.6Å; V140-F170 WeakPolarHBondContact O-CA 3.44Å; V140-H171 PolarHBondContact O-N 3.11Å; V140-I239 CarbonylContact C-O 3.51Å; V140-I239 VanDerWaalsContact CA-O 3.25Å; V140-I239 WeakPolarHBondContact CA-O 3.02Å; V140-L241 HydrophobicContact CG1-CD1 3.57Å; V140-L241 HydrophobicContact CG1-CG 4.1Å; V140-I251 HydrophobicContact CG2-CD1 3.66Å
141	A	98.9	Very high	94	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	136.5	176.6	0	0	0	0	0	111.9	H171 L227 L231 V238 I239 V240 L241	A141-H171 CarbonylContact C-O 3.54Å; A141-H171 VanDerWaalsContact CA-O 3.26Å; A141-H171 WeakPolarHBondContact CA-O 3.33Å; A141-H171 HydrophobicContact CB-CB 4.29Å; A141-L227 HydrophobicContact CB-CD2 4.07Å; A141-L231 HydrophobicContact CB-CD1 4.19Å; A141-V238 HydrophobicContact CB-CG2 3.66Å; A141-I239 PolarHBondContact N-O 2.96Å; A141-V240 HydrophobicContact CB-CG2 4.36Å; A141-V240 WeakPolarHBondContact O-CA 3.27Å; A141-L241 PolarHBondContact O-N 3.41Å
142	I	98.8	Very high	94.6	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	136.7	-179.5	-52.7	172.6	0	0	0	108.7	V140 C144 V153 L156 F170 H171 L172 I173 L241 T243	V140-I142 HydrophobicContact CG1-CD1 4.38Å; V140-I142 HydrophobicContact CG1-CG1 4.22Å; I142-C144 HydrophobicContact CG2-CB 4.49Å; I142-V153 HydrophobicContact CD1-CG1 4.37Å; I142-V153 HydrophobicContact CG2-CG2 3.89Å; I142-L156 HydrophobicContact CD1-CD2 3.84Å; I142-F170 HydrophobicContact CD1-CD1 4.28Å; I142-H171 PolarHBondContact N-O 3.2Å; I142-L172 HydrophobicContact CB-CD2 3.74Å; I142-L172 HydrophobicContact CD1-CD2 4.09Å; I142-L172 HydrophobicContact CG1-CD2 4.2Å; I142-L172 WeakPolarHBondContact O-CA 3.31Å; I142-I173 PolarHBondContact O-N 2.79Å; I142-L241 HydrophobicContact CG1-CB 4.42Å; I142-T243 HydrophobicContact CG2-CG2 3.99Å
143	V	98.4	Very high	94.9	Very high	17 Å²	17	38.7 Å²	38.7	10%	0.103	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122	167.5	-178.4	0	0	0	0	107.9	I173 M223 K224 T243	V143-I173 WeakPolarHBondContact CA-O 3.23Å; V143-I173 HydrophobicContact CG1-CG2 4.4Å; V143-I173 HydrophobicContact CG2-CB 4.22Å; V143-I173 HydrophobicContact CG2-CD1 4.32Å; V143-M223 HydrophobicContact CG1-CB 3.92Å; V143-M223 HydrophobicContact CG1-SD 4.27Å; V143-M223 HydrophobicContact CG2-CB 4.03Å; V143-K224 HydrophobicContact CG2-CG 3.96Å; V143-T243 WeakPolarHBondContact O-CG2 3.33Å
144	C	97.5	Very high	95	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	121.4	-175.3	-179	0	0	0	0	111	I142 A149 S150 V153 I173 A174 A178 L182 T243	I142-C144 HydrophobicContact CG2-CB 4.49Å; C144-A149 VanDerWaalsContact SG-C 3.56Å; C144-S150 PolarHBondContact SG-N 3.33Å; C144-V153 HydrophobicContact CB-CG2 3.9Å; C144-I173 PolarHBondContact N-O 3.24Å; C144-A174 VanDerWaalsContact O-CA 3.25Å; C144-A174 WeakPolarHBondContact O-CA 3.47Å; C144-A178 WeakPolarHBondContact O-CB 3.2Å; C144-L182 HydrophobicContact CB-CD1 4.37Å; C144-T243 HydrophobicContact CB-CG2 4.32Å
145	A	94.1	Very high	95.3	Very high	21 Å²	21	27.6 Å²	27.6	17%	0.174	15%	0.15	C	C	.	.			trans	-135.7	133.7	178.6	0	0	0	0	0	112.5	A149 D175 Y220	A145-A149 VanDerWaalsContact O-CB 3.25Å; A145-A149 WeakPolarHBondContact O-CB 3.48Å; A145-D175 WeakPolarHBondContact CA-OD1 3.32Å; A145-D175 HydrophobicContact CB-CB 4.31Å; A145-Y220 HydrophobicContact CB-CD1 3.43Å; A145-Y220 VanDerWaalsContact CB-CD1 3.43Å; A145-Y220 HydrophobicContact CB-CD2 3.46Å; A145-Y220 VanDerWaalsContact CB-CD2 3.46Å; A145-Y220 HydrophobicContact CB-CE1 3.46Å; A145-Y220 VanDerWaalsContact CB-CE1 3.46Å; A145-Y220 HydrophobicContact CB-CE2 3.43Å; A145-Y220 VanDerWaalsContact CB-CE2 3.43Å; A145-Y220 HydrophobicContact CB-CG 3.45Å; A145-Y220 VanDerWaalsContact CB-CG 3.45Å; A145-Y220 VanDerWaalsContact CB-CZ 3.44Å
146	G	92.4	Very high	95.5	Very high	15 Å²	15	25 Å²	25	16%	0.155	13%	0.132	C	C	.	.	H	α-helix	trans	74.5	176.4	179.3	0	0	0	0	0	114.8	N148 S150 D175	G146-N148 PolarHBondContact O-N 2.81Å; G146-S150 WeakPolarHBondContact O-CB 3.42Å; G146-S150 PolarHBondContact O-N 3.46Å; G146-S150 VanDerWaalsContact O-N 3.15Å; G146-S150 PolarHBondContact O-OG 3.26Å; G146-D175 VanDerWaalsContact N-CG 3.32Å; G146-D175 PolarHBondContact N-OD1 3.24Å; G146-D175 PolarHBondContact N-OD2 2.98Å
147	Y	89.4	Confident	95.6	Very high	114 Å²	114	22.6 Å²	22.6	45%	0.447	12%	0.121	S	C	.	.	H	α-helix	trans	-62.3	-44.1	-172.3	-64.9	-78.2	0	0	0	114.6	S150 R151 I177 I181	Y147-S150 WeakPolarHBondContact O-CB 3.34Å; Y147-S150 PolarHBondContact O-N 3.17Å; Y147-R151 PolarHBondContact O-N 3.47Å; Y147-R151 VanDerWaalsContact O-N 3.16Å; Y147-I177 HydrophobicContact CD1-CG2 3.89Å; Y147-I177 HydrophobicContact CD2-CG2 3.95Å; Y147-I177 HydrophobicContact CE1-CG2 3.63Å; Y147-I177 HydrophobicContact CE2-CD1 4.01Å; Y147-I177 HydrophobicContact CE2-CG2 3.7Å; Y147-I177 HydrophobicContact CG-CG2 4.03Å; Y147-I181 HydrophobicContact CD1-CD1 3.54Å; Y147-I181 HydrophobicContact CE1-CD1 3.86Å; Y147-I181 HydrophobicContact CG-CD1 4.46Å
148	N	88.7	Confident	95.6	Very high	106 Å²	106	21.4 Å²	21.4	57%	0.567	11%	0.112	S	C	*	.	H	α-helix	trans	-68.9	-45.6	-173.5	-65.7	-9.8	0	0	0	110.9	R68 G146 S150 R151 D152	R68-N148 PolarHBondContact NH2-OD1 2.94Å; G146-N148 PolarHBondContact O-N 2.81Å; N148-S150 VanDerWaalsContact C-N 3.28Å; N148-S150 PolarHBondContact O-N 2.98Å; N148-R151 PolarHBondContact O-N 3.15Å; N148-D152 PolarHBondContact O-N 3.44Å
149	A	92.2	Very high	95.5	Very high	19 Å²	19	21.4 Å²	21.4	16%	0.157	11%	0.112	C	C	.	.	H	α-helix	trans	-61.7	-39.5	175.9	0	0	0	0	0	111.3	C144 A145 R151 D152 V153 T243	C144-A149 VanDerWaalsContact SG-C 3.56Å; A145-A149 VanDerWaalsContact O-CB 3.25Å; A145-A149 WeakPolarHBondContact O-CB 3.48Å; A149-R151 VanDerWaalsContact C-N 3.29Å; A149-R151 PolarHBondContact O-N 2.97Å; A149-D152 PolarHBondContact O-N 3.41Å; A149-D152 VanDerWaalsContact O-N 3.14Å; A149-V153 WeakPolarHBondContact O-CG2 3.45Å; A149-V153 PolarHBondContact O-N 3.07Å; A149-T243 HydrophobicContact CB-CG2 4.35Å
150	S	94.6	Very high	95.5	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.007	10%	0.104	C	C	.	.	H	α-helix	trans	-58.5	-41.5	177	-58.3	0	0	0	0	111.8	C144 G146 Y147 N148 V153 V154 A178	C144-S150 PolarHBondContact SG-N 3.33Å; G146-S150 WeakPolarHBondContact O-CB 3.42Å; G146-S150 PolarHBondContact O-N 3.46Å; G146-S150 VanDerWaalsContact O-N 3.15Å; G146-S150 PolarHBondContact O-OG 3.26Å; Y147-S150 WeakPolarHBondContact O-CB 3.34Å; Y147-S150 PolarHBondContact O-N 3.17Å; N148-S150 VanDerWaalsContact C-N 3.28Å; N148-S150 PolarHBondContact O-N 2.98Å; S150-V153 PolarHBondContact O-N 3.25Å; S150-V154 VanDerWaalsContact O-CG2 3.31Å; S150-V154 WeakPolarHBondContact O-CG2 3.38Å; S150-V154 PolarHBondContact O-N 3.04Å; S150-A178 WeakPolarHBondContact OG-CA 3.5Å; S150-A178 WeakPolarHBondContact OG-CB 3.47Å
151	R	91.3	Very high	95.3	Very high	42 Å²	42	19.7 Å²	19.7	16%	0.158	10%	0.104	C	C	.	.	H	α-helix	trans	-65.5	-39.4	176.3	179.4	169.7	165.1	-128.2	0.1	112.8	E75 N76 Y147 N148 A149 V154 T155	E75-R151 IonicContact OE1-CZ 3.08Å; E75-R151 IonicContact OE1-NH1 3.3Å; E75-R151 PolarHBondContact OE1-NH1 3.08Å; E75-R151 IonicContact OE1-NH2 2.69Å; E75-R151 IonicContact OE2-CZ 3.15Å; E75-R151 IonicContact OE2-NH1 3.43Å; E75-R151 PolarHBondContact OE2-NH1 3.4Å; N76-R151 PolarHBondContact OD1-NH2 2.99Å; Y147-R151 PolarHBondContact O-N 3.47Å; Y147-R151 VanDerWaalsContact O-N 3.16Å; N148-R151 PolarHBondContact O-N 3.15Å; A149-R151 VanDerWaalsContact C-N 3.29Å; A149-R151 PolarHBondContact O-N 2.97Å; R151-V154 PolarHBondContact O-N 3.26Å; R151-T155 PolarHBondContact O-N 3.09Å; R151-T155 PolarHBondContact O-OG1 3.17Å
152	D	93.8	Very high	95.1	Very high	29 Å²	29	24.4 Å²	24.4	16%	0.155	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-45.8	175.3	-74.1	-25.5	0	0	0	110.8	N148 A149 V154 T155 L156 T243 Y401	N148-D152 PolarHBondContact O-N 3.44Å; A149-D152 PolarHBondContact O-N 3.41Å; A149-D152 VanDerWaalsContact O-N 3.14Å; D152-V154 VanDerWaalsContact C-N 3.28Å; D152-V154 PolarHBondContact O-N 3.31Å; D152-T155 WeakPolarHBondContact O-CB 3.42Å; D152-T155 PolarHBondContact O-N 3.29Å; D152-L156 PolarHBondContact O-N 2.82Å; D152-T243 CarbonylContact C-O 3.51Å; D152-T243 VanDerWaalsContact C-O 3.27Å; D152-T243 WeakPolarHBondContact CB-O 3.31Å; D152-Y401 PolarHBondContact OD1-OH 3.44Å
153	V	96.9	Very high	94.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58	-39.1	176.2	171.5	0	0	0	0	112.1	I142 C144 A149 S150 T155 L156 V157 L182 T243	I142-V153 HydrophobicContact CD1-CG1 4.37Å; I142-V153 HydrophobicContact CG2-CG2 3.89Å; C144-V153 HydrophobicContact CB-CG2 3.9Å; A149-V153 WeakPolarHBondContact O-CG2 3.45Å; A149-V153 PolarHBondContact O-N 3.07Å; S150-V153 PolarHBondContact O-N 3.25Å; V153-T155 VanDerWaalsContact C-N 3.3Å; V153-T155 PolarHBondContact O-N 2.85Å; V153-L156 WeakPolarHBondContact O-CB 3.46Å; V153-L156 PolarHBondContact O-N 2.97Å; V153-V157 HydrophobicContact CG1-CG2 3.94Å; V153-V157 WeakPolarHBondContact O-CB 3.36Å; V153-V157 VanDerWaalsContact O-CG2 3.26Å; V153-V157 WeakPolarHBondContact O-CG2 3.16Å; V153-V157 PolarHBondContact O-N 3.19Å; V153-L182 HydrophobicContact CB-CD2 4.45Å; V153-L182 HydrophobicContact CG1-CD1 4.13Å; V153-L182 HydrophobicContact CG1-CD2 4.05Å; V153-T243 HydrophobicContact CG2-CG2 3.4Å; V153-T243 VanDerWaalsContact CG2-CG2 3.4Å
154	V	95.6	Very high	94.7	Very high	21 Å²	21	26.1 Å²	26.1	13%	0.127	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-42	176.3	168.9	0	0	0	0	111.6	S150 R151 D152 K158 L182 L185 W189	S150-V154 VanDerWaalsContact O-CG2 3.31Å; S150-V154 WeakPolarHBondContact O-CG2 3.38Å; S150-V154 PolarHBondContact O-N 3.04Å; R151-V154 PolarHBondContact O-N 3.26Å; D152-V154 VanDerWaalsContact C-N 3.28Å; D152-V154 PolarHBondContact O-N 3.31Å; V154-K158 HydrophobicContact CG1-CD 4.25Å; V154-K158 VanDerWaalsContact O-CG 3.27Å; V154-K158 WeakPolarHBondContact O-CG 3.31Å; V154-K158 PolarHBondContact O-N 3.18Å; V154-L182 HydrophobicContact CG2-CD2 4.05Å; V154-L185 HydrophobicContact CB-CD1 4.31Å; V154-L185 HydrophobicContact CG1-CD1 3.93Å; V154-L185 HydrophobicContact CG2-CD1 3.36Å; V154-L185 HydrophobicContact CG2-CD2 4.38Å; V154-L185 HydrophobicContact CG2-CG 4.47Å; V154-W189 HydrophobicContact CG1-CH2 3.97Å; V154-W189 HydrophobicContact CG1-CZ2 4.03Å
155	T	95.6	Very high	94.5	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-43.5	177.9	-55.2	0	0	0	0	111	R151 D152 V153 K158 S159 Y401 F404	R151-T155 PolarHBondContact O-N 3.09Å; R151-T155 PolarHBondContact O-OG1 3.17Å; D152-T155 WeakPolarHBondContact O-CB 3.42Å; D152-T155 PolarHBondContact O-N 3.29Å; V153-T155 VanDerWaalsContact C-N 3.3Å; V153-T155 PolarHBondContact O-N 2.85Å; T155-K158 PolarHBondContact O-N 3.14Å; T155-S159 PolarHBondContact O-N 3.34Å; T155-S159 VanDerWaalsContact O-N 3.09Å; T155-Y401 HydrophobicContact CG2-CD2 3.87Å; T155-Y401 HydrophobicContact CG2-CE2 3.76Å; T155-Y401 HydrophobicContact CG2-CG 4.37Å; T155-F404 HydrophobicContact CG2-CB 3.87Å
156	L	97.9	Very high	94.6	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-55.9	-54.9	172.9	166.5	58.3	0	0	0	111.4	I142 D152 V153 K158 S159 V160 L241 D242 I245 F247	I142-L156 HydrophobicContact CD1-CD2 3.84Å; D152-L156 PolarHBondContact O-N 2.82Å; V153-L156 WeakPolarHBondContact O-CB 3.46Å; V153-L156 PolarHBondContact O-N 2.97Å; L156-K158 VanDerWaalsContact C-N 3.33Å; L156-K158 PolarHBondContact O-N 3.47Å; L156-S159 PolarHBondContact O-N 3.11Å; L156-S159 PolarHBondContact O-OG 3.21Å; L156-V160 HydrophobicContact CD1-CG2 3.93Å; L156-V160 PolarHBondContact O-N 3.4Å; L156-L241 HydrophobicContact CD1-CD1 4.22Å; L156-L241 HydrophobicContact CD2-CB 4.18Å; L156-L241 HydrophobicContact CD2-CD1 4.35Å; L156-D242 WeakPolarHBondContact CD2-O 3.04Å; L156-I245 WeakPolarHBondContact CB-O 3.26Å; L156-I245 HydrophobicContact CD1-CB 3.8Å; L156-I245 HydrophobicContact CD1-CG2 3.8Å; L156-I245 WeakPolarHBondContact CD1-O 3.42Å; L156-I245 HydrophobicContact CD2-CB 4.39Å; L156-F247 HydrophobicContact CD1-CD2 3.89Å; L156-F247 HydrophobicContact CD1-CE2 4.11Å
157	V	97.7	Very high	94.8	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-58.5	-46.8	-177.4	172.2	0	0	0	0	109.7	V153 S159 V160 L161 F170 F186 W189	V153-V157 HydrophobicContact CG1-CG2 3.94Å; V153-V157 WeakPolarHBondContact O-CB 3.36Å; V153-V157 VanDerWaalsContact O-CG2 3.26Å; V153-V157 WeakPolarHBondContact O-CG2 3.16Å; V153-V157 PolarHBondContact O-N 3.19Å; V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 3.2Å; V157-V160 PolarHBondContact O-N 3.27Å; V157-V160 VanDerWaalsContact O-N 3.14Å; V157-L161 HydrophobicContact CG1-CD1 3.7Å; V157-L161 HydrophobicContact CG1-CD2 4.4Å; V157-L161 HydrophobicContact CG1-CG 3.77Å; V157-L161 WeakPolarHBondContact O-CB 3.47Å; V157-L161 VanDerWaalsContact O-CG 3.23Å; V157-L161 WeakPolarHBondContact O-CG 3.42Å; V157-L161 PolarHBondContact O-N 3.09Å; V157-F170 HydrophobicContact CG1-CE2 4.41Å; V157-F170 HydrophobicContact CG1-CZ 4.19Å; V157-F170 HydrophobicContact CG2-CE1 4.2Å; V157-F170 HydrophobicContact CG2-CZ 4.37Å; V157-F186 HydrophobicContact CG1-CE1 3.92Å; V157-F186 HydrophobicContact CG1-CZ 3.84Å; V157-F186 HydrophobicContact CG2-CZ 3.98Å; V157-W189 HydrophobicContact CG1-CZ3 3.85Å
158	K	97.1	Very high	95.2	Very high	21 Å²	21	28.5 Å²	28.5	9%	0.091	13%	0.132	C	C	.	.	H	α-helix	trans	-55.4	-44.1	175.9	-71.9	170.5	-180	-172	0	112.4	V154 T155 L156 V160 L161 F162 W189 F404 L405 Y407 L412	V154-K158 HydrophobicContact CG1-CD 4.25Å; V154-K158 VanDerWaalsContact O-CG 3.27Å; V154-K158 WeakPolarHBondContact O-CG 3.31Å; V154-K158 PolarHBondContact O-N 3.18Å; T155-K158 PolarHBondContact O-N 3.14Å; L156-K158 VanDerWaalsContact C-N 3.33Å; L156-K158 PolarHBondContact O-N 3.47Å; K158-V160 PolarHBondContact O-N 2.91Å; K158-L161 PolarHBondContact O-N 3Å; K158-F162 VanDerWaalsContact O-CB 3.24Å; K158-F162 WeakPolarHBondContact O-CB 3.37Å; K158-F162 PolarHBondContact O-N 3.36Å; K158-W189 HydrophobicContact CD-CH2 4.15Å; K158-W189 HydrophobicContact CD-CZ2 4.4Å; K158-W189 HydrophobicContact CG-CH2 3.49Å; K158-W189 VanDerWaalsContact CG-CH2 3.49Å; K158-W189 HydrophobicContact CG-CZ2 4.15Å; K158-W189 HydrophobicContact CG-CZ3 4.17Å; K158-F404 HydrophobicContact CB-CB 4.31Å; K158-F404 HydrophobicContact CB-CD1 4.39Å; K158-F404 WeakPolarHBondContact CD-O 3.35Å; K158-F404 PolarHBondContact NZ-O 3.37Å; K158-L405 PolarHBondContact NZ-O 2.92Å; K158-Y407 WeakPolarHBondContact CE-O 3.37Å; K158-Y407 PolarHBondContact NZ-O 3.43Å; K158-L412 HydrophobicContact CG-CD1 4.31Å
159	S	97.5	Very high	95.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-41.6	178.1	74.7	0	0	0	0	112.7	T155 L156 V157 H163 F247 F404	T155-S159 PolarHBondContact O-N 3.34Å; T155-S159 VanDerWaalsContact O-N 3.09Å; L156-S159 PolarHBondContact O-N 3.11Å; L156-S159 PolarHBondContact O-OG 3.21Å; V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 3.2Å; S159-H163 PolarHBondContact O-CD2 3.29Å; S159-F247 PolarHBondContact OG-N 3.4Å; S159-F404 VanDerWaalsContact CB-CE2 3.49Å
160	V	97.8	Very high	96	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-66	-48.9	175.7	174.6	0	0	0	0	110.7	L156 V157 K158 F162 H163 R164 L168 F170 F247 I251	L156-V160 HydrophobicContact CD1-CG2 3.93Å; L156-V160 PolarHBondContact O-N 3.4Å; V157-V160 PolarHBondContact O-N 3.27Å; V157-V160 VanDerWaalsContact O-N 3.14Å; K158-V160 PolarHBondContact O-N 2.91Å; V160-F162 VanDerWaalsContact C-N 3.27Å; V160-F162 PolarHBondContact O-N 3.25Å; V160-H163 PolarHBondContact O-N 3.41Å; V160-R164 PolarHBondContact O-N 3.16Å; V160-L168 HydrophobicContact CG1-CD1 3.69Å; V160-F170 HydrophobicContact CG1-CZ 4.41Å; V160-F247 HydrophobicContact CG2-CB 4.27Å; V160-F247 HydrophobicContact CG2-CD2 3.45Å; V160-F247 VanDerWaalsContact CG2-CD2 3.45Å; V160-F247 HydrophobicContact CG2-CE2 3.87Å; V160-F247 HydrophobicContact CG2-CG 3.83Å; V160-I251 HydrophobicContact CG1-CB 4.33Å; V160-I251 HydrophobicContact CG1-CD1 4.19Å; V160-I251 HydrophobicContact CG1-CG2 4.01Å
161	L	96.1	Very high	96.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65	-30.9	-177.8	-63.3	-165.9	0	0	0	112.6	V157 K158 H163 R164 L168 F170 W189 V191 V194 L412	V157-L161 HydrophobicContact CG1-CD1 3.7Å; V157-L161 HydrophobicContact CG1-CD2 4.4Å; V157-L161 HydrophobicContact CG1-CG 3.77Å; V157-L161 WeakPolarHBondContact O-CB 3.47Å; V157-L161 VanDerWaalsContact O-CG 3.23Å; V157-L161 WeakPolarHBondContact O-CG 3.42Å; V157-L161 PolarHBondContact O-N 3.09Å; K158-L161 PolarHBondContact O-N 3Å; L161-H163 VanDerWaalsContact C-N 3.33Å; L161-R164 VanDerWaalsContact CD2-NH1 3.27Å; L161-R164 WeakPolarHBondContact O-CG 3.47Å; L161-L168 HydrophobicContact CD2-CD1 3.43Å; L161-L168 VanDerWaalsContact CD2-CD1 3.43Å; L161-F170 HydrophobicContact CD2-CE2 3.98Å; L161-F170 HydrophobicContact CD2-CZ 4.06Å; L161-W189 HydrophobicContact CD1-CE3 4.28Å; L161-W189 HydrophobicContact CD1-CZ3 4.23Å; L161-V191 HydrophobicContact CD1-CG1 4.29Å; L161-V191 HydrophobicContact CD1-CG2 4.1Å; L161-V194 HydrophobicContact CD2-CG2 4.1Å; L161-L412 HydrophobicContact CB-CD1 4Å; L161-L412 HydrophobicContact CB-CD2 4.04Å; L161-L412 HydrophobicContact CD1-CD1 3.8Å; L161-L412 HydrophobicContact CG-CD1 4.47Å
162	F	94.6	Very high	96.6	Very high	99 Å²	99	21.6 Å²	21.6	43%	0.434	10%	0.095	S	C	.	.	H	α-helix	trans	-65.4	-36.8	176.5	180	-94.5	0	0	0	112.4	K158 V160 F404 Y407	K158-F162 VanDerWaalsContact O-CB 3.24Å; K158-F162 WeakPolarHBondContact O-CB 3.37Å; K158-F162 PolarHBondContact O-N 3.36Å; V160-F162 VanDerWaalsContact C-N 3.27Å; V160-F162 PolarHBondContact O-N 3.25Å; F162-F404 HydrophobicContact CB-CD1 4.46Å; F162-F404 HydrophobicContact CB-CE1 3.59Å; F162-F404 HydrophobicContact CB-CZ 4.26Å; F162-F404 AromaticContact CD1-CE1 3.88Å; F162-F404 HydrophobicContact CD1-CE1 3.88Å; F162-F404 AromaticContact CD1-CZ 3.98Å; F162-F404 HydrophobicContact CD1-CZ 3.98Å; F162-F404 HydrophobicContact CD2-CE1 4.23Å; F162-F404 AromaticContact CG-CE1 3.64Å; F162-F404 HydrophobicContact CG-CE1 3.64Å; F162-F404 HydrophobicContact CG-CZ 4.21Å; F162-Y407 HydrophobicContact CD2-CD2 4.43Å; F162-Y407 AromaticContact CD2-CE2 3.66Å; F162-Y407 HydrophobicContact CD2-CE2 3.66Å; F162-Y407 AromaticContact CD2-CZ 3.85Å; F162-Y407 AromaticContact CE2-CE2 3.85Å; F162-Y407 HydrophobicContact CE2-CE2 3.85Å
163	H	93.9	Very high	96.8	Very high	47 Å²	47	20.3 Å²	20.3	22%	0.218	9%	0.088	C	C	.	.	H	α-helix	trans	-96.5	-12.3	-176.5	-69.1	-68.8	0	0	0	114.7	S159 V160 L161 A248 T249 D250 F404	S159-H163 PolarHBondContact O-CD2 3.29Å; V160-H163 PolarHBondContact O-N 3.41Å; L161-H163 VanDerWaalsContact C-N 3.33Å; H163-A248 PolarHBondContact CE1-O 3.27Å; H163-T249 VanDerWaalsContact CB-C 3.47Å; H163-T249 WeakPolarHBondContact CB-O 3.39Å; H163-D250 WeakPolarHBondContact O-CB 2.93Å; H163-F404 AromaticContact NE2-CZ 3.87Å
164	R	93.9	Very high	96.9	Very high	8 Å²	8	20.3 Å²	20.3	3%	0.03	9%	0.088	C	C	.	.			trans	-61.3	149.8	-171	77.5	177.1	179.2	-146.5	-7.9	113.4	V160 L161 L168 V191 F417	V160-R164 PolarHBondContact O-N 3.16Å; L161-R164 VanDerWaalsContact CD2-NH1 3.27Å; L161-R164 WeakPolarHBondContact O-CG 3.47Å; R164-L168 HydrophobicContact CB-CD1 4.19Å; R164-V191 VanDerWaalsContact CZ-CG1 3.43Å; R164-F417 HydrophobicContact CG-CE1 4.13Å
165	R	93.3	Very high	96.9	Very high	179 Å²	179	20 Å²	20	68%	0.675	9%	0.086	S	C	*	.			trans	-128.2	3.6	167.2	-60.7	177.8	179.4	179.7	-0.3	114.3	D250 F417	R165-D250 VanDerWaalsContact CB-OD2 3.26Å; R165-D250 WeakPolarHBondContact CB-OD2 3.13Å; R165-D250 VanDerWaalsContact CD-OD2 3.31Å; R165-D250 WeakPolarHBondContact CD-OD2 3.29Å; R165-D250 WeakPolarHBondContact CG-OD2 3.31Å; R165-D250 PolarHBondContact N-OD2 3.23Å; R165-F417 VanDerWaalsContact C-CE1 3.44Å; R165-F417 WeakPolarHBondContact O-CD1 3.41Å
166	N	95.9	Very high	96.9	Very high	6 Å²	6	23.6 Å²	23.6	3%	0.032	11%	0.111	C	C	.	.	S	Bend	trans	-130.3	155	-175.3	-65.2	79.2	0	0	0	110.7	E133 K134 I138 A252 F417	E133-N166 PolarHBondContact O-ND2 3.09Å; K134-N166 PolarHBondContact O-ND2 3.38Å; I138-N166 HydrophobicContact CD1-CB 3.71Å; I138-N166 HydrophobicContact CG1-CB 4.1Å; N166-A252 VanDerWaalsContact OD1-CB 3.27Å; N166-A252 WeakPolarHBondContact OD1-CB 3.4Å; N166-F417 VanDerWaalsContact O-CZ 3.24Å; N166-F417 WeakPolarHBondContact O-CZ 3.46Å
167	P	97.1	Very high	96.7	Very high	13 Å²	13	26.1 Å²	26.1	8%	0.084	12%	0.124	C	C	.	.			trans	-54.5	142.7	168.2	-22.2	31.7	0	0	0	111.4	K134 T137 I138 A193 F417 C419	K134-P167 WeakPolarHBondContact O-CD 3.27Å; T137-P167 WeakPolarHBondContact CA-O 3.45Å; I138-P167 PolarHBondContact N-O 3.33Å; P167-A193 WeakPolarHBondContact CA-O 3.48Å; P167-A193 HydrophobicContact CB-CB 4.11Å; P167-A193 HydrophobicContact CG-CB 4.35Å; P167-F417 HydrophobicContact CG-CE2 3.98Å; P167-C419 HydrophobicContact CG-CB 4.47Å
168	L	98	Very high	96.7	Very high	2 Å²	2	26 Å²	26	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.5	-180	-60.8	179.1	0	0	0	110.9	I138 V160 L161 R164 F170 A193 V194 R195 I251	I138-L168 HydrophobicContact CB-CD2 3.75Å; I138-L168 HydrophobicContact CD1-CD2 4.42Å; I138-L168 HydrophobicContact CG2-CD2 4.16Å; I138-L168 WeakPolarHBondContact O-CA 3.28Å; V160-L168 HydrophobicContact CG1-CD1 3.69Å; L161-L168 HydrophobicContact CD2-CD1 3.43Å; L161-L168 VanDerWaalsContact CD2-CD1 3.43Å; R164-L168 HydrophobicContact CB-CD1 4.19Å; L168-F170 HydrophobicContact CB-CE2 3.98Å; L168-F170 HydrophobicContact CB-CZ 4.42Å; L168-F170 HydrophobicContact CD1-CE2 4.03Å; L168-F170 HydrophobicContact CD1-CZ 3.86Å; L168-A193 PolarHBondContact N-O 2.68Å; L168-V194 CarbonylContact O-C 3.2Å; L168-V194 WeakPolarHBondContact O-CA 3.3Å; L168-R195 PolarHBondContact O-N 3.17Å; L168-I251 HydrophobicContact CD2-CG2 3.92Å
169	H	98.7	Very high	96.7	Very high	19 Å²	19	28.6 Å²	28.6	9%	0.088	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	111.5	167.9	-169.4	172.8	0	0	0	109.6	T137 I138 H139 V140 H171 R195 D197	T137-H169 HydrophobicContact CG2-CB 3.67Å; I138-H169 PolarHBondContact O-N 3.25Å; H139-H169 WeakPolarHBondContact CA-O 3.32Å; H139-H169 AromaticContact CE1-ND1 3.63Å; H139-H169 AromaticContact ND1-CG 3.88Å; H139-H169 AromaticContact ND1-ND1 3.73Å; V140-H169 PolarHBondContact N-O 2.71Å; H169-H171 AromaticContact CD2-CE1 3.89Å; H169-H171 AromaticContact CE1-CE1 3.4Å; H169-H171 PolarHBondContact CE1-CE1 3.34Å; H169-H171 AromaticContact CE1-NE2 3.97Å; H169-H171 AromaticContact CG-CE1 3.93Å; H169-H171 AromaticContact CG-NE2 3.78Å; H169-H171 AromaticContact ND1-CE1 3.62Å; H169-H171 AromaticContact ND1-NE2 3.73Å; H169-H171 AromaticContact NE2-CE1 3.58Å; H169-H171 AromaticContact NE2-ND1 3.97Å; H169-R195 WeakPolarHBondContact CA-O 3.34Å; H169-R195 HydrophobicContact CB-CB 4.36Å; H169-D197 IonicContact CE1-OD2 3.34Å; H169-D197 PolarHBondContact CE1-OD2 3.27Å; H169-D197 VanDerWaalsContact NE2-CG 3.26Å; H169-D197 IonicContact NE2-OD1 3.63Å; H169-D197 IonicContact NE2-OD2 2.62Å; H169-D197 PolarHBondContact NE2-OD2 2.91Å; H169-D197 VanDerWaalsContact NE2-OD2 3.08Å
170	F	98.8	Very high	96.6	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.7	174.8	-66.3	-80.1	0	0	0	111.1	V140 I142 V157 V160 L161 L168 L172 F186 V194 R195 V196 D197	V140-F170 HydrophobicContact CB-CD1 3.87Å; V140-F170 HydrophobicContact CB-CE1 4.07Å; V140-F170 HydrophobicContact CG1-CD1 4.06Å; V140-F170 HydrophobicContact CG1-CE1 4.1Å; V140-F170 HydrophobicContact CG2-CE1 4.39Å; V140-F170 CarbonylContact O-C 3.6Å; V140-F170 WeakPolarHBondContact O-CA 3.44Å; I142-F170 HydrophobicContact CD1-CD1 4.28Å; V157-F170 HydrophobicContact CG1-CE2 4.41Å; V157-F170 HydrophobicContact CG1-CZ 4.19Å; V157-F170 HydrophobicContact CG2-CE1 4.2Å; V157-F170 HydrophobicContact CG2-CZ 4.37Å; V160-F170 HydrophobicContact CG1-CZ 4.41Å; L161-F170 HydrophobicContact CD2-CE2 3.98Å; L161-F170 HydrophobicContact CD2-CZ 4.06Å; L168-F170 HydrophobicContact CB-CE2 3.98Å; L168-F170 HydrophobicContact CB-CZ 4.42Å; L168-F170 HydrophobicContact CD1-CE2 4.03Å; L168-F170 HydrophobicContact CD1-CZ 3.86Å; F170-L172 HydrophobicContact CB-CD2 4.39Å; F170-L172 HydrophobicContact CB-CG 4.45Å; F170-F186 AromaticContact CD2-CE1 3.96Å; F170-F186 HydrophobicContact CD2-CE1 3.96Å; F170-F186 HydrophobicContact CD2-CZ 4.01Å; F170-F186 HydrophobicContact CE2-CE1 4.19Å; F170-F186 HydrophobicContact CE2-CZ 4.39Å; F170-F186 HydrophobicContact CG-CZ 4.31Å; F170-V194 HydrophobicContact CD2-CG1 3.82Å; F170-V194 HydrophobicContact CE2-CG1 3.89Å; F170-R195 PolarHBondContact N-O 3.01Å; F170-V196 HydrophobicContact CB-CB 4.46Å; F170-V196 HydrophobicContact CB-CG2 4Å; F170-V196 CarbonylContact O-C 3.5Å; F170-V196 VanDerWaalsContact O-CA 3.29Å; F170-V196 WeakPolarHBondContact O-CA 3.43Å; F170-D197 PolarHBondContact O-N 3.27Å
171	H	98.9	Very high	96.4	Very high	3 Å²	3	38 Å²	38	1%	0.014	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	110.5	173.4	-63.4	-76.7	0	0	0	108.9	H139 V140 A141 I142 H169 Y199 L231	H139-H171 AromaticContact CE1-NE2 3.92Å; H139-H171 AromaticContact CG-NE2 3.85Å; H139-H171 AromaticContact ND1-CD2 3.9Å; H139-H171 AromaticContact ND1-CE1 3.94Å; H139-H171 AromaticContact ND1-NE2 2.94Å; H139-H171 PolarHBondContact ND1-NE2 3.28Å; V140-H171 PolarHBondContact O-N 3.11Å; A141-H171 CarbonylContact C-O 3.54Å; A141-H171 VanDerWaalsContact CA-O 3.26Å; A141-H171 WeakPolarHBondContact CA-O 3.33Å; A141-H171 HydrophobicContact CB-CB 4.29Å; I142-H171 PolarHBondContact N-O 3.2Å; H169-H171 AromaticContact CD2-CE1 3.89Å; H169-H171 AromaticContact CE1-CE1 3.4Å; H169-H171 PolarHBondContact CE1-CE1 3.34Å; H169-H171 AromaticContact CE1-NE2 3.97Å; H169-H171 AromaticContact CG-CE1 3.93Å; H169-H171 AromaticContact CG-NE2 3.78Å; H169-H171 AromaticContact ND1-CE1 3.62Å; H169-H171 AromaticContact ND1-NE2 3.73Å; H169-H171 AromaticContact NE2-CE1 3.58Å; H169-H171 AromaticContact NE2-ND1 3.97Å; H171-Y199 HydrophobicContact CB-CE2 3.73Å; H171-Y199 AromaticContact ND1-CE2 3.78Å; H171-Y199 AromaticContact ND1-CZ 3.83Å; H171-Y199 PolarHBondContact ND1-OH 2.94Å; H171-L231 HydrophobicContact CB-CD2 3.52Å
172	L	98.8	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	110.1	-170.3	-58.4	-178.7	0	0	0	110.6	I142 F170 A174 L182 F186 V196 D197 F198 Y199	I142-L172 HydrophobicContact CB-CD2 3.74Å; I142-L172 HydrophobicContact CD1-CD2 4.09Å; I142-L172 HydrophobicContact CG1-CD2 4.2Å; I142-L172 WeakPolarHBondContact O-CA 3.31Å; F170-L172 HydrophobicContact CB-CD2 4.39Å; F170-L172 HydrophobicContact CB-CG 4.45Å; L172-A174 PolarHBondContact O-N 2.05Å; L172-L182 HydrophobicContact CD1-CB 4.34Å; L172-L182 HydrophobicContact CD1-CD1 3.92Å; L172-F186 HydrophobicContact CD1-CE2 4.09Å; L172-V196 HydrophobicContact CD1-CG2 3.48Å; L172-V196 VanDerWaalsContact CD1-CG2 3.48Å; L172-V196 HydrophobicContact CG-CG2 3.94Å; L172-D197 PolarHBondContact N-O 3.32Å; L172-F198 HydrophobicContact CB-CD1 3.81Å; L172-F198 HydrophobicContact CB-CE1 3.99Å; L172-F198 HydrophobicContact CD1-CD1 4.13Å; L172-F198 HydrophobicContact CD1-CE1 3.44Å; L172-F198 VanDerWaalsContact CD1-CE1 3.44Å; L172-F198 HydrophobicContact CD1-CZ 3.78Å; L172-F198 HydrophobicContact CG-CE1 4.32Å; L172-F198 CarbonylContact O-C 3.21Å; L172-F198 WeakPolarHBondContact O-CA 3.43Å; L172-Y199 PolarHBondContact O-N 2.83Å
173	I	98.6	Very high	96.6	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	109.9	164.3	-64.1	176.8	0	0	0	106.9	I142 V143 C144 Y199 A201 L204 M223 L227 T230	I142-I173 PolarHBondContact O-N 2.79Å; V143-I173 WeakPolarHBondContact CA-O 3.23Å; V143-I173 HydrophobicContact CG1-CG2 4.4Å; V143-I173 HydrophobicContact CG2-CB 4.22Å; V143-I173 HydrophobicContact CG2-CD1 4.32Å; C144-I173 PolarHBondContact N-O 3.24Å; I173-Y199 CarbonylContact C-O 3.6Å; I173-Y199 WeakPolarHBondContact CA-O 3.31Å; I173-A201 HydrophobicContact CG2-CB 3.84Å; I173-L204 HydrophobicContact CD1-CD1 3.98Å; I173-L204 HydrophobicContact CG1-CD1 4.22Å; I173-L204 HydrophobicContact CG2-CD1 3.92Å; I173-M223 HydrophobicContact CG2-SD 3.87Å; I173-L227 HydrophobicContact CD1-CD2 3.6Å; I173-L227 HydrophobicContact CD1-CG 4.44Å; I173-L227 HydrophobicContact CG1-CD2 4.43Å; I173-T230 HydrophobicContact CD1-CG2 4.06Å; I173-T230 HydrophobicContact CG1-CG2 4.14Å
174	A	98.2	Very high	96.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.6	-168.9	0	0	0	0	0	113.2	C144 L172 A178 E179 F198 Y199 A201	C144-A174 VanDerWaalsContact O-CA 3.25Å; C144-A174 WeakPolarHBondContact O-CA 3.47Å; L172-A174 PolarHBondContact O-N 2.05Å; A174-A178 HydrophobicContact CB-CB 4.12Å; A174-E179 HydrophobicContact CB-CB 4.14Å; A174-F198 HydrophobicContact CB-CD1 4.05Å; A174-Y199 PolarHBondContact N-O 3.23Å; A174-A201 VanDerWaalsContact O-CB 3.3Å; A174-A201 WeakPolarHBondContact O-CB 3.34Å; A174-A201 PolarHBondContact O-N 2.63Å
175	D	96.6	Very high	96.6	Very high	16 Å²	16	36.9 Å²	36.9	9%	0.086	19%	0.189	C	C	.	.			trans	-77.4	166.5	161.5	70.2	-6.2	0	0	0	110.3	A145 G146 I177 A178 E179 Y220	A145-D175 WeakPolarHBondContact CA-OD1 3.32Å; A145-D175 HydrophobicContact CB-CB 4.31Å; G146-D175 VanDerWaalsContact N-CG 3.32Å; G146-D175 PolarHBondContact N-OD1 3.24Å; G146-D175 PolarHBondContact N-OD2 2.98Å; D175-I177 PolarHBondContact O-N 3.38Å; D175-I177 VanDerWaalsContact O-N 3.13Å; D175-A178 PolarHBondContact O-N 3.05Å; D175-A178 VanDerWaalsContact O-N 3.12Å; D175-A178 WeakPolarHBondContact OD1-CB 2.99Å; D175-A178 PolarHBondContact OD1-N 3Å; D175-E179 WeakPolarHBondContact O-CB 3.44Å; D175-E179 PolarHBondContact O-N 2.69Å; D175-Y220 HydrophobicContact CB-CE1 4.48Å
176	S	95.9	Very high	96.6	Very high	76 Å²	76	29.1 Å²	29.1	53%	0.531	16%	0.16	S	C	.	.	H	α-helix	trans	-56.3	-33.3	-176.5	56.3	0	0	0	0	113.4	Q180	S176-Q180 WeakPolarHBondContact O-CB 3.27Å; S176-Q180 PolarHBondContact O-N 3.44Å; S176-Q180 VanDerWaalsContact O-N 3.08Å
177	I	94.2	Very high	96.5	Very high	54 Å²	54	34.6 Å²	34.6	28%	0.277	19%	0.185	S	C	.	.	H	α-helix	trans	-66.3	-53.8	176.8	-62.4	172.3	0	0	0	110.4	Y147 D175 E179 Q180 I181	Y147-I177 HydrophobicContact CD1-CG2 3.89Å; Y147-I177 HydrophobicContact CD2-CG2 3.95Å; Y147-I177 HydrophobicContact CE1-CG2 3.63Å; Y147-I177 HydrophobicContact CE2-CD1 4.01Å; Y147-I177 HydrophobicContact CE2-CG2 3.7Å; Y147-I177 HydrophobicContact CG-CG2 4.03Å; D175-I177 PolarHBondContact O-N 3.38Å; D175-I177 VanDerWaalsContact O-N 3.13Å; I177-E179 VanDerWaalsContact C-N 3.35Å; I177-Q180 PolarHBondContact O-N 2.62Å; I177-I181 HydrophobicContact CG2-CD1 3.86Å; I177-I181 WeakPolarHBondContact O-CD1 3.41Å; I177-I181 VanDerWaalsContact O-CG1 3.29Å; I177-I181 WeakPolarHBondContact O-CG1 3.36Å; I177-I181 PolarHBondContact O-N 3.42Å; I177-I181 VanDerWaalsContact O-N 3.16Å
178	A	96.7	Very high	96.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-39.4	-178.8	0	0	0	0	0	111.8	C144 S150 A174 D175 I181 L182	C144-A178 WeakPolarHBondContact O-CB 3.2Å; S150-A178 WeakPolarHBondContact OG-CA 3.5Å; S150-A178 WeakPolarHBondContact OG-CB 3.47Å; A174-A178 HydrophobicContact CB-CB 4.12Å; D175-A178 PolarHBondContact O-N 3.05Å; D175-A178 VanDerWaalsContact O-N 3.12Å; D175-A178 WeakPolarHBondContact OD1-CB 2.99Å; D175-A178 PolarHBondContact OD1-N 3Å; A178-I181 PolarHBondContact O-N 2.82Å; A178-L182 VanDerWaalsContact O-CB 3.29Å; A178-L182 WeakPolarHBondContact O-CB 3.46Å; A178-L182 VanDerWaalsContact O-CG 3.25Å; A178-L182 WeakPolarHBondContact O-CG 3.39Å; A178-L182 PolarHBondContact O-N 2.96Å
179	E	97.4	Very high	95.9	Very high	75 Å²	75	38.3 Å²	38.3	35%	0.35	21%	0.205	S	C	.	.	H	α-helix	trans	-58.4	-51.1	175.3	179.8	174.3	160.5	0	0	111	A174 D175 I177 I181 L182 A183 F198	A174-E179 HydrophobicContact CB-CB 4.14Å; D175-E179 WeakPolarHBondContact O-CB 3.44Å; D175-E179 PolarHBondContact O-N 2.69Å; I177-E179 VanDerWaalsContact C-N 3.35Å; E179-I181 VanDerWaalsContact C-N 3.32Å; E179-I181 PolarHBondContact O-N 3.43Å; E179-L182 PolarHBondContact O-N 3.09Å; E179-A183 WeakPolarHBondContact O-CB 3.26Å; E179-A183 PolarHBondContact O-N 2.9Å; E179-F198 HydrophobicContact CB-CD1 4.01Å; E179-F198 HydrophobicContact CB-CE1 4.34Å; E179-F198 HydrophobicContact CG-CB 4.13Å; E179-F198 HydrophobicContact CG-CD1 3.72Å; E179-F198 HydrophobicContact CG-CD2 4.34Å; E179-F198 HydrophobicContact CG-CE1 4.18Å; E179-F198 HydrophobicContact CG-CG 3.81Å
180	Q	95.3	Very high	95.5	Very high	141 Å²	141	43.4 Å²	43.4	66%	0.659	23%	0.231	S	C	*	.	H	α-helix	trans	-58.5	-44.5	179.9	-175.4	178.8	-2	0	0	112.2	S176 I177 T184	S176-Q180 WeakPolarHBondContact O-CB 3.27Å; S176-Q180 PolarHBondContact O-N 3.44Å; S176-Q180 VanDerWaalsContact O-N 3.08Å; I177-Q180 PolarHBondContact O-N 2.62Å; Q180-T184 WeakPolarHBondContact O-CB 3.32Å; Q180-T184 PolarHBondContact O-N 2.91Å; Q180-T184 PolarHBondContact O-OG1 2.97Å
181	I	94.6	Very high	95.2	Very high	56 Å²	56	44 Å²	44	29%	0.287	23%	0.234	S	C	.	.	H	α-helix	trans	-64.6	-52.7	179.9	-67	165.2	0	0	0	110.5	Y147 I177 A178 E179 T184 L185	Y147-I181 HydrophobicContact CD1-CD1 3.54Å; Y147-I181 HydrophobicContact CE1-CD1 3.86Å; Y147-I181 HydrophobicContact CG-CD1 4.46Å; I177-I181 HydrophobicContact CG2-CD1 3.86Å; I177-I181 WeakPolarHBondContact O-CD1 3.41Å; I177-I181 VanDerWaalsContact O-CG1 3.29Å; I177-I181 WeakPolarHBondContact O-CG1 3.36Å; I177-I181 PolarHBondContact O-N 3.42Å; I177-I181 VanDerWaalsContact O-N 3.16Å; A178-I181 PolarHBondContact O-N 2.82Å; E179-I181 VanDerWaalsContact C-N 3.32Å; E179-I181 PolarHBondContact O-N 3.43Å; I181-T184 PolarHBondContact O-N 2.76Å; I181-L185 WeakPolarHBondContact O-CB 3.45Å; I181-L185 PolarHBondContact O-N 2.77Å
182	L	96.4	Very high	94.9	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-72.4	-37.8	-173.1	-65.2	175.1	0	0	0	111.3	C144 V153 V154 L172 A178 E179 T184 L185 F186 F198	C144-L182 HydrophobicContact CB-CD1 4.37Å; V153-L182 HydrophobicContact CB-CD2 4.45Å; V153-L182 HydrophobicContact CG1-CD1 4.13Å; V153-L182 HydrophobicContact CG1-CD2 4.05Å; V154-L182 HydrophobicContact CG2-CD2 4.05Å; L172-L182 HydrophobicContact CD1-CB 4.34Å; L172-L182 HydrophobicContact CD1-CD1 3.92Å; A178-L182 VanDerWaalsContact O-CB 3.29Å; A178-L182 WeakPolarHBondContact O-CB 3.46Å; A178-L182 VanDerWaalsContact O-CG 3.25Å; A178-L182 WeakPolarHBondContact O-CG 3.39Å; A178-L182 PolarHBondContact O-N 2.96Å; E179-L182 PolarHBondContact O-N 3.09Å; L182-T184 PolarHBondContact O-N 2.91Å; L182-L185 PolarHBondContact O-N 3.44Å; L182-F186 HydrophobicContact CB-CD2 4.43Å; L182-F186 VanDerWaalsContact O-CD2 3.23Å; L182-F186 WeakPolarHBondContact O-CD2 3.43Å; L182-F186 PolarHBondContact O-N 3.43Å; L182-F198 HydrophobicContact CB-CE1 3.88Å; L182-F198 HydrophobicContact CB-CZ 3.88Å
183	A	96.8	Very high	94.6	Very high	33 Å²	33	48 Å²	48	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-60.3	-47.2	174.8	0	0	0	0	0	111	E179 L185 F186 Q187 F198	E179-A183 WeakPolarHBondContact O-CB 3.26Å; E179-A183 PolarHBondContact O-N 2.9Å; A183-L185 VanDerWaalsContact C-N 3.28Å; A183-L185 PolarHBondContact O-N 2.78Å; A183-F186 PolarHBondContact O-N 2.87Å; A183-Q187 WeakPolarHBondContact O-CB 3.43Å; A183-Q187 PolarHBondContact O-N 2.9Å; A183-F198 HydrophobicContact CB-CE2 3.9Å; A183-F198 HydrophobicContact CB-CZ 4.01Å
184	T	94.6	Very high	94.5	Very high	70 Å²	70	49.3 Å²	49.3	43%	0.429	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-42.7	175.1	-56.5	0	0	0	0	111	Q180 I181 L182 T188	Q180-T184 WeakPolarHBondContact O-CB 3.32Å; Q180-T184 PolarHBondContact O-N 2.91Å; Q180-T184 PolarHBondContact O-OG1 2.97Å; I181-T184 PolarHBondContact O-N 2.76Å; L182-T184 PolarHBondContact O-N 2.91Å; T184-T188 HydrophobicContact CG2-CG2 4.34Å; T184-T188 VanDerWaalsContact O-CB 3.32Å; T184-T188 WeakPolarHBondContact O-CB 3.5Å; T184-T188 WeakPolarHBondContact O-CG2 3.33Å; T184-T188 PolarHBondContact O-N 2.88Å; T184-T188 PolarHBondContact O-OG1 2.79Å
185	L	93.2	Very high	94.4	Very high	28 Å²	28	55 Å²	55	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-67.6	-48.2	-179.2	178.5	139.7	0	0	0	112.8	V154 I181 L182 A183 T188 W189	V154-L185 HydrophobicContact CB-CD1 4.31Å; V154-L185 HydrophobicContact CG1-CD1 3.93Å; V154-L185 HydrophobicContact CG2-CD1 3.36Å; V154-L185 HydrophobicContact CG2-CD2 4.38Å; V154-L185 HydrophobicContact CG2-CG 4.47Å; I181-L185 WeakPolarHBondContact O-CB 3.45Å; I181-L185 PolarHBondContact O-N 2.77Å; L182-L185 PolarHBondContact O-N 3.44Å; A183-L185 VanDerWaalsContact C-N 3.28Å; A183-L185 PolarHBondContact O-N 2.78Å; L185-T188 PolarHBondContact O-N 2.76Å; L185-T188 PolarHBondContact O-OG1 3.36Å; L185-T188 VanDerWaalsContact O-OG1 3.1Å; L185-W189 HydrophobicContact CD1-CH2 4.16Å; L185-W189 HydrophobicContact CD1-CZ2 3.6Å; L185-W189 HydrophobicContact CD2-CD2 3.73Å; L185-W189 HydrophobicContact CD2-CE3 3.68Å; L185-W189 HydrophobicContact CD2-CH2 3.58Å; L185-W189 HydrophobicContact CD2-CZ2 3.66Å; L185-W189 HydrophobicContact CD2-CZ3 3.6Å; L185-W189 HydrophobicContact CG-CD2 3.97Å; L185-W189 HydrophobicContact CG-CE3 4.42Å; L185-W189 HydrophobicContact CG-CG 4.46Å; L185-W189 HydrophobicContact CG-CH2 4.16Å; L185-W189 HydrophobicContact CG-CZ2 3.7Å; L185-W189 WeakPolarHBondContact O-CB 3.43Å; L185-W189 VanDerWaalsContact O-CG 3.25Å; L185-W189 PolarHBondContact O-N 3Å
186	F	94.1	Very high	94.5	Very high	16 Å²	16	56.1 Å²	56.1	7%	0.07	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-40.5	177.4	-81.4	-73.5	0	0	0	111.7	V157 F170 L172 L182 A183 M190 V194 V196	V157-F186 HydrophobicContact CG1-CE1 3.92Å; V157-F186 HydrophobicContact CG1-CZ 3.84Å; V157-F186 HydrophobicContact CG2-CZ 3.98Å; F170-F186 AromaticContact CD2-CE1 3.96Å; F170-F186 HydrophobicContact CD2-CE1 3.96Å; F170-F186 HydrophobicContact CD2-CZ 4.01Å; F170-F186 HydrophobicContact CE2-CE1 4.19Å; F170-F186 HydrophobicContact CE2-CZ 4.39Å; F170-F186 HydrophobicContact CG-CZ 4.31Å; L172-F186 HydrophobicContact CD1-CE2 4.09Å; L182-F186 HydrophobicContact CB-CD2 4.43Å; L182-F186 VanDerWaalsContact O-CD2 3.23Å; L182-F186 WeakPolarHBondContact O-CD2 3.43Å; L182-F186 PolarHBondContact O-N 3.43Å; A183-F186 PolarHBondContact O-N 2.87Å; F186-M190 PolarHBondContact O-N 3.48Å; F186-V194 HydrophobicContact CD1-CG1 4.16Å; F186-V194 HydrophobicContact CE1-CG1 4.03Å; F186-V196 HydrophobicContact CB-CG1 4.07Å; F186-V196 HydrophobicContact CD2-CB 4.36Å; F186-V196 HydrophobicContact CD2-CG1 4.27Å; F186-V196 HydrophobicContact CD2-CG2 4.06Å; F186-V196 HydrophobicContact CE2-CG2 4.09Å; F186-V196 HydrophobicContact CG-CB 4.4Å; F186-V196 HydrophobicContact CG-CG1 4.15Å
187	Q	92.9	Very high	94.7	Very high	120 Å²	120	55.8 Å²	55.8	56%	0.561	29%	0.294	S	S	*	.	H	α-helix	trans	-62.8	-42.5	175.8	-175	-177.9	15.6	0	0	111.6	A183 M190	A183-Q187 WeakPolarHBondContact O-CB 3.43Å; A183-Q187 PolarHBondContact O-N 2.9Å; Q187-M190 WeakPolarHBondContact O-CG 3.34Å
188	T	91.2	Very high	94.9	Very high	71 Å²	71	55.6 Å²	55.6	44%	0.436	29%	0.291	S	S	.	.	H	α-helix	trans	-77	-35.8	-179.8	53	0	0	0	0	112	T184 L185 M190 R413	T184-T188 HydrophobicContact CG2-CG2 4.34Å; T184-T188 VanDerWaalsContact O-CB 3.32Å; T184-T188 WeakPolarHBondContact O-CB 3.5Å; T184-T188 WeakPolarHBondContact O-CG2 3.33Å; T184-T188 PolarHBondContact O-N 2.88Å; T184-T188 PolarHBondContact O-OG1 2.79Å; L185-T188 PolarHBondContact O-N 2.76Å; L185-T188 PolarHBondContact O-OG1 3.36Å; L185-T188 VanDerWaalsContact O-OG1 3.1Å; T188-M190 VanDerWaalsContact C-N 3.28Å; T188-M190 PolarHBondContact O-N 2.8Å; T188-R413 PolarHBondContact O-NH2 3.05Å
189	W	91.9	Very high	95	Very high	22 Å²	22	57.6 Å²	57.6	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-33.6	175.2	-71.7	0.7	0	0	0	111.6	V154 V157 K158 L161 L185 V191 L412 R413	V154-W189 HydrophobicContact CG1-CH2 3.97Å; V154-W189 HydrophobicContact CG1-CZ2 4.03Å; V157-W189 HydrophobicContact CG1-CZ3 3.85Å; K158-W189 HydrophobicContact CD-CH2 4.15Å; K158-W189 HydrophobicContact CD-CZ2 4.4Å; K158-W189 HydrophobicContact CG-CH2 3.49Å; K158-W189 VanDerWaalsContact CG-CH2 3.49Å; K158-W189 HydrophobicContact CG-CZ2 4.15Å; K158-W189 HydrophobicContact CG-CZ3 4.17Å; L161-W189 HydrophobicContact CD1-CE3 4.28Å; L161-W189 HydrophobicContact CD1-CZ3 4.23Å; L185-W189 HydrophobicContact CD1-CH2 4.16Å; L185-W189 HydrophobicContact CD1-CZ2 3.6Å; L185-W189 HydrophobicContact CD2-CD2 3.73Å; L185-W189 HydrophobicContact CD2-CE3 3.68Å; L185-W189 HydrophobicContact CD2-CH2 3.58Å; L185-W189 HydrophobicContact CD2-CZ2 3.66Å; L185-W189 HydrophobicContact CD2-CZ3 3.6Å; L185-W189 HydrophobicContact CG-CD2 3.97Å; L185-W189 HydrophobicContact CG-CE3 4.42Å; L185-W189 HydrophobicContact CG-CG 4.46Å; L185-W189 HydrophobicContact CG-CH2 4.16Å; L185-W189 HydrophobicContact CG-CZ2 3.7Å; L185-W189 WeakPolarHBondContact O-CB 3.43Å; L185-W189 VanDerWaalsContact O-CG 3.25Å; L185-W189 PolarHBondContact O-N 3Å; W189-V191 VanDerWaalsContact C-N 3.27Å; W189-V191 HydrophobicContact CB-CG2 3.6Å; W189-V191 HydrophobicContact CE3-CG2 4.31Å; W189-V191 PolarHBondContact O-N 2.87Å; W189-L412 HydrophobicContact CE3-CD1 4.19Å; W189-L412 HydrophobicContact CZ3-CD1 4.14Å; W189-R413 WeakPolarHBondContact O-CD 3.09Å; W189-R413 WeakPolarHBondContact O-CG 3.39Å; W189-R413 PolarHBondContact O-NE 2.81Å
190	M	90.8	Very high	95	Very high	127 Å²	127	56.4 Å²	56.4	63%	0.626	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	49	178.8	-61.7	-171.1	-66.5	0	0	112.3	F186 Q187 T188 P192	F186-M190 PolarHBondContact O-N 3.48Å; Q187-M190 WeakPolarHBondContact O-CG 3.34Å; T188-M190 VanDerWaalsContact C-N 3.28Å; T188-M190 PolarHBondContact O-N 2.8Å; M190-P192 WeakPolarHBondContact O-CD 3.15Å
191	V	91.9	Very high	95.1	Very high	13 Å²	13	49.7 Å²	49.7	8%	0.079	26%	0.263	C	S	.	.			trans	-77.5	125.2	-174.1	-173	0	0	0	0	110.1	L161 R164 W189 V194 L412	L161-V191 HydrophobicContact CD1-CG1 4.29Å; L161-V191 HydrophobicContact CD1-CG2 4.1Å; R164-V191 VanDerWaalsContact CZ-CG1 3.43Å; W189-V191 VanDerWaalsContact C-N 3.27Å; W189-V191 HydrophobicContact CB-CG2 3.6Å; W189-V191 HydrophobicContact CE3-CG2 4.31Å; W189-V191 PolarHBondContact O-N 2.87Å; V191-V194 HydrophobicContact CB-CB 4.31Å; V191-V194 HydrophobicContact CB-CG2 4Å; V191-V194 HydrophobicContact CG1-CG2 3.78Å; V191-V194 PolarHBondContact O-N 3.05Å; V191-L412 HydrophobicContact CG1-CB 4.4Å; V191-L412 WeakPolarHBondContact CG1-O 3.45Å; V191-L412 HydrophobicContact CG2-CB 4.04Å
192	P	92.2	Very high	95.1	Very high	42 Å²	42	50.4 Å²	50.4	27%	0.273	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	147.3	178.1	-24.5	34.1	0	0	0	112.6	M190 V194 R413 E415	M190-P192 WeakPolarHBondContact O-CD 3.15Å; P192-V194 PolarHBondContact O-N 2.77Å; P192-R413 VanDerWaalsContact CD-O 3.26Å; P192-R413 WeakPolarHBondContact CD-O 3.35Å; P192-R413 VanDerWaalsContact CG-O 3.29Å; P192-R413 WeakPolarHBondContact CG-O 3.37Å; P192-E415 HydrophobicContact CB-CG 4.47Å; P192-E415 HydrophobicContact CG-CB 4.36Å
193	A	93.8	Very high	95.1	Very high	46 Å²	46	57 Å²	57	38%	0.38	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	30.4	178.2	0	0	0	0	0	114.4	P167 L168 F417	P167-A193 WeakPolarHBondContact CA-O 3.48Å; P167-A193 HydrophobicContact CB-CB 4.11Å; P167-A193 HydrophobicContact CG-CB 4.35Å; L168-A193 PolarHBondContact N-O 2.68Å; A193-F417 HydrophobicContact CB-CE2 3.98Å; A193-F417 HydrophobicContact CB-CZ 4.3Å
194	V	95.7	Very high	95.1	Very high	28 Å²	28	56.5 Å²	56.5	17%	0.17	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.7	171.6	178.1	0	0	0	0	109.6	L161 L168 F170 F186 V191 P192	L161-V194 HydrophobicContact CD2-CG2 4.1Å; L168-V194 CarbonylContact O-C 3.2Å; L168-V194 WeakPolarHBondContact O-CA 3.3Å; F170-V194 HydrophobicContact CD2-CG1 3.82Å; F170-V194 HydrophobicContact CE2-CG1 3.89Å; F186-V194 HydrophobicContact CD1-CG1 4.16Å; F186-V194 HydrophobicContact CE1-CG1 4.03Å; V191-V194 HydrophobicContact CB-CB 4.31Å; V191-V194 HydrophobicContact CB-CG2 4Å; V191-V194 HydrophobicContact CG1-CG2 3.78Å; V191-V194 PolarHBondContact O-N 3.05Å; P192-V194 PolarHBondContact O-N 2.77Å
195	R	97.3	Very high	95.2	Very high	120 Å²	120	56.4 Å²	56.4	45%	0.453	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	149.9	169.2	-65.5	-177.8	-175.4	165	0.5	109.8	L168 H169 F170 E422	L168-R195 PolarHBondContact O-N 3.17Å; H169-R195 WeakPolarHBondContact CA-O 3.34Å; H169-R195 HydrophobicContact CB-CB 4.36Å; F170-R195 PolarHBondContact N-O 3.01Å; R195-E422 IonicContact CZ-OE1 3.68Å; R195-E422 VanDerWaalsContact CZ-OE1 3.27Å; R195-E422 IonicContact NH1-OE1 3.28Å; R195-E422 PolarHBondContact NH1-OE1 3.47Å; R195-E422 IonicContact NH2-OE1 3.46Å; R195-E422 PolarHBondContact NH2-OE1 3Å; R195-E422 IonicContact NH2-OE2 2.59Å; R195-E422 PolarHBondContact NH2-OE2 3.07Å
196	V	98.3	Very high	95.4	Very high	40 Å²	40	58.9 Å²	58.9	24%	0.242	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.1	174.5	71.8	0	0	0	0	109.9	F170 L172 F186 F198	F170-V196 HydrophobicContact CB-CB 4.46Å; F170-V196 HydrophobicContact CB-CG2 4Å; F170-V196 CarbonylContact O-C 3.5Å; F170-V196 VanDerWaalsContact O-CA 3.29Å; F170-V196 WeakPolarHBondContact O-CA 3.43Å; L172-V196 HydrophobicContact CD1-CG2 3.48Å; L172-V196 VanDerWaalsContact CD1-CG2 3.48Å; L172-V196 HydrophobicContact CG-CG2 3.94Å; F186-V196 HydrophobicContact CB-CG1 4.07Å; F186-V196 HydrophobicContact CD2-CB 4.36Å; F186-V196 HydrophobicContact CD2-CG1 4.27Å; F186-V196 HydrophobicContact CD2-CG2 4.06Å; F186-V196 HydrophobicContact CE2-CG2 4.09Å; F186-V196 HydrophobicContact CG-CB 4.4Å; F186-V196 HydrophobicContact CG-CG1 4.15Å; V196-F198 HydrophobicContact CG1-CE2 3.86Å; V196-F198 HydrophobicContact CG1-CZ 4.5Å; V196-F198 HydrophobicContact CG2-CE2 3.91Å; V196-F198 HydrophobicContact CG2-CZ 4.01Å
197	D	98.6	Very high	95.5	Very high	69 Å²	69	59.7 Å²	59.7	37%	0.369	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	134.7	173.2	-77.1	-19.3	0	0	0	109	H169 F170 L172 Y199	H169-D197 IonicContact CE1-OD2 3.34Å; H169-D197 PolarHBondContact CE1-OD2 3.27Å; H169-D197 VanDerWaalsContact NE2-CG 3.26Å; H169-D197 IonicContact NE2-OD1 3.63Å; H169-D197 IonicContact NE2-OD2 2.62Å; H169-D197 PolarHBondContact NE2-OD2 2.91Å; H169-D197 VanDerWaalsContact NE2-OD2 3.08Å; F170-D197 PolarHBondContact O-N 3.27Å; L172-D197 PolarHBondContact N-O 3.32Å; D197-Y199 HydrophobicContact CB-CE2 4.05Å
198	F	98.6	Very high	95.8	Very high	50 Å²	50	54 Å²	54	22%	0.219	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.8	177.9	-67.8	-88.5	0	0	0	111.2	L172 A174 E179 L182 A183 V196	L172-F198 HydrophobicContact CB-CD1 3.81Å; L172-F198 HydrophobicContact CB-CE1 3.99Å; L172-F198 HydrophobicContact CD1-CD1 4.13Å; L172-F198 HydrophobicContact CD1-CE1 3.44Å; L172-F198 VanDerWaalsContact CD1-CE1 3.44Å; L172-F198 HydrophobicContact CD1-CZ 3.78Å; L172-F198 HydrophobicContact CG-CE1 4.32Å; L172-F198 CarbonylContact O-C 3.21Å; L172-F198 WeakPolarHBondContact O-CA 3.43Å; A174-F198 HydrophobicContact CB-CD1 4.05Å; E179-F198 HydrophobicContact CB-CD1 4.01Å; E179-F198 HydrophobicContact CB-CE1 4.34Å; E179-F198 HydrophobicContact CG-CB 4.13Å; E179-F198 HydrophobicContact CG-CD1 3.72Å; E179-F198 HydrophobicContact CG-CD2 4.34Å; E179-F198 HydrophobicContact CG-CE1 4.18Å; E179-F198 HydrophobicContact CG-CG 3.81Å; L182-F198 HydrophobicContact CB-CE1 3.88Å; L182-F198 HydrophobicContact CB-CZ 3.88Å; A183-F198 HydrophobicContact CB-CE2 3.9Å; A183-F198 HydrophobicContact CB-CZ 4.01Å; V196-F198 HydrophobicContact CG1-CE2 3.86Å; V196-F198 HydrophobicContact CG1-CZ 4.5Å; V196-F198 HydrophobicContact CG2-CE2 3.91Å; V196-F198 HydrophobicContact CG2-CZ 4.01Å
199	Y	98.4	Very high	96.1	Very high	41 Å²	41	54.1 Å²	54.1	16%	0.161	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.5	176.1	-53.7	-90.3	0	0	0	108.2	H171 L172 I173 A174 D197 A201 T230 L231 P232	H171-Y199 HydrophobicContact CB-CE2 3.73Å; H171-Y199 AromaticContact ND1-CE2 3.78Å; H171-Y199 AromaticContact ND1-CZ 3.83Å; H171-Y199 PolarHBondContact ND1-OH 2.94Å; L172-Y199 PolarHBondContact O-N 2.83Å; I173-Y199 CarbonylContact C-O 3.6Å; I173-Y199 WeakPolarHBondContact CA-O 3.31Å; A174-Y199 PolarHBondContact N-O 3.23Å; D197-Y199 HydrophobicContact CB-CE2 4.05Å; Y199-A201 PolarHBondContact O-N 3.31Å; Y199-A201 VanDerWaalsContact O-N 3.12Å; Y199-T230 HydrophobicContact CD1-CG2 3.66Å; Y199-T230 HydrophobicContact CD2-CG2 4.48Å; Y199-T230 HydrophobicContact CE1-CG2 4.49Å; Y199-T230 HydrophobicContact CG-CG2 3.67Å; Y199-L231 HydrophobicContact CD2-CD2 4.46Å; Y199-L231 HydrophobicContact CE2-CD2 3.89Å; Y199-P232 WeakPolarHBondContact OH-CD 3.33Å
200	N	97.8	Very high	96.4	Very high	50 Å²	50	57.1 Å²	57.1	27%	0.267	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	114.2	-173.9	-175.7	-6.4	0	0	0	111.3	D202 E203	N200-D202 PolarHBondContact O-N 3.05Å; N200-D202 VanDerWaalsContact OD1-CB 3.31Å; N200-D202 WeakPolarHBondContact OD1-CB 3.32Å; N200-D202 PolarHBondContact OD1-N 3.33Å; N200-E203 HydrophobicContact CB-CB 4.44Å; N200-E203 HydrophobicContact CB-CG 4.04Å; N200-E203 PolarHBondContact ND2-OE1 2.84Å; N200-E203 VanDerWaalsContact ND2-OE1 3.16Å; N200-E203 PolarHBondContact O-N 2.94Å
201	A	97.2	Very high	96.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-30.1	179.9	0	0	0	0	0	112.3	I173 A174 Y199 E203 L204 K205 Y220 M223	I173-A201 HydrophobicContact CG2-CB 3.84Å; A174-A201 VanDerWaalsContact O-CB 3.3Å; A174-A201 WeakPolarHBondContact O-CB 3.34Å; A174-A201 PolarHBondContact O-N 2.63Å; Y199-A201 PolarHBondContact O-N 3.31Å; Y199-A201 VanDerWaalsContact O-N 3.12Å; A201-E203 VanDerWaalsContact C-N 3.3Å; A201-E203 PolarHBondContact O-N 3.24Å; A201-L204 PolarHBondContact O-N 2.74Å; A201-L204 VanDerWaalsContact O-N 3.14Å; A201-K205 WeakPolarHBondContact O-CG 3.34Å; A201-K205 PolarHBondContact O-N 2.95Å; A201-Y220 HydrophobicContact CB-CD1 4.27Å; A201-Y220 HydrophobicContact CB-CE1 3.84Å; A201-M223 HydrophobicContact CB-CE 3.95Å; A201-M223 HydrophobicContact CB-SD 3.79Å; A201-M223 WeakPolarHBondContact O-CE 3.25Å
202	D	95.1	Very high	97	Very high	71 Å²	71	53.7 Å²	53.7	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-64.6	-35.9	179.5	-69.2	-28.5	0	0	0	112.1	N200 L204 K205	N200-D202 PolarHBondContact O-N 3.05Å; N200-D202 VanDerWaalsContact OD1-CB 3.31Å; N200-D202 WeakPolarHBondContact OD1-CB 3.32Å; N200-D202 PolarHBondContact OD1-N 3.33Å; D202-L204 PolarHBondContact O-N 2.82Å; D202-K205 PolarHBondContact O-N 3.09Å; D202-K205 WeakPolarHBondContact OD1-CE 3.36Å; D202-K205 IonicContact OD1-NZ 3.93Å; D202-K205 PolarHBondContact OD1-NZ 3.08Å
203	E	96.8	Very high	97.2	Very high	140 Å²	140	53.6 Å²	53.6	65%	0.654	28%	0.282	S	S	*	.	H	α-helix	trans	-68.5	-23	176.8	-67.5	171.7	-155.8	0	0	112.3	N200 A201	N200-E203 HydrophobicContact CB-CB 4.44Å; N200-E203 HydrophobicContact CB-CG 4.04Å; N200-E203 PolarHBondContact ND2-OE1 2.84Å; N200-E203 VanDerWaalsContact ND2-OE1 3.16Å; N200-E203 PolarHBondContact O-N 2.94Å; A201-E203 VanDerWaalsContact C-N 3.3Å; A201-E203 PolarHBondContact O-N 3.24Å
204	L	96.9	Very high	97.3	Very high	23 Å²	23	58.5 Å²	58.5	12%	0.12	29%	0.294	C	S	.	.	H	α-helix	trans	-96.9	-9.2	-177.7	-57.3	174.6	0	0	0	113.1	I173 A201 D202 S206 E207 V226 T230	I173-L204 HydrophobicContact CD1-CD1 3.98Å; I173-L204 HydrophobicContact CG1-CD1 4.22Å; I173-L204 HydrophobicContact CG2-CD1 3.92Å; A201-L204 PolarHBondContact O-N 2.74Å; A201-L204 VanDerWaalsContact O-N 3.14Å; D202-L204 PolarHBondContact O-N 2.82Å; L204-S206 VanDerWaalsContact C-N 3.3Å; L204-S206 PolarHBondContact O-N 3.35Å; L204-E207 VanDerWaalsContact O-CB 3.3Å; L204-E207 WeakPolarHBondContact O-CB 3.34Å; L204-E207 PolarHBondContact O-N 3.09Å; L204-E207 VanDerWaalsContact O-N 3.11Å; L204-V226 HydrophobicContact CB-CG2 4.41Å; L204-V226 HydrophobicContact CD1-CG2 4.2Å; L204-T230 HydrophobicContact CD1-CG2 3.71Å; L204-T230 WeakPolarHBondContact CD1-OG1 3.47Å; L204-T230 HydrophobicContact CD2-CG2 4.45Å
205	K	96.1	Very high	97.2	Very high	67 Å²	67	59 Å²	59	29%	0.291	30%	0.295	S	S	.	.	H	α-helix	trans	-56.4	-42.7	-175.3	-79.1	178.4	175.3	169.2	0	112.7	A201 D202 E207 V208 S209 I219 M223	A201-K205 WeakPolarHBondContact O-CG 3.34Å; A201-K205 PolarHBondContact O-N 2.95Å; D202-K205 PolarHBondContact O-N 3.09Å; D202-K205 WeakPolarHBondContact OD1-CE 3.36Å; D202-K205 IonicContact OD1-NZ 3.93Å; D202-K205 PolarHBondContact OD1-NZ 3.08Å; K205-E207 PolarHBondContact O-N 3Å; K205-V208 PolarHBondContact O-N 3.31Å; K205-S209 VanDerWaalsContact O-CB 3.23Å; K205-S209 WeakPolarHBondContact O-CB 3.26Å; K205-S209 PolarHBondContact O-N 3.29Å; K205-S209 PolarHBondContact O-OG 2.93Å; K205-I219 HydrophobicContact CB-CD1 4.06Å; K205-I219 HydrophobicContact CG-CD1 4.08Å; K205-M223 HydrophobicContact CG-CE 3.84Å
206	S	97.2	Very high	96.9	Very high	80 Å²	80	59.8 Å²	59.8	56%	0.559	30%	0.299	S	S	*	.	H	α-helix	trans	-62.2	-24.4	-178	56.4	0	0	0	0	113.2	L204 V208	L204-S206 VanDerWaalsContact C-N 3.3Å; L204-S206 PolarHBondContact O-N 3.35Å; S206-V208 VanDerWaalsContact C-N 3.26Å; S206-V208 PolarHBondContact O-N 3.03Å
207	E	97.7	Very high	96.6	Very high	33 Å²	33	60 Å²	60	15%	0.154	30%	0.302	C	S	.	.	H	α-helix	trans	-68.4	-28.4	-178.6	-61.3	-67.3	149.9	0	0	112.6	L204 K205 W210 V226 K229 R317	L204-E207 VanDerWaalsContact O-CB 3.3Å; L204-E207 WeakPolarHBondContact O-CB 3.34Å; L204-E207 PolarHBondContact O-N 3.09Å; L204-E207 VanDerWaalsContact O-N 3.11Å; K205-E207 PolarHBondContact O-N 3Å; E207-W210 PolarHBondContact O-NE1 3.44Å; E207-V226 HydrophobicContact CB-CG1 3.63Å; E207-V226 HydrophobicContact CG-CG1 4.27Å; E207-K229 IonicContact OE1-NZ 3.67Å; E207-K229 PolarHBondContact OE1-NZ 3.21Å; E207-K229 IonicContact OE2-NZ 3.93Å; E207-K229 PolarHBondContact OE2-NZ 3.48Å; E207-R317 PolarHBondContact O-NH1 2.89Å; E207-R317 PolarHBondContact O-NH2 3.29Å; E207-R317 IonicContact OE2-CZ 3.39Å; E207-R317 IonicContact OE2-NH2 3.45Å; E207-R317 PolarHBondContact OE2-NH2 2.81Å
208	V	97.9	Very high	96.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-127.6	-13.8	-170.9	-63.1	0	0	0	0	114.2	K205 S206 W210 I211 I219 L222 M223 V226 W316	K205-V208 PolarHBondContact O-N 3.31Å; S206-V208 VanDerWaalsContact C-N 3.26Å; S206-V208 PolarHBondContact O-N 3.03Å; V208-W210 PolarHBondContact O-N 2.86Å; V208-W210 VanDerWaalsContact O-N 3.09Å; V208-I211 WeakPolarHBondContact O-CB 3.16Å; V208-I211 PolarHBondContact O-N 2.88Å; V208-I219 HydrophobicContact CG2-CD1 4.23Å; V208-I219 HydrophobicContact CG2-CG1 3.8Å; V208-L222 HydrophobicContact CB-CB 3.91Å; V208-L222 HydrophobicContact CB-CD1 4.31Å; V208-L222 HydrophobicContact CG1-CB 4.25Å; V208-L222 HydrophobicContact CG2-CB 4.06Å; V208-M223 HydrophobicContact CG2-CG 4.46Å; V208-V226 HydrophobicContact CG1-CG1 3.85Å; V208-W316 HydrophobicContact CG1-CH2 4.28Å
209	S	97.5	Very high	96.2	Very high	74 Å²	74	58.1 Å²	58.1	52%	0.517	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.6	-175.7	59.7	0	0	0	0	114.6	K205 I211	K205-S209 VanDerWaalsContact O-CB 3.23Å; K205-S209 WeakPolarHBondContact O-CB 3.26Å; K205-S209 PolarHBondContact O-N 3.29Å; K205-S209 PolarHBondContact O-OG 2.93Å; S209-I211 PolarHBondContact O-N 3.12Å
210	W	97.9	Very high	96.1	Very high	85 Å²	85	58.8 Å²	58.8	32%	0.322	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-15	175.7	64.8	-89.9	0	0	0	113.2	E207 V208 P212 W316 R317 A320 E321 L324	E207-W210 PolarHBondContact O-NE1 3.44Å; V208-W210 PolarHBondContact O-N 2.86Å; V208-W210 VanDerWaalsContact O-N 3.09Å; W210-P212 VanDerWaalsContact O-CD 3.31Å; W210-P212 WeakPolarHBondContact O-CD 3.29Å; W210-W316 HydrophobicContact CZ2-CH2 4.3Å; W210-W316 AromaticContact CZ2-CZ3 3.71Å; W210-W316 HydrophobicContact CZ2-CZ3 3.71Å; W210-R317 HydrophobicContact CZ2-CG 4.28Å; W210-A320 HydrophobicContact CH2-CB 3.79Å; W210-A320 HydrophobicContact CZ3-CB 4.46Å; W210-E321 HydrophobicContact CH2-CG 3.81Å; W210-E321 HydrophobicContact CZ3-CG 3.81Å; W210-L324 HydrophobicContact CE3-CD1 4.45Å; W210-L324 HydrophobicContact CZ3-CD1 3.88Å
211	I	98.4	Very high	96.1	Very high	6 Å²	6	57 Å²	57	3%	0.031	30%	0.296	C	S	.	.	S	Bend	trans	-85.6	114.4	178	-60.5	164.6	0	0	0	109.3	V208 S209 N213 L222 L225 W316 L324 T330 I337	V208-I211 WeakPolarHBondContact O-CB 3.16Å; V208-I211 PolarHBondContact O-N 2.88Å; S209-I211 PolarHBondContact O-N 3.12Å; I211-N213 PolarHBondContact O-N 2.83Å; I211-L222 HydrophobicContact CB-CD1 3.94Å; I211-L222 HydrophobicContact CG2-CD1 4.15Å; I211-L222 HydrophobicContact CG2-CD2 4.19Å; I211-L225 HydrophobicContact CD1-CD1 4.19Å; I211-W316 HydrophobicContact CD1-CZ3 3.77Å; I211-L324 HydrophobicContact CG2-CD1 4.4Å; I211-T330 HydrophobicContact CG2-CG2 3.87Å; I211-I337 HydrophobicContact CD1-CD1 3.66Å; I211-I337 HydrophobicContact CG2-CD1 4.14Å
212	P	97.7	Very high	96.1	Very high	62 Å²	62	57 Å²	57	40%	0.403	30%	0.297	S	S	.	.			trans	-64.2	129.3	173.6	-18.4	32.1	0	0	0	110.6	W210 L324 S329 T330	W210-P212 VanDerWaalsContact O-CD 3.31Å; W210-P212 WeakPolarHBondContact O-CD 3.29Å; P212-L324 HydrophobicContact CG-CD2 4.45Å; P212-S329 CarbonylContact O-C 3.57Å; P212-S329 VanDerWaalsContact O-CA 3.22Å; P212-S329 WeakPolarHBondContact O-CA 3.49Å; P212-S329 VanDerWaalsContact O-CB 3.3Å; P212-S329 WeakPolarHBondContact O-CB 3.5Å; P212-T330 PolarHBondContact O-N 3.29Å; P212-T330 PolarHBondContact O-OG1 3.49Å
213	N	96.9	Very high	96.2	Very high	41 Å²	41	53.7 Å²	53.7	22%	0.219	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-137.2	136.6	-173.8	-178.6	33.3	0	0	0	112.2	I211 H215 G218 L222 T330	I211-N213 PolarHBondContact O-N 2.83Å; N213-H215 VanDerWaalsContact OD1-CB 3.29Å; N213-H215 WeakPolarHBondContact OD1-CB 3.39Å; N213-H215 PolarHBondContact OD1-N 3.35Å; N213-G218 PolarHBondContact ND2-O 3.26Å; N213-L222 HydrophobicContact CB-CD1 4.13Å; N213-T330 WeakPolarHBondContact CA-OG1 3.46Å; N213-T330 WeakPolarHBondContact CB-OG1 3.29Å; N213-T330 VanDerWaalsContact CG-OG1 3.31Å; N213-T330 PolarHBondContact OD1-OG1 2.84Å
214	K	95	Very high	96.3	Very high	148 Å²	148	47.4 Å²	47.4	64%	0.643	25%	0.249	S	C	*	.			trans	-107.4	-1.9	176.1	-70.6	174.8	-177.2	158.9	0	113.9	S329 T330	K214-S329 WeakPolarHBondContact CD-OG 3.25Å; K214-S329 WeakPolarHBondContact CE-OG 3.36Å; K214-S329 WeakPolarHBondContact CG-OG 3.47Å; K214-S329 PolarHBondContact NZ-OG 3.38Å; K214-T330 PolarHBondContact N-O 3.32Å
215	H	94.5	Very high	96.4	Very high	40 Å²	40	46.3 Å²	46.3	19%	0.185	24%	0.243	C	C	.	.			trans	-65	144.7	-178.6	-167.4	-102.5	0	0	0	111.5	N213 S217 G218 A333	N213-H215 VanDerWaalsContact OD1-CB 3.29Å; N213-H215 WeakPolarHBondContact OD1-CB 3.39Å; N213-H215 PolarHBondContact OD1-N 3.35Å; H215-S217 PolarHBondContact CE1-OG 2.04Å; H215-S217 WeakPolarHBondContact ND1-CB 3.48Å; H215-S217 PolarHBondContact ND1-N 2.58Å; H215-S217 PolarHBondContact ND1-OG 2.67Å; H215-S217 PolarHBondContact O-N 3.28Å; H215-G218 PolarHBondContact O-N 3.45Å; H215-A333 HydrophobicContact CB-CB 3.75Å
216	Y	90.7	Very high	96.5	Very high	136 Å²	136	43.1 Å²	43.1	53%	0.533	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.6	-175.4	68.3	-92.9	0	0	0	113.2	G218	Y216-G218 PolarHBondContact O-N 3.48Å
217	S	91.3	Very high	96.6	Very high	45 Å²	45	39.4 Å²	39.4	32%	0.315	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-0.8	174	-44.4	0	0	0	0	113.6	H215 Y220	H215-S217 PolarHBondContact CE1-OG 2.04Å; H215-S217 WeakPolarHBondContact ND1-CB 3.48Å; H215-S217 PolarHBondContact ND1-N 2.58Å; H215-S217 PolarHBondContact ND1-OG 2.67Å; H215-S217 PolarHBondContact O-N 3.28Å; S217-Y220 PolarHBondContact O-N 3.09Å
218	G	94.4	Very high	96.6	Very high	31 Å²	31	38.4 Å²	38.4	32%	0.32	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	56.5	-142.5	178.9	0	0	0	0	0	112.6	N213 H215 Y216 Y220 G221	N213-G218 PolarHBondContact ND2-O 3.26Å; H215-G218 PolarHBondContact O-N 3.45Å; Y216-G218 PolarHBondContact O-N 3.48Å; G218-Y220 PolarHBondContact O-N 3.13Å; G218-G221 PolarHBondContact O-N 3.19Å
219	I	95.8	Very high	96.5	Very high	47 Å²	47	43.2 Å²	43.2	24%	0.241	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-60.8	-31.4	-177.7	-167	165.3	0	0	0	113.2	K205 V208 G221 L222 M223	K205-I219 HydrophobicContact CB-CD1 4.06Å; K205-I219 HydrophobicContact CG-CD1 4.08Å; V208-I219 HydrophobicContact CG2-CD1 4.23Å; V208-I219 HydrophobicContact CG2-CG1 3.8Å; I219-G221 PolarHBondContact O-N 3.46Å; I219-L222 WeakPolarHBondContact O-CB 3.44Å; I219-L222 PolarHBondContact O-N 3.35Å; I219-M223 HydrophobicContact CG2-CE 4.44Å
220	Y	96.3	Very high	96.5	Very high	56 Å²	56	40.8 Å²	40.8	22%	0.22	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-64.6	-29.1	-179.9	-56.8	-72.1	0	0	0	112.2	A145 D175 A201 S217 G218 L222 M223	A145-Y220 HydrophobicContact CB-CD1 3.43Å; A145-Y220 VanDerWaalsContact CB-CD1 3.43Å; A145-Y220 HydrophobicContact CB-CD2 3.46Å; A145-Y220 VanDerWaalsContact CB-CD2 3.46Å; A145-Y220 HydrophobicContact CB-CE1 3.46Å; A145-Y220 VanDerWaalsContact CB-CE1 3.46Å; A145-Y220 HydrophobicContact CB-CE2 3.43Å; A145-Y220 VanDerWaalsContact CB-CE2 3.43Å; A145-Y220 HydrophobicContact CB-CG 3.45Å; A145-Y220 VanDerWaalsContact CB-CG 3.45Å; A145-Y220 VanDerWaalsContact CB-CZ 3.44Å; D175-Y220 HydrophobicContact CB-CE1 4.48Å; A201-Y220 HydrophobicContact CB-CD1 4.27Å; A201-Y220 HydrophobicContact CB-CE1 3.84Å; S217-Y220 PolarHBondContact O-N 3.09Å; G218-Y220 PolarHBondContact O-N 3.13Å; Y220-L222 PolarHBondContact O-N 3.26Å; Y220-L222 VanDerWaalsContact O-N 3.09Å; Y220-M223 HydrophobicContact CD1-CE 3.58Å; Y220-M223 HydrophobicContact CD1-SD 3.51Å; Y220-M223 VanDerWaalsContact CD1-SD 3.51Å; Y220-M223 HydrophobicContact CE1-CE 3.79Å; Y220-M223 HydrophobicContact CE1-SD 4.18Å; Y220-M223 HydrophobicContact CG-SD 4.45Å; Y220-M223 PolarHBondContact O-N 3.1Å; Y220-M223 VanDerWaalsContact O-N 3.09Å
221	G	96.1	Very high	96.5	Very high	11 Å²	11	37 Å²	37	11%	0.113	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-64.3	-10.5	173	0	0	0	0	0	114.5	G218 I219 A333 D334	G218-G221 PolarHBondContact O-N 3.19Å; I219-G221 PolarHBondContact O-N 3.46Å; G221-A333 WeakPolarHBondContact O-CB 3.29Å; G221-D334 VanDerWaalsContact O-CB 3.27Å; G221-D334 WeakPolarHBondContact O-CB 3.34Å; G221-D334 PolarHBondContact O-N 3Å; G221-D334 VanDerWaalsContact O-N 3.08Å
222	L	98.2	Very high	96.5	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-99.4	-13.3	175.7	-62.8	168.3	0	0	0	112.7	V208 I211 N213 I219 Y220 K224 L225 A333 I337	V208-L222 HydrophobicContact CB-CB 3.91Å; V208-L222 HydrophobicContact CB-CD1 4.31Å; V208-L222 HydrophobicContact CG1-CB 4.25Å; V208-L222 HydrophobicContact CG2-CB 4.06Å; I211-L222 HydrophobicContact CB-CD1 3.94Å; I211-L222 HydrophobicContact CG2-CD1 4.15Å; I211-L222 HydrophobicContact CG2-CD2 4.19Å; N213-L222 HydrophobicContact CB-CD1 4.13Å; I219-L222 WeakPolarHBondContact O-CB 3.44Å; I219-L222 PolarHBondContact O-N 3.35Å; Y220-L222 PolarHBondContact O-N 3.26Å; Y220-L222 VanDerWaalsContact O-N 3.09Å; L222-K224 PolarHBondContact O-N 3.16Å; L222-L225 HydrophobicContact CB-CD1 4.44Å; L222-L225 HydrophobicContact CD2-CD1 4.33Å; L222-L225 VanDerWaalsContact O-CB 3.29Å; L222-L225 WeakPolarHBondContact O-CB 3.27Å; L222-L225 VanDerWaalsContact O-CG 3.31Å; L222-L225 WeakPolarHBondContact O-CG 3.15Å; L222-L225 PolarHBondContact O-N 3.28Å; L222-L225 VanDerWaalsContact O-N 3.07Å; L222-A333 HydrophobicContact CD2-CB 4Å; L222-A333 HydrophobicContact CG-CB 4.34Å; L222-I337 HydrophobicContact CD2-CD1 4.27Å
223	M	98	Very high	96.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-72.1	-12.3	-168.2	-69.2	-175.6	174.2	0	0	114.1	V143 I173 A201 K205 V208 I219 Y220 L225 V226	V143-M223 HydrophobicContact CG1-CB 3.92Å; V143-M223 HydrophobicContact CG1-SD 4.27Å; V143-M223 HydrophobicContact CG2-CB 4.03Å; I173-M223 HydrophobicContact CG2-SD 3.87Å; A201-M223 HydrophobicContact CB-CE 3.95Å; A201-M223 HydrophobicContact CB-SD 3.79Å; A201-M223 WeakPolarHBondContact O-CE 3.25Å; K205-M223 HydrophobicContact CG-CE 3.84Å; V208-M223 HydrophobicContact CG2-CG 4.46Å; I219-M223 HydrophobicContact CG2-CE 4.44Å; Y220-M223 HydrophobicContact CD1-CE 3.58Å; Y220-M223 HydrophobicContact CD1-SD 3.51Å; Y220-M223 VanDerWaalsContact CD1-SD 3.51Å; Y220-M223 HydrophobicContact CE1-CE 3.79Å; Y220-M223 HydrophobicContact CE1-SD 4.18Å; Y220-M223 HydrophobicContact CG-SD 4.45Å; Y220-M223 PolarHBondContact O-N 3.1Å; Y220-M223 VanDerWaalsContact O-N 3.09Å; M223-L225 PolarHBondContact O-N 3.17Å; M223-V226 WeakPolarHBondContact O-CG2 3.45Å; M223-V226 PolarHBondContact O-N 2.77Å
224	K	98.3	Very high	96.5	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.035	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-64.6	-22.3	170	-56.8	-172.6	-154.1	155.3	0	112.4	V143 L222 V226 L227 V240 D242 T297 I300 D334	V143-K224 HydrophobicContact CG2-CG 3.96Å; L222-K224 PolarHBondContact O-N 3.16Å; K224-V226 PolarHBondContact O-N 2.97Å; K224-L227 HydrophobicContact CB-CD1 4.05Å; K224-L227 HydrophobicContact CG-CD1 4.5Å; K224-L227 WeakPolarHBondContact O-CD1 3.14Å; K224-L227 WeakPolarHBondContact O-CG 3.41Å; K224-L227 PolarHBondContact O-N 3.23Å; K224-V240 HydrophobicContact CD-CG1 3.83Å; K224-V240 HydrophobicContact CG-CG1 4.21Å; K224-D242 WeakPolarHBondContact CE-OD1 3.16Å; K224-D242 VanDerWaalsContact NZ-CG 3.3Å; K224-D242 IonicContact NZ-OD1 2.95Å; K224-D242 PolarHBondContact NZ-OD1 2.72Å; K224-D242 IonicContact NZ-OD2 2.78Å; K224-D242 PolarHBondContact NZ-OD2 3.15Å; K224-T297 PolarHBondContact NZ-O 3.46Å; K224-I300 HydrophobicContact CD-CD1 4.17Å; K224-D334 HydrophobicContact CB-CB 4.48Å; K224-D334 VanDerWaalsContact CB-OD2 3.27Å; K224-D334 WeakPolarHBondContact CB-OD2 3.16Å; K224-D334 WeakPolarHBondContact CD-OD2 3Å; K224-D334 VanDerWaalsContact CE-OD2 3.29Å; K224-D334 WeakPolarHBondContact CE-OD2 3.27Å; K224-D334 WeakPolarHBondContact CG-OD2 3.29Å; K224-D334 IonicContact NZ-OD2 2.89Å
225	L	98.5	Very high	96.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-65	-26	178.3	-64.7	170.3	0	0	0	113.1	I211 L222 M223 W316 D334 I337 F338	I211-L225 HydrophobicContact CD1-CD1 4.19Å; L222-L225 HydrophobicContact CB-CD1 4.44Å; L222-L225 HydrophobicContact CD2-CD1 4.33Å; L222-L225 VanDerWaalsContact O-CB 3.29Å; L222-L225 WeakPolarHBondContact O-CB 3.27Å; L222-L225 VanDerWaalsContact O-CG 3.31Å; L222-L225 WeakPolarHBondContact O-CG 3.15Å; L222-L225 PolarHBondContact O-N 3.28Å; L222-L225 VanDerWaalsContact O-N 3.07Å; M223-L225 PolarHBondContact O-N 3.17Å; L225-W316 HydrophobicContact CB-CD2 4.13Å; L225-W316 HydrophobicContact CB-CE3 4.48Å; L225-W316 HydrophobicContact CB-CH2 4.49Å; L225-W316 HydrophobicContact CB-CZ2 4.1Å; L225-W316 HydrophobicContact CD1-CD2 4.44Å; L225-W316 HydrophobicContact CD1-CE3 4.04Å; L225-W316 HydrophobicContact CD1-CZ3 4.15Å; L225-W316 HydrophobicContact CD2-CB 4.44Å; L225-W316 HydrophobicContact CD2-CD2 4.29Å; L225-W316 HydrophobicContact CD2-CG 4.23Å; L225-W316 PolarHBondContact O-NE1 3Å; L225-D334 HydrophobicContact CD2-CB 4.43Å; L225-D334 HydrophobicContact CG-CB 4.17Å; L225-I337 HydrophobicContact CD1-CB 4.4Å; L225-I337 HydrophobicContact CD1-CD1 3.63Å; L225-I337 HydrophobicContact CD1-CG2 4.32Å; L225-I337 HydrophobicContact CD2-CB 4.14Å; L225-I337 HydrophobicContact CD2-CG2 3.77Å; L225-F338 HydrophobicContact CD2-CD2 3.96Å; L225-F338 HydrophobicContact CD2-CE2 3.83Å
226	V	98.2	Very high	96.8	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-97.1	0.2	-175.5	-61.2	0	0	0	0	113.9	L204 E207 V208 M223 K224 T228 K229 T230 W316	L204-V226 HydrophobicContact CB-CG2 4.41Å; L204-V226 HydrophobicContact CD1-CG2 4.2Å; E207-V226 HydrophobicContact CB-CG1 3.63Å; E207-V226 HydrophobicContact CG-CG1 4.27Å; V208-V226 HydrophobicContact CG1-CG1 3.85Å; M223-V226 WeakPolarHBondContact O-CG2 3.45Å; M223-V226 PolarHBondContact O-N 2.77Å; K224-V226 PolarHBondContact O-N 2.97Å; V226-T228 PolarHBondContact O-N 3.35Å; V226-T228 VanDerWaalsContact O-N 3.11Å; V226-K229 WeakPolarHBondContact O-CA 3.35Å; V226-K229 WeakPolarHBondContact O-CB 3.38Å; V226-K229 PolarHBondContact O-N 2.94Å; V226-T230 PolarHBondContact O-N 3.2Å; V226-T230 PolarHBondContact O-OG1 2.92Å; V226-T230 VanDerWaalsContact O-OG1 3.09Å; V226-W316 HydrophobicContact CG1-CZ2 4.33Å
227	L	98.5	Very high	97.2	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-55.4	-35.3	-176.5	-73	169.4	0	0	0	113.8	A141 I173 K224 K229 T230 L231 V240 L302	A141-L227 HydrophobicContact CB-CD2 4.07Å; I173-L227 HydrophobicContact CD1-CD2 3.6Å; I173-L227 HydrophobicContact CD1-CG 4.44Å; I173-L227 HydrophobicContact CG1-CD2 4.43Å; K224-L227 HydrophobicContact CB-CD1 4.05Å; K224-L227 HydrophobicContact CG-CD1 4.5Å; K224-L227 WeakPolarHBondContact O-CD1 3.14Å; K224-L227 WeakPolarHBondContact O-CG 3.41Å; K224-L227 PolarHBondContact O-N 3.23Å; L227-K229 PolarHBondContact O-N 3.36Å; L227-T230 PolarHBondContact O-N 3.4Å; L227-L231 HydrophobicContact CB-CD1 4.25Å; L227-L231 HydrophobicContact CD2-CD1 4.08Å; L227-L231 HydrophobicContact CD2-CD2 4.45Å; L227-L231 HydrophobicContact CD2-CG 4.16Å; L227-L231 WeakPolarHBondContact O-CB 3.4Å; L227-L231 WeakPolarHBondContact O-CG 3.32Å; L227-L231 PolarHBondContact O-N 3.11Å; L227-V240 HydrophobicContact CD1-CB 4.31Å; L227-V240 HydrophobicContact CD1-CG1 3.68Å; L227-V240 HydrophobicContact CD1-CG2 3.59Å; L227-L302 HydrophobicContact CB-CD1 4.48Å; L227-L302 HydrophobicContact CD1-CD1 4.07Å
228	T	97.7	Very high	97.6	Very high	11 Å²	11	36 Å²	36	7%	0.067	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-28.5	177.8	53.7	0	0	0	0	113.3	V226 L304 L307 R308 W312	V226-T228 PolarHBondContact O-N 3.35Å; V226-T228 VanDerWaalsContact O-N 3.11Å; T228-L304 HydrophobicContact CG2-CD2 4.04Å; T228-L307 HydrophobicContact CG2-CB 3.81Å; T228-L307 HydrophobicContact CG2-CD1 4.22Å; T228-R308 PolarHBondContact O-NE 2.8Å; T228-W312 HydrophobicContact CG2-CB 4.26Å; T228-W312 HydrophobicContact CG2-CG 4.14Å
229	K	95.9	Very high	97.8	Very high	102 Å²	102	34.5 Å²	34.5	44%	0.443	19%	0.186	S	C	.	.	H	α-helix	trans	-88.8	-39.4	177.8	179.4	-179.1	-177.3	173.7	0	111.3	E207 V226 L227	E207-K229 IonicContact OE1-NZ 3.67Å; E207-K229 PolarHBondContact OE1-NZ 3.21Å; E207-K229 IonicContact OE2-NZ 3.93Å; E207-K229 PolarHBondContact OE2-NZ 3.48Å; V226-K229 WeakPolarHBondContact O-CA 3.35Å; V226-K229 WeakPolarHBondContact O-CB 3.38Å; V226-K229 PolarHBondContact O-N 2.94Å; L227-K229 PolarHBondContact O-N 3.36Å
230	T	98.1	Very high	97.9	Very high	23 Å²	23	32.2 Å²	32.2	14%	0.141	18%	0.175	C	C	.	.	H	α-helix	trans	-76	-43.9	-174.5	-55	0	0	0	0	113.4	I173 Y199 L204 V226 L227	I173-T230 HydrophobicContact CD1-CG2 4.06Å; I173-T230 HydrophobicContact CG1-CG2 4.14Å; Y199-T230 HydrophobicContact CD1-CG2 3.66Å; Y199-T230 HydrophobicContact CD2-CG2 4.48Å; Y199-T230 HydrophobicContact CE1-CG2 4.49Å; Y199-T230 HydrophobicContact CG-CG2 3.67Å; L204-T230 HydrophobicContact CD1-CG2 3.71Å; L204-T230 WeakPolarHBondContact CD1-OG1 3.47Å; L204-T230 HydrophobicContact CD2-CG2 4.45Å; V226-T230 PolarHBondContact O-N 3.2Å; V226-T230 PolarHBondContact O-OG1 2.92Å; V226-T230 VanDerWaalsContact O-OG1 3.09Å; L227-T230 PolarHBondContact O-N 3.4Å
231	L	98.6	Very high	98	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.026	17%	0.165	C	C	.	.	S	Bend	trans	-75	155.2	-174.6	-63.4	179.8	0	0	0	112.1	A141 H171 Y199 L227 A233 L235 V238 L304 R308	A141-L231 HydrophobicContact CB-CD1 4.19Å; H171-L231 HydrophobicContact CB-CD2 3.52Å; Y199-L231 HydrophobicContact CD2-CD2 4.46Å; Y199-L231 HydrophobicContact CE2-CD2 3.89Å; L227-L231 HydrophobicContact CB-CD1 4.25Å; L227-L231 HydrophobicContact CD2-CD1 4.08Å; L227-L231 HydrophobicContact CD2-CD2 4.45Å; L227-L231 HydrophobicContact CD2-CG 4.16Å; L227-L231 WeakPolarHBondContact O-CB 3.4Å; L227-L231 WeakPolarHBondContact O-CG 3.32Å; L227-L231 PolarHBondContact O-N 3.11Å; L231-A233 PolarHBondContact O-N 3.34Å; L231-L235 HydrophobicContact CB-CD2 4.23Å; L231-L235 HydrophobicContact CD1-CD2 4.15Å; L231-V238 HydrophobicContact CD1-CB 4.4Å; L231-V238 HydrophobicContact CD1-CG1 3.94Å; L231-V238 HydrophobicContact CD1-CG2 4.28Å; L231-L304 HydrophobicContact CB-CD1 4.2Å; L231-L304 HydrophobicContact CD1-CD1 3.76Å; L231-L304 HydrophobicContact CD1-CD2 4.43Å; L231-R308 PolarHBondContact O-NH2 3.42Å
232	P	98.3	Very high	98.1	Very high	41 Å²	41	31 Å²	31	27%	0.266	17%	0.169	S	C	.	.			trans	-51.5	138.5	-174.4	-27.7	35.6	0	0	0	113	Y199 N234 L235 R308	Y199-P232 WeakPolarHBondContact OH-CD 3.33Å; P232-N234 WeakPolarHBondContact CB-OD1 3.3Å; P232-N234 PolarHBondContact O-N 3.06Å; P232-L235 HydrophobicContact CB-CB 4.29Å; P232-L235 VanDerWaalsContact O-CB 3.31Å; P232-L235 WeakPolarHBondContact O-CB 3.21Å; P232-L235 PolarHBondContact O-N 3Å; P232-R308 PolarHBondContact O-NH1 3.49Å; P232-R308 PolarHBondContact O-NH2 2.91Å
233	A	97.1	Very high	98.1	Very high	92 Å²	92	32 Å²	32	76%	0.76	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-29	-173.3	0	0	0	0	0	113.5	L231 R308	L231-A233 PolarHBondContact O-N 3.34Å; A233-R308 PolarHBondContact O-NH1 3.16Å
234	N	96.8	Very high	98	Very high	137 Å²	137	32.3 Å²	32.3	73%	0.733	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-8.9	176.3	65.6	-38.7	0	0	0	113.7	P232 E236	P232-N234 WeakPolarHBondContact CB-OD1 3.3Å; P232-N234 PolarHBondContact O-N 3.06Å; N234-E236 PolarHBondContact O-N 3.45Å
235	L	98.4	Very high	98	Very high	14 Å²	14	32 Å²	32	7%	0.073	18%	0.176	C	C	.	.			trans	-73.6	117.3	176.2	-176.9	62.2	0	0	0	109.7	H139 L231 P232 V238 L304 R308	H139-L235 HydrophobicContact CB-CD1 3.96Å; H139-L235 HydrophobicContact CB-CD2 4.42Å; H139-L235 VanDerWaalsContact CG-CD1 3.41Å; H139-L235 WeakPolarHBondContact ND1-CD1 3.12Å; L231-L235 HydrophobicContact CB-CD2 4.23Å; L231-L235 HydrophobicContact CD1-CD2 4.15Å; P232-L235 HydrophobicContact CB-CB 4.29Å; P232-L235 VanDerWaalsContact O-CB 3.31Å; P232-L235 WeakPolarHBondContact O-CB 3.21Å; P232-L235 PolarHBondContact O-N 3Å; L235-V238 HydrophobicContact CD2-CB 4.33Å; L235-L304 HydrophobicContact CB-CD1 4.21Å; L235-L304 HydrophobicContact CD2-CD1 3.72Å; L235-L304 HydrophobicContact CG-CD1 3.79Å; L235-L304 WeakPolarHBondContact O-CB 3.48Å; L235-R308 PolarHBondContact O-NH1 3.39Å
236	E	98.3	Very high	97.9	Very high	129 Å²	129	32.1 Å²	32.1	60%	0.603	18%	0.177	S	C	*	.			trans	-86.7	-38.8	-173.6	-62.5	-173.7	168.3	0	0	113.6	N234 L303 L304 D305	N234-E236 PolarHBondContact O-N 3.45Å; E236-L303 CarbonylContact O-C 3.56Å; E236-L304 PolarHBondContact O-N 2.83Å; E236-D305 HydrophobicContact CB-CB 4.42Å; E236-D305 HydrophobicContact CG-CB 4.45Å; E236-D305 PolarHBondContact O-N 3.05Å
237	R	98.5	Very high	97.9	Very high	43 Å²	43	32 Å²	32	16%	0.162	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	149.1	-175.5	64.8	-176	-176.9	-173.8	-3.3	111.9	E136 W255 F258 H259 L302 L303	E136-R237 IonicContact OE1-CZ 2.87Å; E136-R237 IonicContact OE1-NE 2.64Å; E136-R237 IonicContact OE1-NH2 3.8Å; E136-R237 PolarHBondContact OE1-NH2 2.81Å; E136-R237 IonicContact OE2-NH2 3.66Å; R237-W255 HydrophobicContact CB-CH2 4.49Å; R237-W255 HydrophobicContact CG-CH2 3.55Å; R237-W255 HydrophobicContact CG-CZ2 3.62Å; R237-W255 HydrophobicContact CG-CZ3 4.23Å; R237-W255 VanDerWaalsContact NE-CZ2 3.35Å; R237-W255 WeakPolarHBondContact O-CH2 3.43Å; R237-F258 HydrophobicContact CB-CD1 4.32Å; R237-F258 HydrophobicContact CB-CD2 4.39Å; R237-F258 HydrophobicContact CB-CE1 3.98Å; R237-F258 HydrophobicContact CB-CE2 4.08Å; R237-F258 HydrophobicContact CB-CZ 3.86Å; R237-F258 HydrophobicContact CG-CD2 4.29Å; R237-F258 HydrophobicContact CG-CE2 4.26Å; R237-H259 PolarHBondContact NH1-NE2 2.84Å; R237-L302 VanDerWaalsContact CA-O 3.23Å; R237-L302 WeakPolarHBondContact CA-O 3.38Å; R237-L303 HydrophobicContact CB-CD2 3.81Å
238	V	98.9	Very high	97.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	143.7	-178.3	69.1	0	0	0	0	111.1	H139 A141 L231 L235 V240 F258 L302 L304	H139-V238 HydrophobicContact CB-CB 4.49Å; H139-V238 HydrophobicContact CB-CG2 4.11Å; H139-V238 WeakPolarHBondContact O-CG2 3.3Å; A141-V238 HydrophobicContact CB-CG2 3.66Å; L231-V238 HydrophobicContact CD1-CB 4.4Å; L231-V238 HydrophobicContact CD1-CG1 3.94Å; L231-V238 HydrophobicContact CD1-CG2 4.28Å; L235-V238 HydrophobicContact CD2-CB 4.33Å; V238-V240 HydrophobicContact CG1-CG2 4.16Å; V238-F258 WeakPolarHBondContact O-CZ 3.15Å; V238-L302 HydrophobicContact CG1-CB 3.92Å; V238-L302 HydrophobicContact CG1-CD1 4.28Å; V238-L302 PolarHBondContact N-O 3.36Å; V238-L302 PolarHBondContact O-N 3.47Å; V238-L304 HydrophobicContact CB-CD1 4.13Å; V238-L304 HydrophobicContact CG1-CD1 3.73Å; V238-L304 HydrophobicContact CG1-CD2 3.95Å; V238-L304 HydrophobicContact CG1-CG 3.86Å
239	I	98.9	Very high	97.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.6	166.6	-64.5	167.1	0	0	0	107.9	I138 H139 V140 A141 L241 I251 L254 W255 F258 I300 L301	I138-I239 HydrophobicContact CG2-CD1 4.26Å; H139-I239 PolarHBondContact O-N 3.33Å; V140-I239 CarbonylContact C-O 3.51Å; V140-I239 VanDerWaalsContact CA-O 3.25Å; V140-I239 WeakPolarHBondContact CA-O 3.02Å; A141-I239 PolarHBondContact N-O 2.96Å; I239-L241 HydrophobicContact CG2-CD2 3.69Å; I239-L241 HydrophobicContact CG2-CG 3.95Å; I239-I251 HydrophobicContact CD1-CD1 4.09Å; I239-I251 HydrophobicContact CD1-CG1 3.76Å; I239-L254 HydrophobicContact CD1-CB 4.18Å; I239-L254 HydrophobicContact CD1-CD2 4.13Å; I239-L254 HydrophobicContact CD1-CG 3.99Å; I239-L254 HydrophobicContact CG2-CD2 3.99Å; I239-W255 HydrophobicContact CD1-CB 4.18Å; I239-W255 HydrophobicContact CD1-CE3 3.73Å; I239-W255 HydrophobicContact CG1-CE3 3.81Å; I239-W255 HydrophobicContact CG1-CZ3 4.25Å; I239-F258 HydrophobicContact CG1-CE2 4.24Å; I239-I300 CarbonylContact C-O 3.53Å; I239-I300 WeakPolarHBondContact CA-O 3.22Å; I239-L301 HydrophobicContact CG1-CG 4.46Å
240	V	98.9	Very high	97.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.3	174.9	-166.5	0	0	0	0	109.3	A141 K224 L227 V238 V299 I300 L302	A141-V240 HydrophobicContact CB-CG2 4.36Å; A141-V240 WeakPolarHBondContact O-CA 3.27Å; K224-V240 HydrophobicContact CD-CG1 3.83Å; K224-V240 HydrophobicContact CG-CG1 4.21Å; L227-V240 HydrophobicContact CD1-CB 4.31Å; L227-V240 HydrophobicContact CD1-CG1 3.68Å; L227-V240 HydrophobicContact CD1-CG2 3.59Å; V238-V240 HydrophobicContact CG1-CG2 4.16Å; V240-V299 WeakPolarHBondContact O-CA 3.29Å; V240-I300 HydrophobicContact CB-CB 4.02Å; V240-I300 HydrophobicContact CB-CD1 4.45Å; V240-I300 HydrophobicContact CB-CG1 4.31Å; V240-I300 HydrophobicContact CG2-CB 4.33Å; V240-I300 PolarHBondContact N-O 3.42Å; V240-I300 PolarHBondContact O-N 3.06Å; V240-L302 HydrophobicContact CG2-CD1 3.43Å; V240-L302 VanDerWaalsContact CG2-CD1 3.43Å; V240-L302 HydrophobicContact CG2-CG 3.81Å
241	L	98.9	Very high	97.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141	-178	-58.2	174	0	0	0	111.2	V140 A141 I142 L156 I239 F247 I251 G298 V299	V140-L241 HydrophobicContact CG1-CD1 3.57Å; V140-L241 HydrophobicContact CG1-CG 4.1Å; A141-L241 PolarHBondContact O-N 3.41Å; I142-L241 HydrophobicContact CG1-CB 4.42Å; L156-L241 HydrophobicContact CD1-CD1 4.22Å; L156-L241 HydrophobicContact CD2-CB 4.18Å; L156-L241 HydrophobicContact CD2-CD1 4.35Å; I239-L241 HydrophobicContact CG2-CD2 3.69Å; I239-L241 HydrophobicContact CG2-CG 3.95Å; L241-F247 HydrophobicContact CD1-CE2 3.63Å; L241-F247 HydrophobicContact CD1-CZ 4.05Å; L241-F247 HydrophobicContact CD2-CE2 3.95Å; L241-F247 HydrophobicContact CD2-CZ 3.99Å; L241-F247 HydrophobicContact CG-CE2 4.46Å; L241-I251 HydrophobicContact CD1-CD1 4.4Å; L241-G298 CarbonylContact C-O 3.55Å; L241-G298 WeakPolarHBondContact CA-O 3.49Å; L241-V299 HydrophobicContact CD2-CB 4.43Å; L241-V299 HydrophobicContact CD2-CG1 4.13Å; L241-V299 HydrophobicContact CD2-CG2 4Å
242	D	98.1	Very high	97.6	Very high	40 Å²	40	29 Å²	29	21%	0.214	17%	0.17	C	C	.	.			trans	-68.5	157.1	162.2	-90.4	-23.3	0	0	0	111.1	L156 K224 D244 I245 G298 H380	L156-D242 WeakPolarHBondContact CD2-O 3.04Å; K224-D242 WeakPolarHBondContact CE-OD1 3.16Å; K224-D242 VanDerWaalsContact NZ-CG 3.3Å; K224-D242 IonicContact NZ-OD1 2.95Å; K224-D242 PolarHBondContact NZ-OD1 2.72Å; K224-D242 IonicContact NZ-OD2 2.78Å; K224-D242 PolarHBondContact NZ-OD2 3.15Å; D242-D244 WeakPolarHBondContact CB-OD1 3.31Å; D242-D244 PolarHBondContact O-N 3.16Å; D242-I245 HydrophobicContact CB-CG1 4.02Å; D242-I245 VanDerWaalsContact O-CG1 3.26Å; D242-I245 WeakPolarHBondContact O-CG1 3.44Å; D242-G298 PolarHBondContact N-O 2.62Å; D242-G298 WeakPolarHBondContact OD2-CA 3.25Å; D242-H380 IonicContact OD2-CE1 3.27Å; D242-H380 IonicContact OD2-NE2 3.72Å; D242-H380 PolarHBondContact OD2-NE2 3.04Å
243	T	97.4	Very high	97.6	Very high	23 Å²	23	30 Å²	30	14%	0.141	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.9	-177.1	61	0	0	0	0	112.7	I142 V143 C144 A149 D152 V153 I245	I142-T243 HydrophobicContact CG2-CG2 3.99Å; V143-T243 WeakPolarHBondContact O-CG2 3.33Å; C144-T243 HydrophobicContact CB-CG2 4.32Å; A149-T243 HydrophobicContact CB-CG2 4.35Å; D152-T243 CarbonylContact C-O 3.51Å; D152-T243 VanDerWaalsContact C-O 3.27Å; D152-T243 WeakPolarHBondContact CB-O 3.31Å; V153-T243 HydrophobicContact CG2-CG2 3.4Å; V153-T243 VanDerWaalsContact CG2-CG2 3.4Å; T243-I245 VanDerWaalsContact C-N 3.35Å; T243-I245 PolarHBondContact O-N 3.28Å
244	D	95.7	Very high	97.6	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.032	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	39.3	-174.6	65.8	-17.2	0	0	0	112.3	D242 H380 W381 K386	D242-D244 WeakPolarHBondContact CB-OD1 3.31Å; D242-D244 PolarHBondContact O-N 3.16Å; D244-H380 IonicContact OD1-CD2 2.8Å; D244-H380 PolarHBondContact OD1-CD2 3.34Å; D244-H380 IonicContact OD1-NE2 3.49Å; D244-H380 PolarHBondContact OD1-NE2 2.87Å; D244-W381 HydrophobicContact CB-CB 4.15Å; D244-W381 WeakPolarHBondContact O-CB 3.19Å; D244-W381 VanDerWaalsContact O-CD1 3.24Å; D244-W381 PolarHBondContact O-N 3.42Å; D244-W381 VanDerWaalsContact OD2-C 3.29Å; D244-K386 IonicContact OD2-NZ 3.52Å; D244-K386 PolarHBondContact OD2-NZ 3.19Å
245	I	97.8	Very high	97.7	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	147.3	174.7	-64.4	-69.6	0	0	0	110.2	L156 D242 T243 F247 V299 V378 I379 H380	L156-I245 WeakPolarHBondContact CB-O 3.26Å; L156-I245 HydrophobicContact CD1-CB 3.8Å; L156-I245 HydrophobicContact CD1-CG2 3.8Å; L156-I245 WeakPolarHBondContact CD1-O 3.42Å; L156-I245 HydrophobicContact CD2-CB 4.39Å; D242-I245 HydrophobicContact CB-CG1 4.02Å; D242-I245 VanDerWaalsContact O-CG1 3.26Å; D242-I245 WeakPolarHBondContact O-CG1 3.44Å; T243-I245 VanDerWaalsContact C-N 3.35Å; T243-I245 PolarHBondContact O-N 3.28Å; I245-F247 HydrophobicContact CG2-CD2 3.88Å; I245-F247 HydrophobicContact CG2-CE2 3.7Å; I245-V299 HydrophobicContact CD1-CG2 3.92Å; I245-V378 HydrophobicContact CD1-CG1 4.3Å; I245-V378 HydrophobicContact CG2-CG1 3.38Å; I245-I379 CarbonylContact C-O 3.6Å; I245-I379 WeakPolarHBondContact CA-O 3.38Å; I245-H380 HydrophobicContact CD1-CB 3.54Å; I245-H380 VanDerWaalsContact CD1-CG 3.47Å
246	T	97.4	Very high	97.7	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.012	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	122.5	170.8	-52.5	0	0	0	0	109.7	I379 W381 L400 F404	T246-I379 PolarHBondContact N-O 3.18Å; T246-I379 PolarHBondContact O-N 3.34Å; T246-W381 PolarHBondContact OG1-NE1 2.94Å; T246-W381 VanDerWaalsContact OG1-NE1 3.08Å; T246-L400 HydrophobicContact CG2-CD2 4Å; T246-L400 HydrophobicContact CG2-CG 4.07Å; T246-F404 HydrophobicContact CG2-CD2 3.81Å; T246-F404 HydrophobicContact CG2-CE2 4.15Å
247	F	97.6	Very high	97.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	142.2	174.9	-84	-107.6	0	0	0	111	L156 S159 V160 L241 I245 I251 L254 V378	L156-F247 HydrophobicContact CD1-CD2 3.89Å; L156-F247 HydrophobicContact CD1-CE2 4.11Å; S159-F247 PolarHBondContact OG-N 3.4Å; V160-F247 HydrophobicContact CG2-CB 4.27Å; V160-F247 HydrophobicContact CG2-CD2 3.45Å; V160-F247 VanDerWaalsContact CG2-CD2 3.45Å; V160-F247 HydrophobicContact CG2-CE2 3.87Å; V160-F247 HydrophobicContact CG2-CG 3.83Å; L241-F247 HydrophobicContact CD1-CE2 3.63Å; L241-F247 HydrophobicContact CD1-CZ 4.05Å; L241-F247 HydrophobicContact CD2-CE2 3.95Å; L241-F247 HydrophobicContact CD2-CZ 3.99Å; L241-F247 HydrophobicContact CG-CE2 4.46Å; I245-F247 HydrophobicContact CG2-CD2 3.88Å; I245-F247 HydrophobicContact CG2-CE2 3.7Å; F247-I251 HydrophobicContact CD1-CB 4.3Å; F247-I251 HydrophobicContact CE1-CB 3.89Å; F247-I251 HydrophobicContact CE1-CD1 4.09Å; F247-I251 HydrophobicContact CE1-CG1 3.75Å; F247-I251 HydrophobicContact CZ-CD1 3.87Å; F247-I251 HydrophobicContact CZ-CG1 4.01Å; F247-L254 HydrophobicContact CE1-CD2 4.48Å; F247-L254 HydrophobicContact CZ-CD2 4.35Å; F247-V378 HydrophobicContact CD1-CG2 3.92Å; F247-V378 HydrophobicContact CE1-CG2 3.71Å; F247-V378 HydrophobicContact CE2-CG1 4.4Å; F247-V378 HydrophobicContact CE2-CG2 4.31Å; F247-V378 HydrophobicContact CG-CG2 4.33Å; F247-V378 HydrophobicContact CZ-CG2 3.92Å
248	A	95.9	Very high	97.7	Very high	28 Å²	28	11.3 Å²	11.3	23%	0.231	7%	0.066	C	C	.	.	S	Bend	trans	-119.6	2.6	172.8	0	0	0	0	0	112.3	H163 K377 I379 L400	H163-A248 PolarHBondContact CE1-O 3.27Å; A248-K377 PolarHBondContact N-O 3.21Å; A248-I379 HydrophobicContact CB-CD1 4.32Å; A248-L400 HydrophobicContact CB-CD2 3.98Å
249	T	95.6	Very high	97.6	Very high	28 Å²	28	16 Å²	16	17%	0.172	9%	0.087	C	C	.	.	S	Bend	trans	-147.9	174.6	178.1	-156.8	0	0	0	0	111.4	H163 I251 E253 W356 K377	H163-T249 VanDerWaalsContact CB-C 3.47Å; H163-T249 WeakPolarHBondContact CB-O 3.39Å; T249-I251 PolarHBondContact O-N 2.94Å; T249-E253 PolarHBondContact OG1-OE1 2.59Å; T249-W356 HydrophobicContact CG2-CH2 4.05Å; T249-W356 HydrophobicContact CG2-CZ3 4Å; T249-K377 HydrophobicContact CG2-CB 3.73Å; T249-K377 HydrophobicContact CG2-CD 3.97Å; T249-K377 HydrophobicContact CG2-CG 3.9Å
250	D	96.1	Very high	97.5	Very high	14 Å²	14	19.6 Å²	19.6	8%	0.075	10%	0.103	C	C	.	.			trans	-66.1	128.5	177.4	-169.6	-5.1	0	0	0	111.5	H163 R165 A252 E253	H163-D250 WeakPolarHBondContact O-CB 2.93Å; R165-D250 VanDerWaalsContact CB-OD2 3.26Å; R165-D250 WeakPolarHBondContact CB-OD2 3.13Å; R165-D250 VanDerWaalsContact CD-OD2 3.31Å; R165-D250 WeakPolarHBondContact CD-OD2 3.29Å; R165-D250 WeakPolarHBondContact CG-OD2 3.31Å; R165-D250 PolarHBondContact N-OD2 3.23Å; D250-A252 PolarHBondContact O-N 3.02Å; D250-A252 PolarHBondContact OD1-N 2.8Å; D250-E253 WeakPolarHBondContact O-CB 3.3Å; D250-E253 PolarHBondContact O-N 3.13Å
251	I	98	Very high	97.4	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-64.4	-21.7	177.7	-167.5	166.2	0	0	0	112.5	I138 V140 V160 L168 I239 L241 F247 T249 E253 L254 W255	I138-I251 HydrophobicContact CD1-CG2 4.04Å; I138-I251 HydrophobicContact CG2-CG1 4.49Å; I138-I251 HydrophobicContact CG2-CG2 4.36Å; V140-I251 HydrophobicContact CG2-CD1 3.66Å; V160-I251 HydrophobicContact CG1-CB 4.33Å; V160-I251 HydrophobicContact CG1-CD1 4.19Å; V160-I251 HydrophobicContact CG1-CG2 4.01Å; L168-I251 HydrophobicContact CD2-CG2 3.92Å; I239-I251 HydrophobicContact CD1-CD1 4.09Å; I239-I251 HydrophobicContact CD1-CG1 3.76Å; L241-I251 HydrophobicContact CD1-CD1 4.4Å; F247-I251 HydrophobicContact CD1-CB 4.3Å; F247-I251 HydrophobicContact CE1-CB 3.89Å; F247-I251 HydrophobicContact CE1-CD1 4.09Å; F247-I251 HydrophobicContact CE1-CG1 3.75Å; F247-I251 HydrophobicContact CZ-CD1 3.87Å; F247-I251 HydrophobicContact CZ-CG1 4.01Å; T249-I251 PolarHBondContact O-N 2.94Å; I251-E253 PolarHBondContact O-N 3.27Å; I251-L254 WeakPolarHBondContact O-CB 3.24Å; I251-L254 PolarHBondContact O-N 3.04Å; I251-W255 PolarHBondContact O-N 2.97Å
252	A	97.5	Very high	97.3	Very high	9 Å²	9	28.2 Å²	28.2	7%	0.074	14%	0.14	C	C	.	.	H	α-helix	trans	-57.6	-34.5	173.8	0	0	0	0	0	112.8	V132 I138 N166 D250 L254 W255 A256	V132-A252 HydrophobicContact CB-CB 4.35Å; V132-A252 HydrophobicContact CG2-CB 4.23Å; V132-A252 VanDerWaalsContact CG2-O 3.25Å; V132-A252 WeakPolarHBondContact CG2-O 3.15Å; I138-A252 VanDerWaalsContact CD1-CA 3.47Å; I138-A252 HydrophobicContact CD1-CB 3.71Å; N166-A252 VanDerWaalsContact OD1-CB 3.27Å; N166-A252 WeakPolarHBondContact OD1-CB 3.4Å; D250-A252 PolarHBondContact O-N 3.02Å; D250-A252 PolarHBondContact OD1-N 2.8Å; A252-L254 VanDerWaalsContact C-N 3.28Å; A252-L254 PolarHBondContact O-N 2.88Å; A252-W255 WeakPolarHBondContact O-CB 3.42Å; A252-W255 PolarHBondContact O-N 3.12Å; A252-A256 PolarHBondContact O-N 3.43Å
253	E	97.3	Very high	97.1	Very high	61 Å²	61	29.7 Å²	29.7	29%	0.285	17%	0.165	S	C	.	.	H	α-helix	trans	-65	-32.7	175.5	-71.3	-177.5	-107.6	0	0	112.5	T249 D250 I251 W356 K377	T249-E253 PolarHBondContact OG1-OE1 2.59Å; D250-E253 WeakPolarHBondContact O-CB 3.3Å; D250-E253 PolarHBondContact O-N 3.13Å; I251-E253 PolarHBondContact O-N 3.27Å; E253-W356 HydrophobicContact CB-CH2 3.63Å; E253-W356 HydrophobicContact CB-CZ2 3.96Å; E253-K377 IonicContact OE2-NZ 2.78Å; E253-K377 PolarHBondContact OE2-NZ 3.45Å
254	L	98.1	Very high	97.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-73.7	-42.7	173.6	-175.3	53.1	0	0	0	110.4	I239 F247 I251 A252 A256 V257 V299 L301 W356	I239-L254 HydrophobicContact CD1-CB 4.18Å; I239-L254 HydrophobicContact CD1-CD2 4.13Å; I239-L254 HydrophobicContact CD1-CG 3.99Å; I239-L254 HydrophobicContact CG2-CD2 3.99Å; F247-L254 HydrophobicContact CE1-CD2 4.48Å; F247-L254 HydrophobicContact CZ-CD2 4.35Å; I251-L254 WeakPolarHBondContact O-CB 3.24Å; I251-L254 PolarHBondContact O-N 3.04Å; A252-L254 VanDerWaalsContact C-N 3.28Å; A252-L254 PolarHBondContact O-N 2.88Å; L254-A256 VanDerWaalsContact C-N 3.29Å; L254-A256 PolarHBondContact O-N 3.42Å; L254-V257 HydrophobicContact CD1-CG2 4.41Å; L254-V257 WeakPolarHBondContact O-CB 3.5Å; L254-V257 WeakPolarHBondContact O-CG2 3.49Å; L254-V257 PolarHBondContact O-N 3.09Å; L254-V299 HydrophobicContact CD2-CG1 3.76Å; L254-L301 HydrophobicContact CD1-CD1 3.54Å; L254-L301 HydrophobicContact CD1-CD2 4.28Å; L254-L301 HydrophobicContact CD1-CG 4.44Å; L254-L301 HydrophobicContact CD2-CD1 4.26Å; L254-L301 HydrophobicContact CG-CD1 3.9Å; L254-W356 HydrophobicContact CB-CD2 4.46Å; L254-W356 HydrophobicContact CB-CE3 3.96Å; L254-W356 HydrophobicContact CB-CH2 3.68Å; L254-W356 HydrophobicContact CB-CZ2 4.17Å; L254-W356 HydrophobicContact CB-CZ3 3.57Å; L254-W356 HydrophobicContact CD1-CB 4.42Å; L254-W356 HydrophobicContact CD1-CD2 3.64Å; L254-W356 HydrophobicContact CD1-CE3 3.78Å; L254-W356 HydrophobicContact CD1-CG 3.95Å; L254-W356 HydrophobicContact CD1-CZ2 4.42Å; L254-W356 HydrophobicContact CD1-CZ3 4.28Å; L254-W356 HydrophobicContact CD2-CE3 4.14Å; L254-W356 HydrophobicContact CD2-CZ3 4.4Å; L254-W356 HydrophobicContact CG-CD2 4.5Å; L254-W356 HydrophobicContact CG-CE3 4.17Å; L254-W356 HydrophobicContact CG-CZ3 4.29Å; L254-W356 VanDerWaalsContact N-CH2 3.27Å
255	W	98.6	Very high	97.2	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.015	19%	0.192	C	C	.	.	H	α-helix	trans	-58.1	-41.3	177.2	-172.3	-105.3	0	0	0	112.2	V132 E136 I138 H139 R237 I239 I251 A252 V257 F258	V132-W255 HydrophobicContact CG2-CB 4.39Å; E136-W255 PolarHBondContact OE1-NE1 3.12Å; I138-W255 HydrophobicContact CB-CD2 4.36Å; I138-W255 HydrophobicContact CB-CE3 4.47Å; I138-W255 HydrophobicContact CD1-CB 4.15Å; I138-W255 HydrophobicContact CD1-CG 4.36Å; I138-W255 HydrophobicContact CG1-CB 4.24Å; I138-W255 HydrophobicContact CG1-CD2 4.17Å; I138-W255 HydrophobicContact CG1-CG 3.94Å; I138-W255 HydrophobicContact CG2-CB 4.31Å; I138-W255 HydrophobicContact CG2-CD2 3.94Å; I138-W255 HydrophobicContact CG2-CE3 3.68Å; I138-W255 HydrophobicContact CG2-CG 4.24Å; I138-W255 HydrophobicContact CG2-CZ3 4.18Å; H139-W255 HydrophobicContact CB-CH2 3.97Å; H139-W255 HydrophobicContact CB-CZ3 4.31Å; H139-W255 WeakPolarHBondContact O-CZ3 3.33Å; R237-W255 HydrophobicContact CB-CH2 4.49Å; R237-W255 HydrophobicContact CG-CH2 3.55Å; R237-W255 HydrophobicContact CG-CZ2 3.62Å; R237-W255 HydrophobicContact CG-CZ3 4.23Å; R237-W255 VanDerWaalsContact NE-CZ2 3.35Å; R237-W255 WeakPolarHBondContact O-CH2 3.43Å; I239-W255 HydrophobicContact CD1-CB 4.18Å; I239-W255 HydrophobicContact CD1-CE3 3.73Å; I239-W255 HydrophobicContact CG1-CE3 3.81Å; I239-W255 HydrophobicContact CG1-CZ3 4.25Å; I251-W255 PolarHBondContact O-N 2.97Å; A252-W255 WeakPolarHBondContact O-CB 3.42Å; A252-W255 PolarHBondContact O-N 3.12Å; W255-V257 PolarHBondContact O-N 3.01Å; W255-F258 HydrophobicContact CD2-CD2 4.23Å; W255-F258 HydrophobicContact CD2-CE2 4.35Å; W255-F258 HydrophobicContact CE3-CD2 4.07Å; W255-F258 AromaticContact CE3-CE2 3.74Å; W255-F258 HydrophobicContact CE3-CE2 3.74Å; W255-F258 AromaticContact CZ3-CE2 3.92Å; W255-F258 HydrophobicContact CZ3-CE2 3.92Å; W255-F258 WeakPolarHBondContact O-CD2 2.97Å; W255-F258 PolarHBondContact O-N 3.28Å; W255-F258 VanDerWaalsContact O-N 3.14Å
256	A	97.9	Very high	97.2	Very high	5 Å²	5	35.7 Å²	35.7	4%	0.041	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-57.3	-23.8	175.3	0	0	0	0	0	113.8	P130 V132 A252 L254 F258 H259	P130-A256 HydrophobicContact CB-CB 4.43Å; P130-A256 VanDerWaalsContact O-CB 3.29Å; P130-A256 WeakPolarHBondContact O-CB 3.47Å; V132-A256 HydrophobicContact CG2-CB 3.88Å; A252-A256 PolarHBondContact O-N 3.43Å; L254-A256 VanDerWaalsContact C-N 3.29Å; L254-A256 PolarHBondContact O-N 3.42Å; A256-F258 PolarHBondContact O-N 3.41Å; A256-H259 WeakPolarHBondContact O-CB 3.47Å; A256-H259 PolarHBondContact O-N 2.97Å; A256-H259 VanDerWaalsContact O-N 3.15Å; A256-H259 PolarHBondContact O-ND1 3.21Å; A256-H259 VanDerWaalsContact O-ND1 3.15Å
257	V	98.1	Very high	97.3	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.03	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.5	-23.4	-180	-176.6	0	0	0	0	112.2	L254 W255 H259 K260 F261 L301 Y350 L352	L254-V257 HydrophobicContact CD1-CG2 4.41Å; L254-V257 WeakPolarHBondContact O-CB 3.5Å; L254-V257 WeakPolarHBondContact O-CG2 3.49Å; L254-V257 PolarHBondContact O-N 3.09Å; W255-V257 PolarHBondContact O-N 3.01Å; V257-H259 PolarHBondContact O-N 3.22Å; V257-K260 HydrophobicContact CG1-CD 4.43Å; V257-K260 WeakPolarHBondContact O-CB 3.49Å; V257-K260 PolarHBondContact O-N 2.9Å; V257-F261 HydrophobicContact CG1-CE1 4.4Å; V257-L301 HydrophobicContact CB-CD2 3.91Å; V257-L301 HydrophobicContact CG1-CD2 4.24Å; V257-Y350 HydrophobicContact CG1-CD1 4.13Å; V257-Y350 HydrophobicContact CG1-CE1 3.6Å; V257-L352 HydrophobicContact CB-CD2 4.43Å; V257-L352 HydrophobicContact CG1-CD2 3.58Å
258	F	98.2	Very high	97.4	Very high	9 Å²	9	35.6 Å²	35.6	4%	0.039	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-55.1	-34.2	172.9	-80.9	-66.9	0	0	0	112.8	R237 V238 I239 W255 A256 K260 F261 L301 L303	R237-F258 HydrophobicContact CB-CD1 4.32Å; R237-F258 HydrophobicContact CB-CD2 4.39Å; R237-F258 HydrophobicContact CB-CE1 3.98Å; R237-F258 HydrophobicContact CB-CE2 4.08Å; R237-F258 HydrophobicContact CB-CZ 3.86Å; R237-F258 HydrophobicContact CG-CD2 4.29Å; R237-F258 HydrophobicContact CG-CE2 4.26Å; V238-F258 WeakPolarHBondContact O-CZ 3.15Å; I239-F258 HydrophobicContact CG1-CE2 4.24Å; W255-F258 HydrophobicContact CD2-CD2 4.23Å; W255-F258 HydrophobicContact CD2-CE2 4.35Å; W255-F258 HydrophobicContact CE3-CD2 4.07Å; W255-F258 AromaticContact CE3-CE2 3.74Å; W255-F258 HydrophobicContact CE3-CE2 3.74Å; W255-F258 AromaticContact CZ3-CE2 3.92Å; W255-F258 HydrophobicContact CZ3-CE2 3.92Å; W255-F258 WeakPolarHBondContact O-CD2 2.97Å; W255-F258 PolarHBondContact O-N 3.28Å; W255-F258 VanDerWaalsContact O-N 3.14Å; A256-F258 PolarHBondContact O-N 3.41Å; F258-K260 PolarHBondContact O-N 3.07Å; F258-F261 HydrophobicContact CD1-CE2 4.14Å; F258-F261 HydrophobicContact CD1-CZ 4.18Å; F258-F261 HydrophobicContact CE1-CE2 4.31Å; F258-F261 HydrophobicContact CE1-CZ 4.39Å; F258-F261 WeakPolarHBondContact O-CB 3.43Å; F258-F261 PolarHBondContact O-N 3.03Å; F258-F261 VanDerWaalsContact O-N 3.16Å; F258-L301 HydrophobicContact CD1-CB 4.35Å; F258-L301 HydrophobicContact CD1-CD2 4.36Å; F258-L301 HydrophobicContact CD2-CD2 4.13Å; F258-L301 HydrophobicContact CE1-CB 3.65Å; F258-L301 HydrophobicContact CE1-CD2 4.35Å; F258-L301 HydrophobicContact CE1-CG 4.31Å; F258-L301 HydrophobicContact CE2-CB 4.24Å; F258-L301 HydrophobicContact CE2-CD2 4.1Å; F258-L301 HydrophobicContact CE2-CG 4.07Å; F258-L301 HydrophobicContact CG-CD2 4.26Å; F258-L301 HydrophobicContact CZ-CB 3.58Å; F258-L301 HydrophobicContact CZ-CD2 4.22Å; F258-L301 HydrophobicContact CZ-CG 3.92Å; F258-L303 HydrophobicContact CD1-CD2 3.39Å; F258-L303 HydrophobicContact CD1-CG 3.96Å; F258-L303 HydrophobicContact CE1-CD2 3.65Å; F258-L303 HydrophobicContact CE1-CG 4.03Å; F258-L303 HydrophobicContact CG-CD2 4.32Å
259	H	96.8	Very high	97.5	Very high	97 Å²	97	34.3 Å²	34.3	45%	0.449	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-67.3	-14.4	177.3	-57.1	105.5	0	0	0	113.5	P130 R237 A256 V257	P130-H259 HydrophobicContact CB-CB 3.97Å; P130-H259 HydrophobicContact CG-CB 3.98Å; R237-H259 PolarHBondContact NH1-NE2 2.84Å; A256-H259 WeakPolarHBondContact O-CB 3.47Å; A256-H259 PolarHBondContact O-N 2.97Å; A256-H259 VanDerWaalsContact O-N 3.15Å; A256-H259 PolarHBondContact O-ND1 3.21Å; A256-H259 VanDerWaalsContact O-ND1 3.15Å; V257-H259 PolarHBondContact O-N 3.22Å
260	K	97.1	Very high	97.6	Very high	76 Å²	76	33 Å²	33	33%	0.33	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-87.6	-11.3	177.6	-56.8	-175.2	-178.5	177.6	0	112.8	V257 F258 Y350	V257-K260 HydrophobicContact CG1-CD 4.43Å; V257-K260 WeakPolarHBondContact O-CB 3.49Å; V257-K260 PolarHBondContact O-N 2.9Å; F258-K260 PolarHBondContact O-N 3.07Å; K260-Y350 HydrophobicContact CB-CE2 3.73Å; K260-Y350 WeakPolarHBondContact CD-OH 3.38Å; K260-Y350 WeakPolarHBondContact O-CE2 3.5Å
261	F	97.8	Very high	97.7	Very high	20 Å²	20	34.6 Å²	34.6	9%	0.088	18%	0.179	C	C	.	.			trans	-68.5	133.7	178.4	-74.5	27.2	0	0	0	109.3	V257 F258 Q265 G268 L301 L303 Y350	V257-F261 HydrophobicContact CG1-CE1 4.4Å; F258-F261 HydrophobicContact CD1-CE2 4.14Å; F258-F261 HydrophobicContact CD1-CZ 4.18Å; F258-F261 HydrophobicContact CE1-CE2 4.31Å; F258-F261 HydrophobicContact CE1-CZ 4.39Å; F258-F261 WeakPolarHBondContact O-CB 3.43Å; F258-F261 PolarHBondContact O-N 3.03Å; F258-F261 VanDerWaalsContact O-N 3.16Å; F261-Q265 HydrophobicContact CB-CB 4.13Å; F261-Q265 HydrophobicContact CD2-CB 4.17Å; F261-Q265 HydrophobicContact CG-CB 4.25Å; F261-G268 VanDerWaalsContact CZ-CA 3.45Å; F261-G268 VanDerWaalsContact CZ-N 3.31Å; F261-L301 HydrophobicContact CE1-CD2 4.31Å; F261-L301 HydrophobicContact CZ-CB 3.82Å; F261-L301 HydrophobicContact CZ-CD2 4.27Å; F261-L303 HydrophobicContact CB-CD1 4.49Å; F261-L303 HydrophobicContact CD2-CD1 3.67Å; F261-L303 HydrophobicContact CD2-CG 4.03Å; F261-L303 HydrophobicContact CE2-CD1 4.35Å; F261-L303 HydrophobicContact CE2-CG 4.22Å; F261-Y350 HydrophobicContact CD1-CD1 4.06Å; F261-Y350 AromaticContact CD1-CD2 3.96Å; F261-Y350 HydrophobicContact CD1-CD2 3.96Å; F261-Y350 AromaticContact CD1-CG 3.58Å; F261-Y350 HydrophobicContact CD1-CG 3.58Å; F261-Y350 AromaticContact CE1-CD1 3.73Å; F261-Y350 HydrophobicContact CE1-CD1 3.73Å; F261-Y350 HydrophobicContact CE1-CD2 4.44Å; F261-Y350 AromaticContact CE1-CG 3.64Å; F261-Y350 HydrophobicContact CE1-CG 3.64Å; F261-Y350 HydrophobicContact CG-CG 4.5Å
262	K	95.5	Very high	97.7	Very high	162 Å²	162	34.8 Å²	34.8	70%	0.704	18%	0.18	S	C	*	.			trans	-127.5	155.2	-178.5	-65.3	-179.5	-178.3	-177.3	0	110.6	Q264 Q265	K262-Q264 PolarHBondContact O-N 2.75Å; K262-Q265 WeakPolarHBondContact O-CB 3.4Å; K262-Q265 VanDerWaalsContact O-CG 3.26Å; K262-Q265 WeakPolarHBondContact O-CG 3.26Å; K262-Q265 PolarHBondContact O-N 3.31Å; K262-Q265 VanDerWaalsContact O-N 3.15Å; K262-Q265 PolarHBondContact O-OE1 3.08Å
263	G	95.4	Very high	97.6	Very high	71 Å²	71	34.9 Å²	34.9	73%	0.732	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	-124.8	177.5	0	0	0	0	0	112.6
264	Q	96.1	Very high	97.4	Very high	115 Å²	115	32.4 Å²	32.4	54%	0.537	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	10.9	-177.5	-65.9	180	-46.7	0	0	113.7	K262 V266 F347	K262-Q264 PolarHBondContact O-N 2.75Å; Q264-V266 PolarHBondContact O-N 3.46Å; Q264-F347 HydrophobicContact CB-CD2 3.77Å; Q264-F347 HydrophobicContact CB-CE2 4.32Å
265	Q	98.6	Very high	97.2	Very high	42 Å²	42	33.6 Å²	33.6	20%	0.196	18%	0.175	C	C	.	.			trans	-65.8	128.4	177.3	-68.2	173.4	-31.9	0	0	110.6	F261 K262 L348 V349	F261-Q265 HydrophobicContact CB-CB 4.13Å; F261-Q265 HydrophobicContact CD2-CB 4.17Å; F261-Q265 HydrophobicContact CG-CB 4.25Å; K262-Q265 WeakPolarHBondContact O-CB 3.4Å; K262-Q265 VanDerWaalsContact O-CG 3.26Å; K262-Q265 WeakPolarHBondContact O-CG 3.26Å; K262-Q265 PolarHBondContact O-N 3.31Å; K262-Q265 VanDerWaalsContact O-N 3.15Å; K262-Q265 PolarHBondContact O-OE1 3.08Å; Q265-L348 WeakPolarHBondContact CA-O 3.33Å; Q265-V349 PolarHBondContact NE2-O 3.28Å
266	V	98.7	Very high	96.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	18%	0.184	C	C	.	.			trans	-136.6	-12.7	-177.5	-64.9	0	0	0	0	113.2	Q264 L303 K306 L307 M310 L348	Q264-V266 PolarHBondContact O-N 3.46Å; V266-L303 HydrophobicContact CB-CB 4.36Å; V266-L303 PolarHBondContact O-N 3.45Å; V266-K306 HydrophobicContact CG1-CB 3.49Å; V266-K306 VanDerWaalsContact CG1-CB 3.49Å; V266-K306 HydrophobicContact CG1-CD 3.89Å; V266-K306 HydrophobicContact CG1-CG 4.35Å; V266-L307 HydrophobicContact CB-CD2 4.12Å; V266-L307 HydrophobicContact CB-CG 4.1Å; V266-L307 HydrophobicContact CG2-CD2 3.63Å; V266-L307 HydrophobicContact CG2-CG 4.18Å; V266-M310 HydrophobicContact CG1-SD 4.04Å; V266-M310 HydrophobicContact CG2-SD 4.41Å; V266-L348 HydrophobicContact CG2-CB 4.03Å; V266-L348 HydrophobicContact CG2-CD2 3.89Å; V266-L348 HydrophobicContact CG2-CG 4.4Å; V266-L348 PolarHBondContact N-O 3.32Å
267	L	98.8	Very high	96.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.6	177.1	-57.5	176.5	0	0	0	109.8	L269 L301 L302 L307 W312 F338 I342 L348 V349 Y350	L267-L269 HydrophobicContact CB-CD1 4.22Å; L267-L269 HydrophobicContact CD1-CD1 4.47Å; L267-L301 CarbonylContact C-O 3.1Å; L267-L301 WeakPolarHBondContact CA-O 3.41Å; L267-L302 HydrophobicContact CD2-CD2 3.3Å; L267-L307 HydrophobicContact CD2-CD1 4.08Å; L267-L307 HydrophobicContact CD2-CD2 4.11Å; L267-W312 HydrophobicContact CD1-CH2 4.22Å; L267-W312 HydrophobicContact CD1-CZ3 4.25Å; L267-F338 HydrophobicContact CD1-CD1 4.17Å; L267-F338 HydrophobicContact CD1-CE1 4.38Å; L267-F338 HydrophobicContact CD2-CE1 4.05Å; L267-I342 HydrophobicContact CD1-CD1 4.04Å; L267-I342 HydrophobicContact CD1-CG1 4.02Å; L267-L348 PolarHBondContact N-O 3.25Å; L267-V349 HydrophobicContact CB-CG2 4.48Å; L267-V349 CarbonylContact O-C 3.46Å; L267-V349 WeakPolarHBondContact O-CA 3.45Å; L267-Y350 PolarHBondContact O-N 3.29Å
268	G	98.8	Very high	96.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.7	165.4	0	0	0	0	0	110	F261 I300 L301 Y350	F261-G268 VanDerWaalsContact CZ-CA 3.45Å; F261-G268 VanDerWaalsContact CZ-N 3.31Å; G268-I300 WeakPolarHBondContact O-CA 3.49Å; G268-L301 PolarHBondContact N-O 2.89Å; G268-L301 PolarHBondContact O-N 2.82Å; G268-Y350 WeakPolarHBondContact CA-O 3.47Å
269	L	98.8	Very high	96.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	150.7	-174.3	-71.7	161.9	0	0	0	110.9	L267 Y295 N296 I300 I342 Y350 L352	L267-L269 HydrophobicContact CB-CD1 4.22Å; L267-L269 HydrophobicContact CD1-CD1 4.47Å; L269-Y295 HydrophobicContact CB-CD1 3.58Å; L269-Y295 HydrophobicContact CB-CE1 4.42Å; L269-Y295 HydrophobicContact CB-CG 3.95Å; L269-Y295 HydrophobicContact CD1-CG 4.22Å; L269-N296 WeakPolarHBondContact CD2-O 3.41Å; L269-I300 HydrophobicContact CD2-CB 4.04Å; L269-I300 HydrophobicContact CD2-CD1 4.42Å; L269-I300 HydrophobicContact CD2-CG1 3.75Å; L269-I300 HydrophobicContact CD2-CG2 3.67Å; L269-I300 HydrophobicContact CG-CG2 4.19Å; L269-I342 HydrophobicContact CD1-CD1 3.49Å; L269-I342 VanDerWaalsContact CD1-CD1 3.49Å; L269-Y350 PolarHBondContact N-O 3.3Å; L269-L352 PolarHBondContact O-N 2.73Å
270	V	98.6	Very high	95.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	135.3	170.8	172.5	0	0	0	0	109.3	N272 Y295 N296 L352 C354 W356 N357	V270-N272 PolarHBondContact O-N 2.9Å; V270-Y295 WeakPolarHBondContact O-CA 3.5Å; V270-N296 PolarHBondContact O-N 3.39Å; V270-L352 HydrophobicContact CG2-CB 3.52Å; V270-L352 HydrophobicContact CG2-CD1 4.15Å; V270-L352 HydrophobicContact CG2-CG 4.48Å; V270-C354 HydrophobicContact CG1-CB 3.83Å; V270-W356 HydrophobicContact CG2-CB 4.12Å; V270-N357 HydrophobicContact CB-CB 3.7Å; V270-N357 HydrophobicContact CG1-CB 4.04Å; V270-N357 HydrophobicContact CG2-CB 3.57Å
271	E	98.1	Very high	95	Very high	49 Å²	49	39.7 Å²	39.7	23%	0.229	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	137.7	172.8	-166.9	-168.6	-140.4	0	0	109.8	Q273 R293 G294 Q359	E271-Q273 PolarHBondContact O-N 3.5Å; E271-R293 HydrophobicContact CG-CB 4.04Å; E271-R293 IonicContact OE1-CZ 3.89Å; E271-R293 IonicContact OE1-NE 3.68Å; E271-R293 IonicContact OE1-NH2 2.99Å; E271-R293 PolarHBondContact OE1-NH2 3.46Å; E271-R293 IonicContact OE2-CZ 2.71Å; E271-R293 VanDerWaalsContact OE2-CZ 3.3Å; E271-R293 IonicContact OE2-NE 2.76Å; E271-R293 PolarHBondContact OE2-NE 3.35Å; E271-R293 VanDerWaalsContact OE2-NE 3.09Å; E271-R293 IonicContact OE2-NH2 3.53Å; E271-R293 PolarHBondContact OE2-NH2 2.8Å; E271-G294 CarbonylContact C-O 3.59Å; E271-G294 WeakPolarHBondContact CA-O 3.09Å; E271-G294 VanDerWaalsContact CG-O 3.26Å; E271-G294 WeakPolarHBondContact CG-O 3.23Å; E271-Q359 PolarHBondContact O-NE2 3.18Å; E271-Q359 VanDerWaalsContact O-NE2 3.11Å
272	N	97.1	Very high	94.4	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.027	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-62.6	128.8	176.8	176.4	69.6	0	0	0	109.7	V270 S274 R293 G294 Q359	V270-N272 PolarHBondContact O-N 2.9Å; N272-S274 PolarHBondContact ND2-N 3.3Å; N272-S274 PolarHBondContact ND2-O 3.09Å; N272-S274 PolarHBondContact ND2-OG 2.81Å; N272-S274 PolarHBondContact O-N 3Å; N272-R293 WeakPolarHBondContact CB-O 3.3Å; N272-R293 PolarHBondContact ND2-O 3.04Å; N272-R293 WeakPolarHBondContact O-CB 3.41Å; N272-G294 PolarHBondContact N-O 3.41Å; N272-Q359 PolarHBondContact OD1-OE1 3.05Å
273	Q	95.3	Very high	94	Very high	10 Å²	10	46.4 Å²	46.4	5%	0.047	24%	0.241	C	C	.	.	S	Bend	trans	-88.7	24.7	-172.3	-67.1	169.1	8.8	0	0	112.2	E271 C354 N357 Q359 T364 R365 S366 C369	E271-Q273 PolarHBondContact O-N 3.5Å; Q273-C354 PolarHBondContact NE2-O 2.99Å; Q273-N357 PolarHBondContact NE2-O 3.14Å; Q273-Q359 HydrophobicContact CB-CB 4.22Å; Q273-T364 CarbonylContact O-C 3.27Å; Q273-T364 WeakPolarHBondContact O-CA 3.16Å; Q273-R365 WeakPolarHBondContact O-CB 3.41Å; Q273-R365 PolarHBondContact O-N 3.27Å; Q273-S366 VanDerWaalsContact OE1-CA 3.26Å; Q273-C369 PolarHBondContact NE2-SG 3Å
274	S	92.7	Very high	93.5	Very high	10 Å²	10	50.1 Å²	50.1	7%	0.07	24%	0.243	C	C	.	.	S	Bend	trans	-136	163	173.3	73.1	0	0	0	0	110.4	N272 W276	N272-S274 PolarHBondContact ND2-N 3.3Å; N272-S274 PolarHBondContact ND2-O 3.09Å; N272-S274 PolarHBondContact ND2-OG 2.81Å; N272-S274 PolarHBondContact O-N 3Å; S274-W276 PolarHBondContact O-N 3.07Å
275	D	93.8	Very high	93.1	Very high	25 Å²	25	45.7 Å²	45.7	13%	0.134	22%	0.223	C	C	.	.	S	Bend	trans	-83.8	19.1	178.7	-63.8	-25.9	0	0	0	112.7	Y277 L278 N280 L281 R365	D275-Y277 PolarHBondContact O-N 2.67Å; D275-L278 HydrophobicContact CB-CB 4.35Å; D275-L278 HydrophobicContact CB-CD1 3.93Å; D275-L278 HydrophobicContact CB-CG 4.32Å; D275-L278 WeakPolarHBondContact O-CB 3.08Å; D275-L278 PolarHBondContact O-N 2.91Å; D275-L278 WeakPolarHBondContact OD1-CD1 3.25Å; D275-N280 WeakPolarHBondContact CB-OD1 3.21Å; D275-N280 PolarHBondContact O-OD1 2.85Å; D275-L281 HydrophobicContact CB-CD2 4.03Å; D275-R365 IonicContact OD1-CZ 3.92Å; D275-R365 IonicContact OD1-NE 2.81Å; D275-R365 PolarHBondContact OD1-NE 2.89Å; D275-R365 IonicContact OD1-NH2 3.41Å; D275-R365 PolarHBondContact OD1-NH2 3.37Å; D275-R365 IonicContact OD2-CZ 2.69Å; D275-R365 IonicContact OD2-NE 2.79Å; D275-R365 IonicContact OD2-NH2 2.7Å; D275-R365 PolarHBondContact OD2-NH2 3.02Å
276	W	93.9	Very high	92.8	Very high	51 Å²	51	51.9 Å²	51.9	19%	0.193	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-47.5	-57.6	-179.5	-179.6	-88.8	0	0	0	112.1	S274 L278 G279 L281 W282 H285 L332	S274-W276 PolarHBondContact O-N 3.07Å; W276-L278 PolarHBondContact O-N 3.01Å; W276-L278 VanDerWaalsContact O-N 3.17Å; W276-G279 PolarHBondContact O-N 2.9Å; W276-L281 HydrophobicContact CB-CD1 4.18Å; W276-L281 HydrophobicContact CE3-CD1 3.99Å; W276-W282 HydrophobicContact CE3-CH2 4.08Å; W276-W282 HydrophobicContact CH2-CH2 4.09Å; W276-W282 AromaticContact CZ3-CH2 3.57Å; W276-W282 HydrophobicContact CZ3-CH2 3.57Å; W276-W282 HydrophobicContact CZ3-CZ3 4.36Å; W276-H285 AromaticContact CD2-CE1 3.96Å; W276-H285 AromaticContact CD2-NE2 3.98Å; W276-H285 AromaticContact CE2-NE2 3.82Å; W276-H285 AromaticContact CZ2-NE2 3.9Å; W276-H285 PolarHBondContact O-CE1 3.01Å; W276-H285 PolarHBondContact O-ND1 2.99Å; W276-L332 HydrophobicContact CD2-CD1 3.87Å; W276-L332 HydrophobicContact CG-CD1 3.92Å; W276-L332 HydrophobicContact CH2-CD2 4.35Å; W276-L332 HydrophobicContact CZ2-CD1 4.13Å; W276-L332 HydrophobicContact CZ2-CD2 4.1Å; W276-L332 HydrophobicContact CZ2-CG 3.88Å; W276-L332 VanDerWaalsContact NE1-CD1 3.3Å
277	Y	96.1	Very high	92.6	Very high	15 Å²	15	53 Å²	53	6%	0.059	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-75.2	-4.9	-176.6	-67	-78.1	0	0	0	114.8	D275 G279 P287 W288 A290 R293 L332 Q335 D336 N339	D275-Y277 PolarHBondContact O-N 2.67Å; Y277-G279 VanDerWaalsContact C-N 3.31Å; Y277-P287 HydrophobicContact CD1-CB 4.06Å; Y277-P287 WeakPolarHBondContact O-CG 3.29Å; Y277-W288 WeakPolarHBondContact CD1-O 3.17Å; Y277-W288 HydrophobicContact CE1-CB 4.37Å; Y277-A290 HydrophobicContact CD1-CB 3.63Å; Y277-A290 HydrophobicContact CD2-CB 4.42Å; Y277-A290 HydrophobicContact CE1-CB 4.38Å; Y277-A290 HydrophobicContact CG-CB 3.66Å; Y277-R293 WeakPolarHBondContact CD2-O 3.41Å; Y277-L332 HydrophobicContact CE2-CD1 4.39Å; Y277-Q335 VanDerWaalsContact CE2-NE2 3.35Å; Y277-Q335 PolarHBondContact OH-NE2 3.37Å; Y277-D336 VanDerWaalsContact CE1-OD1 3.29Å; Y277-D336 WeakPolarHBondContact CE1-OD1 3.26Å; Y277-D336 PolarHBondContact OH-OD1 2.85Å; Y277-N339 HydrophobicContact CE1-CB 4.33Å
278	L	94.7	Very high	92.5	Very high	78 Å²	78	53.2 Å²	53.2	41%	0.408	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-80.4	-12.1	173.8	-58.5	-176.1	0	0	0	112.9	D275 W276 N280 G292 R293	D275-L278 HydrophobicContact CB-CB 4.35Å; D275-L278 HydrophobicContact CB-CD1 3.93Å; D275-L278 HydrophobicContact CB-CG 4.32Å; D275-L278 WeakPolarHBondContact O-CB 3.08Å; D275-L278 PolarHBondContact O-N 2.91Å; D275-L278 WeakPolarHBondContact OD1-CD1 3.25Å; W276-L278 PolarHBondContact O-N 3.01Å; W276-L278 VanDerWaalsContact O-N 3.17Å; L278-N280 PolarHBondContact O-N 3.48Å; L278-G292 WeakPolarHBondContact CD2-O 3.41Å; L278-R293 HydrophobicContact CD1-CG 4.03Å; L278-R293 HydrophobicContact CD2-CG 4.36Å; L278-R293 HydrophobicContact CG-CG 4.09Å
279	G	88.4	Confident	92.5	Very high	26 Å²	26	55.1 Å²	55.1	27%	0.268	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	11.7	176	0	0	0	0	0	115	W276 Y277	W276-G279 PolarHBondContact O-N 2.9Å; Y277-G279 VanDerWaalsContact C-N 3.31Å
280	N	84.9	Confident	92.4	Very high	99 Å²	99	55.7 Å²	55.7	53%	0.529	27%	0.27	S	S	.	.			trans	-106.9	4.5	-173.6	63.1	-0.1	0	0	0	113.9	D275 L278	D275-N280 WeakPolarHBondContact CB-OD1 3.21Å; D275-N280 PolarHBondContact O-OD1 2.85Å; L278-N280 PolarHBondContact O-N 3.48Å
281	L	82.9	Confident	92.4	Very high	55 Å²	55	57.9 Å²	57.9	29%	0.288	28%	0.281	S	S	.	.	S	Bend	trans	-68.1	-38.6	-177.1	-69	-178.5	0	0	0	113.6	D275 W276	D275-L281 HydrophobicContact CB-CD2 4.03Å; W276-L281 HydrophobicContact CB-CD1 4.18Å; W276-L281 HydrophobicContact CE3-CD1 3.99Å
282	W	86.4	Confident	92.3	Very high	137 Å²	137	57.9 Å²	57.9	52%	0.519	29%	0.294	S	S	.	.	S	Bend	trans	-156	167	175	58.7	88.7	0	0	0	111.8	W276 N284 H285	W276-W282 HydrophobicContact CE3-CH2 4.08Å; W276-W282 HydrophobicContact CH2-CH2 4.09Å; W276-W282 AromaticContact CZ3-CH2 3.57Å; W276-W282 HydrophobicContact CZ3-CH2 3.57Å; W276-W282 HydrophobicContact CZ3-CZ3 4.36Å; W282-N284 PolarHBondContact O-N 2.63Å; W282-H285 HydrophobicContact CD2-CB 3.98Å; W282-H285 AromaticContact CE2-CD2 3.64Å; W282-H285 AromaticContact CE2-CG 3.77Å; W282-H285 HydrophobicContact CG-CB 4.09Å; W282-H285 AromaticContact CH2-CD2 3.67Å; W282-H285 AromaticContact CH2-NE2 3.73Å; W282-H285 HydrophobicContact CZ2-CB 4.18Å; W282-H285 AromaticContact CZ2-CD2 3.17Å; W282-H285 WeakPolarHBondContact CZ2-CD2 3.35Å; W282-H285 AromaticContact CZ2-CG 3.71Å; W282-H285 AromaticContact CZ2-NE2 3.69Å; W282-H285 VanDerWaalsContact O-CB 3.26Å; W282-H285 WeakPolarHBondContact O-CB 3.47Å; W282-H285 PolarHBondContact O-N 3.38Å
283	K	85.6	Confident	92.3	Very high	186 Å²	186	60.9 Å²	60.9	81%	0.809	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	128.5	-179.8	-168.3	176.6	-177	179	0	110.5	H285	K283-H285 VanDerWaalsContact C-N 3.25Å; K283-H285 PolarHBondContact O-N 2.9Å
284	N	84.9	Confident	92.4	Very high	148 Å²	148	60.4 Å²	60.4	79%	0.791	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	14.4	-176.4	-46.3	-34.8	0	0	0	115.1	W282 R286	W282-N284 PolarHBondContact O-N 2.63Å; N284-R286 PolarHBondContact O-N 3.36Å; N284-R286 VanDerWaalsContact O-N 3.15Å
285	H	89	Confident	92.7	Very high	23 Å²	23	61 Å²	61	11%	0.106	30%	0.304	C	S	.	.			trans	-64.9	115.1	169	-175.1	-137.5	0	0	0	109.9	W276 W282 K283	W276-H285 AromaticContact CD2-CE1 3.96Å; W276-H285 AromaticContact CD2-NE2 3.98Å; W276-H285 AromaticContact CE2-NE2 3.82Å; W276-H285 AromaticContact CZ2-NE2 3.9Å; W276-H285 PolarHBondContact O-CE1 3.01Å; W276-H285 PolarHBondContact O-ND1 2.99Å; W282-H285 HydrophobicContact CD2-CB 3.98Å; W282-H285 AromaticContact CE2-CD2 3.64Å; W282-H285 AromaticContact CE2-CG 3.77Å; W282-H285 HydrophobicContact CG-CB 4.09Å; W282-H285 AromaticContact CH2-CD2 3.67Å; W282-H285 AromaticContact CH2-NE2 3.73Å; W282-H285 HydrophobicContact CZ2-CB 4.18Å; W282-H285 AromaticContact CZ2-CD2 3.17Å; W282-H285 WeakPolarHBondContact CZ2-CD2 3.35Å; W282-H285 AromaticContact CZ2-CG 3.71Å; W282-H285 AromaticContact CZ2-NE2 3.69Å; W282-H285 VanDerWaalsContact O-CB 3.26Å; W282-H285 WeakPolarHBondContact O-CB 3.47Å; W282-H285 PolarHBondContact O-N 3.38Å; K283-H285 VanDerWaalsContact C-N 3.25Å; K283-H285 PolarHBondContact O-N 2.9Å
286	R	91.6	Very high	92.9	Very high	171 Å²	171	60 Å²	60	65%	0.645	30%	0.299	S	S	*	.			trans	-119.6	96.4	176	-171.7	178.5	-179.4	-157.5	-2.7	108.5	N284 G326 M327	N284-R286 PolarHBondContact O-N 3.36Å; N284-R286 VanDerWaalsContact O-N 3.15Å; R286-G326 PolarHBondContact NH1-O 2.91Å; R286-M327 HydrophobicContact CG-SD 4.35Å; R286-M327 WeakPolarHBondContact O-CE 3.45Å
287	P	94.6	Very high	93.1	Very high	26 Å²	26	57.8 Å²	57.8	17%	0.169	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-75.6	164.3	178	32.1	-35	0	0	0	110.8	Y277	Y277-P287 HydrophobicContact CD1-CB 4.06Å; Y277-P287 WeakPolarHBondContact O-CG 3.29Å
288	W	97.1	Very high	93.2	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.011	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-63	157.7	165.9	-83.3	66.9	0	0	0	111.1	Y277 A290 E323 L324 M327 S329 T330 D336 I337 A340	Y277-W288 WeakPolarHBondContact CD1-O 3.17Å; Y277-W288 HydrophobicContact CE1-CB 4.37Å; W288-A290 PolarHBondContact O-N 3.11Å; W288-E323 HydrophobicContact CE3-CB 3.74Å; W288-E323 HydrophobicContact CE3-CG 4.05Å; W288-E323 HydrophobicContact CH2-CB 3.77Å; W288-E323 HydrophobicContact CZ3-CB 3.31Å; W288-E323 HydrophobicContact CZ3-CG 3.89Å; W288-L324 HydrophobicContact CH2-CD2 4.05Å; W288-L324 HydrophobicContact CH2-CG 3.99Å; W288-L324 HydrophobicContact CZ2-CD2 3.84Å; W288-L324 HydrophobicContact CZ2-CG 4.28Å; W288-M327 HydrophobicContact CD2-CG 4.46Å; W288-M327 HydrophobicContact CG-CE 3.94Å; W288-M327 HydrophobicContact CZ2-CB 4.01Å; W288-S329 PolarHBondContact NE1-O 3.04Å; W288-T330 HydrophobicContact CH2-CG2 3.91Å; W288-T330 HydrophobicContact CZ2-CG2 3.57Å; W288-D336 HydrophobicContact CB-CB 3.79Å; W288-D336 HydrophobicContact CD2-CB 3.71Å; W288-D336 HydrophobicContact CE3-CB 4.08Å; W288-D336 HydrophobicContact CG-CB 3.55Å; W288-I337 HydrophobicContact CH2-CG1 4.38Å; W288-I337 HydrophobicContact CZ3-CG1 4.07Å; W288-A340 HydrophobicContact CE3-CB 4.19Å
289	P	97.3	Very high	93.4	Very high	40 Å²	40	53.4 Å²	53.4	26%	0.26	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-61.7	136.7	179.9	-21.2	32	0	0	0	112.6	E323 N339 A340 K343	P289-E323 HydrophobicContact CG-CG 4.25Å; P289-E323 WeakPolarHBondContact CG-OE2 3.29Å; P289-N339 CarbonylContact O-C 3.58Å; P289-A340 WeakPolarHBondContact O-CA 3.44Å; P289-A340 PolarHBondContact O-N 3.41Å; P289-A340 VanDerWaalsContact O-N 3.17Å; P289-K343 HydrophobicContact CB-CB 4.38Å; P289-K343 HydrophobicContact CB-CG 4.13Å
290	A	98.1	Very high	93.9	Very high	13 Å²	13	52.1 Å²	52.1	11%	0.107	26%	0.256	C	S	.	.			trans	-150.1	167.1	174.5	0	0	0	0	0	112.3	Y277 W288 N339 K343	Y277-A290 HydrophobicContact CD1-CB 3.63Å; Y277-A290 HydrophobicContact CD2-CB 4.42Å; Y277-A290 HydrophobicContact CE1-CB 4.38Å; Y277-A290 HydrophobicContact CG-CB 3.66Å; W288-A290 PolarHBondContact O-N 3.11Å; A290-N339 HydrophobicContact CB-CB 3.8Å; A290-K343 WeakPolarHBondContact O-CD 3.28Å; A290-K343 WeakPolarHBondContact O-CE 3.21Å; A290-K343 PolarHBondContact O-NZ 3.4Å; A290-K343 VanDerWaalsContact O-NZ 3.11Å
291	L	97.4	Very high	94.6	Very high	45 Å²	45	47.4 Å²	47.4	24%	0.236	23%	0.231	C	C	.	.	S	Bend	trans	-87.2	122.8	167.7	-64.2	174.3	0	0	0	109.7	R293 G294 I342 K343 P346	L291-R293 PolarHBondContact O-N 3.31Å; L291-G294 WeakPolarHBondContact O-CA 3.45Å; L291-G294 PolarHBondContact O-N 2.95Å; L291-I342 HydrophobicContact CD1-CG2 3.5Å; L291-I342 HydrophobicContact CG-CG2 4.14Å; L291-K343 HydrophobicContact CD2-CD 3.55Å; L291-K343 HydrophobicContact CG-CD 4.2Å; L291-P346 HydrophobicContact CD1-CB 3.57Å; L291-P346 HydrophobicContact CD2-CB 4.48Å
292	G	96.6	Very high	95.4	Very high	49 Å²	49	45 Å²	45	51%	0.505	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	-126.7	179.5	0	0	0	0	0	111.6	L278 G294	L278-G292 WeakPolarHBondContact CD2-O 3.41Å; G292-G294 PolarHBondContact O-N 3.28Å
293	R	96.6	Very high	96	Very high	69 Å²	69	39.3 Å²	39.3	26%	0.26	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-1.8	175	-78.9	-176	-72.2	-89.4	-3.4	114.2	E271 N272 Y277 L278 L291	E271-R293 HydrophobicContact CG-CB 4.04Å; E271-R293 IonicContact OE1-CZ 3.89Å; E271-R293 IonicContact OE1-NE 3.68Å; E271-R293 IonicContact OE1-NH2 2.99Å; E271-R293 PolarHBondContact OE1-NH2 3.46Å; E271-R293 IonicContact OE2-CZ 2.71Å; E271-R293 VanDerWaalsContact OE2-CZ 3.3Å; E271-R293 IonicContact OE2-NE 2.76Å; E271-R293 PolarHBondContact OE2-NE 3.35Å; E271-R293 VanDerWaalsContact OE2-NE 3.09Å; E271-R293 IonicContact OE2-NH2 3.53Å; E271-R293 PolarHBondContact OE2-NH2 2.8Å; N272-R293 WeakPolarHBondContact CB-O 3.3Å; N272-R293 PolarHBondContact ND2-O 3.04Å; N272-R293 WeakPolarHBondContact O-CB 3.41Å; Y277-R293 WeakPolarHBondContact CD2-O 3.41Å; L278-R293 HydrophobicContact CD1-CG 4.03Å; L278-R293 HydrophobicContact CD2-CG 4.36Å; L278-R293 HydrophobicContact CG-CG 4.09Å; L291-R293 PolarHBondContact O-N 3.31Å
294	G	98.1	Very high	96.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.			trans	73	-174.2	-172.3	0	0	0	0	0	112.6	E271 N272 L291 G292 N339	E271-G294 CarbonylContact C-O 3.59Å; E271-G294 WeakPolarHBondContact CA-O 3.09Å; E271-G294 VanDerWaalsContact CG-O 3.26Å; E271-G294 WeakPolarHBondContact CG-O 3.23Å; N272-G294 PolarHBondContact N-O 3.41Å; L291-G294 WeakPolarHBondContact O-CA 3.45Å; L291-G294 PolarHBondContact O-N 2.95Å; G292-G294 PolarHBondContact O-N 3.28Å; G294-N339 WeakPolarHBondContact CA-OD1 3.34Å
295	Y	98.6	Very high	97.1	Very high	22 Å²	22	25.1 Å²	25.1	9%	0.086	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.2	-178.4	-67.4	-84.6	0	0	0	110.7	L269 V270 Q335 N339 I342 V349 Q351	L269-Y295 HydrophobicContact CB-CD1 3.58Å; L269-Y295 HydrophobicContact CB-CE1 4.42Å; L269-Y295 HydrophobicContact CB-CG 3.95Å; L269-Y295 HydrophobicContact CD1-CG 4.22Å; V270-Y295 WeakPolarHBondContact O-CA 3.5Å; Y295-Q335 WeakPolarHBondContact O-CG 3.15Å; Y295-N339 PolarHBondContact N-OD1 2.97Å; Y295-N339 PolarHBondContact O-ND2 3.45Å; Y295-I342 HydrophobicContact CD2-CD1 4.12Å; Y295-I342 HydrophobicContact CD2-CG2 4.08Å; Y295-I342 HydrophobicContact CE2-CG2 3.85Å; Y295-V349 HydrophobicContact CD1-CG1 4.37Å; Y295-V349 HydrophobicContact CE1-CG1 3.78Å; Y295-V349 HydrophobicContact CE2-CG1 4.24Å; Y295-V349 HydrophobicContact CE2-CG2 4.49Å; Y295-Q351 HydrophobicContact CE1-CB 4.32Å; Y295-Q351 HydrophobicContact CE1-CG 4.14Å
296	N	98.6	Very high	97.6	Very high	5 Å²	5	27.8 Å²	27.8	3%	0.027	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.4	175.2	178.8	-95.5	0	0	0	111	L269 V270 G298 Q335 N357 Q359 H380	L269-N296 WeakPolarHBondContact CD2-O 3.41Å; V270-N296 PolarHBondContact O-N 3.39Å; N296-G298 PolarHBondContact OD1-N 2.95Å; N296-Q335 VanDerWaalsContact CA-OE1 3.3Å; N296-Q335 PolarHBondContact ND2-OE1 2.74Å; N296-N357 PolarHBondContact OD1-ND2 3.08Å; N296-Q359 HydrophobicContact CB-CG 4.33Å; N296-H380 PolarHBondContact OD1-CE1 3.26Å; N296-H380 PolarHBondContact OD1-ND1 2.84Å
297	T	98.6	Very high	97.9	Very high	4 Å²	4	19.8 Å²	19.8	3%	0.025	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	11	-175.9	45.9	0	0	0	0	114.4	K224 V299 I300 D334 Q335 F338	K224-T297 PolarHBondContact NZ-O 3.46Å; T297-V299 VanDerWaalsContact C-N 3.32Å; T297-V299 PolarHBondContact O-N 3.28Å; T297-I300 HydrophobicContact CG2-CD1 3.92Å; T297-I300 WeakPolarHBondContact O-CG1 3.26Å; T297-D334 PolarHBondContact OG1-OD1 3.34Å; T297-Q335 HydrophobicContact CG2-CB 4.08Å; T297-Q335 HydrophobicContact CG2-CG 4Å; T297-Q335 WeakPolarHBondContact OG1-CB 3.35Å; T297-F338 HydrophobicContact CG2-CB 4.06Å; T297-F338 HydrophobicContact CG2-CD2 3.89Å; T297-F338 HydrophobicContact CG2-CG 4.01Å
298	G	98.1	Very high	98.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-21.6	178.3	0	0	0	0	0	115.2	L241 D242 N296 H380	L241-G298 CarbonylContact C-O 3.55Å; L241-G298 WeakPolarHBondContact CA-O 3.49Å; D242-G298 PolarHBondContact N-O 2.62Å; D242-G298 WeakPolarHBondContact OD2-CA 3.25Å; N296-G298 PolarHBondContact OD1-N 2.95Å; G298-H380 VanDerWaalsContact CA-CE1 3.49Å; G298-H380 WeakPolarHBondContact CA-CE1 3.31Å
299	V	98.8	Very high	98.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	116.9	169.7	-179.2	0	0	0	0	107.7	V240 L241 I245 L254 T297 L301 W356 N357 V378	V240-V299 WeakPolarHBondContact O-CA 3.29Å; L241-V299 HydrophobicContact CD2-CB 4.43Å; L241-V299 HydrophobicContact CD2-CG1 4.13Å; L241-V299 HydrophobicContact CD2-CG2 4Å; I245-V299 HydrophobicContact CD1-CG2 3.92Å; L254-V299 HydrophobicContact CD2-CG1 3.76Å; T297-V299 VanDerWaalsContact C-N 3.32Å; T297-V299 PolarHBondContact O-N 3.28Å; V299-L301 HydrophobicContact CG1-CD1 4.47Å; V299-W356 WeakPolarHBondContact CG2-O 3.25Å; V299-N357 HydrophobicContact CB-CB 4.17Å; V299-N357 HydrophobicContact CG2-CB 4.02Å; V299-V378 HydrophobicContact CG2-CG1 4.01Å
300	I	98.9	Very high	98.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	133	-179.3	-37.7	178.8	0	0	0	109.7	K224 I239 V240 G268 L269 T297 L302 F338	K224-I300 HydrophobicContact CD-CD1 4.17Å; I239-I300 CarbonylContact C-O 3.53Å; I239-I300 WeakPolarHBondContact CA-O 3.22Å; V240-I300 HydrophobicContact CB-CB 4.02Å; V240-I300 HydrophobicContact CB-CD1 4.45Å; V240-I300 HydrophobicContact CB-CG1 4.31Å; V240-I300 HydrophobicContact CG2-CB 4.33Å; V240-I300 PolarHBondContact N-O 3.42Å; V240-I300 PolarHBondContact O-N 3.06Å; G268-I300 WeakPolarHBondContact O-CA 3.49Å; L269-I300 HydrophobicContact CD2-CB 4.04Å; L269-I300 HydrophobicContact CD2-CD1 4.42Å; L269-I300 HydrophobicContact CD2-CG1 3.75Å; L269-I300 HydrophobicContact CD2-CG2 3.67Å; L269-I300 HydrophobicContact CG-CG2 4.19Å; T297-I300 HydrophobicContact CG2-CD1 3.92Å; T297-I300 WeakPolarHBondContact O-CG1 3.26Å; I300-L302 HydrophobicContact CB-CD2 4.46Å; I300-L302 HydrophobicContact CB-CG 4.5Å; I300-L302 HydrophobicContact CG2-CD2 3.41Å; I300-L302 VanDerWaalsContact CG2-CD2 3.41Å; I300-L302 HydrophobicContact CG2-CG 3.9Å; I300-F338 HydrophobicContact CD1-CE2 4.4Å; I300-F338 HydrophobicContact CD1-CZ 4.22Å
301	L	98.9	Very high	98.1	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	115.6	167.4	-79.7	74	0	0	0	107.4	I239 L254 V257 F258 F261 L267 G268 V299 L352	I239-L301 HydrophobicContact CG1-CG 4.46Å; L254-L301 HydrophobicContact CD1-CD1 3.54Å; L254-L301 HydrophobicContact CD1-CD2 4.28Å; L254-L301 HydrophobicContact CD1-CG 4.44Å; L254-L301 HydrophobicContact CD2-CD1 4.26Å; L254-L301 HydrophobicContact CG-CD1 3.9Å; V257-L301 HydrophobicContact CB-CD2 3.91Å; V257-L301 HydrophobicContact CG1-CD2 4.24Å; F258-L301 HydrophobicContact CD1-CB 4.35Å; F258-L301 HydrophobicContact CD1-CD2 4.36Å; F258-L301 HydrophobicContact CD2-CD2 4.13Å; F258-L301 HydrophobicContact CE1-CB 3.65Å; F258-L301 HydrophobicContact CE1-CD2 4.35Å; F258-L301 HydrophobicContact CE1-CG 4.31Å; F258-L301 HydrophobicContact CE2-CB 4.24Å; F258-L301 HydrophobicContact CE2-CD2 4.1Å; F258-L301 HydrophobicContact CE2-CG 4.07Å; F258-L301 HydrophobicContact CG-CD2 4.26Å; F258-L301 HydrophobicContact CZ-CB 3.58Å; F258-L301 HydrophobicContact CZ-CD2 4.22Å; F258-L301 HydrophobicContact CZ-CG 3.92Å; F261-L301 HydrophobicContact CE1-CD2 4.31Å; F261-L301 HydrophobicContact CZ-CB 3.82Å; F261-L301 HydrophobicContact CZ-CD2 4.27Å; L267-L301 CarbonylContact C-O 3.1Å; L267-L301 WeakPolarHBondContact CA-O 3.41Å; G268-L301 PolarHBondContact N-O 2.89Å; G268-L301 PolarHBondContact O-N 2.82Å; V299-L301 HydrophobicContact CG1-CD1 4.47Å; L301-L352 HydrophobicContact CD1-CD1 3.58Å; L301-L352 HydrophobicContact CD1-CD2 4.24Å; L301-L352 HydrophobicContact CD2-CD2 4.41Å
302	L	98.9	Very high	98.1	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124	-179.1	-62.7	-176.7	0	0	0	110.9	L227 R237 V238 V240 L267 I300 L304 L307 F338	L227-L302 HydrophobicContact CB-CD1 4.48Å; L227-L302 HydrophobicContact CD1-CD1 4.07Å; R237-L302 VanDerWaalsContact CA-O 3.23Å; R237-L302 WeakPolarHBondContact CA-O 3.38Å; V238-L302 HydrophobicContact CG1-CB 3.92Å; V238-L302 HydrophobicContact CG1-CD1 4.28Å; V238-L302 PolarHBondContact N-O 3.36Å; V238-L302 PolarHBondContact O-N 3.47Å; V240-L302 HydrophobicContact CG2-CD1 3.43Å; V240-L302 VanDerWaalsContact CG2-CD1 3.43Å; V240-L302 HydrophobicContact CG2-CG 3.81Å; L267-L302 HydrophobicContact CD2-CD2 3.3Å; I300-L302 HydrophobicContact CB-CD2 4.46Å; I300-L302 HydrophobicContact CB-CG 4.5Å; I300-L302 HydrophobicContact CG2-CD2 3.41Å; I300-L302 VanDerWaalsContact CG2-CD2 3.41Å; I300-L302 HydrophobicContact CG2-CG 3.9Å; L302-L304 HydrophobicContact CB-CD2 4.06Å; L302-L304 HydrophobicContact CB-CG 4.47Å; L302-L304 HydrophobicContact CD1-CD2 4.17Å; L302-L304 PolarHBondContact O-N 2.9Å; L302-L307 HydrophobicContact CB-CD1 4.01Å; L302-L307 HydrophobicContact CD2-CD1 3.85Å; L302-L307 HydrophobicContact CG-CD1 4.42Å; L302-F338 HydrophobicContact CD2-CE1 4.44Å
303	L	98.8	Very high	98.1	Very high	18 Å²	18	34.7 Å²	34.7	9%	0.094	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	87.9	161.9	-67.9	-176.7	0	0	0	108.9	E236 R237 F258 F261 V266 D305 K306 L307	E236-L303 CarbonylContact O-C 3.56Å; R237-L303 HydrophobicContact CB-CD2 3.81Å; F258-L303 HydrophobicContact CD1-CD2 3.39Å; F258-L303 HydrophobicContact CD1-CG 3.96Å; F258-L303 HydrophobicContact CE1-CD2 3.65Å; F258-L303 HydrophobicContact CE1-CG 4.03Å; F258-L303 HydrophobicContact CG-CD2 4.32Å; F261-L303 HydrophobicContact CB-CD1 4.49Å; F261-L303 HydrophobicContact CD2-CD1 3.67Å; F261-L303 HydrophobicContact CD2-CG 4.03Å; F261-L303 HydrophobicContact CE2-CD1 4.35Å; F261-L303 HydrophobicContact CE2-CG 4.22Å; V266-L303 HydrophobicContact CB-CB 4.36Å; V266-L303 PolarHBondContact O-N 3.45Å; L303-D305 PolarHBondContact O-N 2.9Å; L303-K306 HydrophobicContact CB-CB 4.26Å; L303-K306 HydrophobicContact CB-CD 4.43Å; L303-K306 HydrophobicContact CB-CG 4.49Å; L303-K306 HydrophobicContact CD1-CD 3.84Å; L303-K306 PolarHBondContact O-N 3.34Å; L303-L307 WeakPolarHBondContact O-CB 3.48Å; L303-L307 WeakPolarHBondContact O-CD1 3.38Å; L303-L307 VanDerWaalsContact O-CG 3.25Å; L303-L307 WeakPolarHBondContact O-CG 3.33Å; L303-L307 PolarHBondContact O-N 3.19Å
304	L	98.6	Very high	98.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61	-42.2	-173.8	-64.1	175.3	0	0	0	112.6	T228 L231 L235 E236 V238 L302 K306 L307 R308	T228-L304 HydrophobicContact CG2-CD2 4.04Å; L231-L304 HydrophobicContact CB-CD1 4.2Å; L231-L304 HydrophobicContact CD1-CD1 3.76Å; L231-L304 HydrophobicContact CD1-CD2 4.43Å; L235-L304 HydrophobicContact CB-CD1 4.21Å; L235-L304 HydrophobicContact CD2-CD1 3.72Å; L235-L304 HydrophobicContact CG-CD1 3.79Å; L235-L304 WeakPolarHBondContact O-CB 3.48Å; E236-L304 PolarHBondContact O-N 2.83Å; V238-L304 HydrophobicContact CB-CD1 4.13Å; V238-L304 HydrophobicContact CG1-CD1 3.73Å; V238-L304 HydrophobicContact CG1-CD2 3.95Å; V238-L304 HydrophobicContact CG1-CG 3.86Å; L302-L304 HydrophobicContact CB-CD2 4.06Å; L302-L304 HydrophobicContact CB-CG 4.47Å; L302-L304 HydrophobicContact CD1-CD2 4.17Å; L302-L304 PolarHBondContact O-N 2.9Å; L304-K306 VanDerWaalsContact C-N 3.33Å; L304-K306 PolarHBondContact O-N 3.36Å; L304-L307 PolarHBondContact O-N 3.1Å; L304-R308 WeakPolarHBondContact O-CB 3.44Å; L304-R308 VanDerWaalsContact O-CG 3.22Å; L304-R308 WeakPolarHBondContact O-CG 3.23Å; L304-R308 PolarHBondContact O-N 3.43Å
305	D	96.8	Very high	98.2	Very high	37 Å²	37	38.4 Å²	38.4	20%	0.198	17%	0.173	C	C	.	.	H	α-helix	trans	-61	-44.3	-179.1	80.5	-55.1	0	0	0	111.2	E236 L303 K309	E236-D305 HydrophobicContact CB-CB 4.42Å; E236-D305 HydrophobicContact CG-CB 4.45Å; E236-D305 PolarHBondContact O-N 3.05Å; L303-D305 PolarHBondContact O-N 2.9Å; D305-K309 WeakPolarHBondContact O-CD 3.34Å; D305-K309 VanDerWaalsContact O-CG 3.29Å; D305-K309 WeakPolarHBondContact O-CG 3.45Å; D305-K309 PolarHBondContact O-N 3.4Å; D305-K309 VanDerWaalsContact O-N 3.1Å; D305-K309 IonicContact OD2-NZ 3.46Å; D305-K309 PolarHBondContact OD2-NZ 3.14Å
306	K	97.9	Very high	98.2	Very high	79 Å²	79	37.3 Å²	37.3	34%	0.343	17%	0.169	S	C	.	.	H	α-helix	trans	-70.1	-43.8	177.3	-66.7	-172.6	-175.2	177.9	0	111.3	V266 L303 L304 R308 K309 M310	V266-K306 HydrophobicContact CG1-CB 3.49Å; V266-K306 VanDerWaalsContact CG1-CB 3.49Å; V266-K306 HydrophobicContact CG1-CD 3.89Å; V266-K306 HydrophobicContact CG1-CG 4.35Å; L303-K306 HydrophobicContact CB-CB 4.26Å; L303-K306 HydrophobicContact CB-CD 4.43Å; L303-K306 HydrophobicContact CB-CG 4.49Å; L303-K306 HydrophobicContact CD1-CD 3.84Å; L303-K306 PolarHBondContact O-N 3.34Å; L304-K306 VanDerWaalsContact C-N 3.33Å; L304-K306 PolarHBondContact O-N 3.36Å; K306-R308 VanDerWaalsContact C-N 3.31Å; K306-R308 PolarHBondContact O-N 3.48Å; K306-K309 WeakPolarHBondContact O-CB 2.88Å; K306-K309 PolarHBondContact O-N 3.33Å; K306-M310 WeakPolarHBondContact O-CB 3.43Å; K306-M310 VanDerWaalsContact O-CG 3.25Å; K306-M310 WeakPolarHBondContact O-CG 3.44Å; K306-M310 PolarHBondContact O-N 2.89Å
307	L	98.5	Very high	98.2	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-42.3	176	-75.8	165.7	0	0	0	111.9	T228 V266 L267 L302 L303 L304 M310 K311 W312	T228-L307 HydrophobicContact CG2-CB 3.81Å; T228-L307 HydrophobicContact CG2-CD1 4.22Å; V266-L307 HydrophobicContact CB-CD2 4.12Å; V266-L307 HydrophobicContact CB-CG 4.1Å; V266-L307 HydrophobicContact CG2-CD2 3.63Å; V266-L307 HydrophobicContact CG2-CG 4.18Å; L267-L307 HydrophobicContact CD2-CD1 4.08Å; L267-L307 HydrophobicContact CD2-CD2 4.11Å; L302-L307 HydrophobicContact CB-CD1 4.01Å; L302-L307 HydrophobicContact CD2-CD1 3.85Å; L302-L307 HydrophobicContact CG-CD1 4.42Å; L303-L307 WeakPolarHBondContact O-CB 3.48Å; L303-L307 WeakPolarHBondContact O-CD1 3.38Å; L303-L307 VanDerWaalsContact O-CG 3.25Å; L303-L307 WeakPolarHBondContact O-CG 3.33Å; L303-L307 PolarHBondContact O-N 3.19Å; L304-L307 PolarHBondContact O-N 3.1Å; L307-M310 CarbonylContact O-C 3.56Å; L307-M310 PolarHBondContact O-N 3.39Å; L307-K311 PolarHBondContact O-N 3.03Å; L307-W312 HydrophobicContact CB-CB 3.94Å; L307-W312 HydrophobicContact CB-CG 4.4Å; L307-W312 HydrophobicContact CD2-CB 4.08Å; L307-W312 HydrophobicContact CD2-CD2 3.81Å; L307-W312 HydrophobicContact CD2-CE3 3.61Å; L307-W312 HydrophobicContact CD2-CG 4.01Å; L307-W312 HydrophobicContact CD2-CZ3 4.33Å; L307-W312 VanDerWaalsContact O-CB 3.32Å; L307-W312 WeakPolarHBondContact O-CB 3.29Å; L307-W312 PolarHBondContact O-N 3.5Å
308	R	98.2	Very high	98.2	Very high	63 Å²	63	43.6 Å²	43.6	24%	0.238	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-47.7	174.1	-71.9	169.9	-173.5	138.3	1.9	111.4	T228 L231 P232 A233 L235 L304 K306 M310 K311	T228-R308 PolarHBondContact O-NE 2.8Å; L231-R308 PolarHBondContact O-NH2 3.42Å; P232-R308 PolarHBondContact O-NH1 3.49Å; P232-R308 PolarHBondContact O-NH2 2.91Å; A233-R308 PolarHBondContact O-NH1 3.16Å; L235-R308 PolarHBondContact O-NH1 3.39Å; L304-R308 WeakPolarHBondContact O-CB 3.44Å; L304-R308 VanDerWaalsContact O-CG 3.22Å; L304-R308 WeakPolarHBondContact O-CG 3.23Å; L304-R308 PolarHBondContact O-N 3.43Å; K306-R308 VanDerWaalsContact C-N 3.31Å; K306-R308 PolarHBondContact O-N 3.48Å; R308-M310 PolarHBondContact O-N 2.76Å; R308-K311 PolarHBondContact O-N 3.21Å
309	K	97.4	Very high	98.2	Very high	161 Å²	161	43.8 Å²	43.8	70%	0.7	20%	0.199	S	C	*	.	H	α-helix	trans	-58.8	-35.1	175.9	-70.9	163.3	-173.1	159.7	0	112.4	D305 K306 K311	D305-K309 WeakPolarHBondContact O-CD 3.34Å; D305-K309 VanDerWaalsContact O-CG 3.29Å; D305-K309 WeakPolarHBondContact O-CG 3.45Å; D305-K309 PolarHBondContact O-N 3.4Å; D305-K309 VanDerWaalsContact O-N 3.1Å; D305-K309 IonicContact OD2-NZ 3.46Å; D305-K309 PolarHBondContact OD2-NZ 3.14Å; K306-K309 WeakPolarHBondContact O-CB 2.88Å; K306-K309 PolarHBondContact O-N 3.33Å; K309-K311 PolarHBondContact O-N 3.37Å
310	M	97.2	Very high	98.2	Very high	62 Å²	62	43.8 Å²	43.8	31%	0.305	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	3.2	177.4	-64.7	-176.7	78.3	0	0	113.9	V266 K306 L307 R308 W312 L348	V266-M310 HydrophobicContact CG1-SD 4.04Å; V266-M310 HydrophobicContact CG2-SD 4.41Å; K306-M310 WeakPolarHBondContact O-CB 3.43Å; K306-M310 VanDerWaalsContact O-CG 3.25Å; K306-M310 WeakPolarHBondContact O-CG 3.44Å; K306-M310 PolarHBondContact O-N 2.89Å; L307-M310 CarbonylContact O-C 3.56Å; L307-M310 PolarHBondContact O-N 3.39Å; R308-M310 PolarHBondContact O-N 2.76Å; M310-W312 VanDerWaalsContact C-N 3.34Å; M310-W312 PolarHBondContact O-N 3.47Å; M310-L348 HydrophobicContact CE-CD2 3.39Å; M310-L348 HydrophobicContact SD-CD2 4.02Å
311	K	97.7	Very high	98.2	Very high	138 Å²	138	48.6 Å²	48.6	60%	0.6	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	47.7	-176.8	-54	-175.1	179.9	-177.3	0	112.3	L307 R308 K309 E313 Q314 M315	L307-K311 PolarHBondContact O-N 3.03Å; R308-K311 PolarHBondContact O-N 3.21Å; K309-K311 PolarHBondContact O-N 3.37Å; K311-E313 PolarHBondContact O-N 3.47Å; K311-E313 VanDerWaalsContact O-N 3.11Å; K311-Q314 HydrophobicContact CB-CB 4.16Å; K311-Q314 WeakPolarHBondContact O-CB 3.26Å; K311-Q314 PolarHBondContact O-N 3.15Å; K311-M315 PolarHBondContact O-N 3.16Å
312	W	97.8	Very high	98.1	Very high	6 Å²	6	54.4 Å²	54.4	2%	0.023	24%	0.243	C	C	.	.	H	α-helix	trans	-45.5	-44.1	179.1	173.5	-107.7	0	0	0	113.1	T228 L267 L307 M310 Q314 M315 W316 F338 V341	T228-W312 HydrophobicContact CG2-CB 4.26Å; T228-W312 HydrophobicContact CG2-CG 4.14Å; L267-W312 HydrophobicContact CD1-CH2 4.22Å; L267-W312 HydrophobicContact CD1-CZ3 4.25Å; L307-W312 HydrophobicContact CB-CB 3.94Å; L307-W312 HydrophobicContact CB-CG 4.4Å; L307-W312 HydrophobicContact CD2-CB 4.08Å; L307-W312 HydrophobicContact CD2-CD2 3.81Å; L307-W312 HydrophobicContact CD2-CE3 3.61Å; L307-W312 HydrophobicContact CD2-CG 4.01Å; L307-W312 HydrophobicContact CD2-CZ3 4.33Å; L307-W312 VanDerWaalsContact O-CB 3.32Å; L307-W312 WeakPolarHBondContact O-CB 3.29Å; L307-W312 PolarHBondContact O-N 3.5Å; M310-W312 VanDerWaalsContact C-N 3.34Å; M310-W312 PolarHBondContact O-N 3.47Å; W312-Q314 PolarHBondContact O-N 3.41Å; W312-M315 HydrophobicContact CE3-SD 4.31Å; W312-M315 HydrophobicContact CZ3-SD 4.41Å; W312-M315 WeakPolarHBondContact O-CB 3.42Å; W312-M315 PolarHBondContact O-N 3.42Å; W312-M315 VanDerWaalsContact O-N 3.13Å; W312-W316 AromaticContact CD1-CD1 3.65Å; W312-W316 AromaticContact CE2-CD1 3.86Å; W312-W316 HydrophobicContact CZ2-CB 4.37Å; W312-W316 AromaticContact NE1-CD1 3.41Å; W312-W316 PolarHBondContact O-N 3.36Å; W312-F338 AromaticContact CH2-CD1 3.68Å; W312-F338 HydrophobicContact CH2-CD1 3.68Å; W312-F338 AromaticContact CH2-CE1 3.7Å; W312-F338 HydrophobicContact CH2-CE1 3.7Å; W312-F338 HydrophobicContact CH2-CG 4.44Å; W312-F338 HydrophobicContact CH2-CZ 4.46Å; W312-F338 AromaticContact CZ2-CD1 3.71Å; W312-F338 HydrophobicContact CZ2-CD1 3.71Å; W312-F338 AromaticContact CZ2-CE1 3.34Å; W312-F338 HydrophobicContact CZ2-CE1 3.34Å; W312-F338 HydrophobicContact CZ2-CE2 4.3Å; W312-F338 HydrophobicContact CZ2-CG 4.34Å; W312-F338 AromaticContact CZ2-CZ 3.68Å; W312-F338 HydrophobicContact CZ2-CZ 3.68Å; W312-V341 HydrophobicContact CH2-CB 4.27Å; W312-V341 HydrophobicContact CH2-CG1 4Å; W312-V341 HydrophobicContact CH2-CG2 4.45Å; W312-V341 HydrophobicContact CZ3-CB 4.34Å; W312-V341 HydrophobicContact CZ3-CG1 3.58Å
313	E	97.8	Very high	98.1	Very high	60 Å²	60	56 Å²	56	28%	0.28	25%	0.251	S	S	.	.	H	α-helix	trans	-56.3	-50.6	178.9	-169.4	-172.7	160.4	0	0	112.6	K311 M315 W316 R317	K311-E313 PolarHBondContact O-N 3.47Å; K311-E313 VanDerWaalsContact O-N 3.11Å; E313-M315 VanDerWaalsContact C-N 3.29Å; E313-M315 PolarHBondContact O-N 3.08Å; E313-W316 HydrophobicContact CG-CZ2 4.21Å; E313-R317 WeakPolarHBondContact O-CB 3.44Å; E313-R317 VanDerWaalsContact O-CG 3.23Å; E313-R317 WeakPolarHBondContact O-CG 3.4Å; E313-R317 PolarHBondContact O-N 3.24Å; E313-R317 VanDerWaalsContact O-N 3.1Å; E313-R317 IonicContact OE1-CZ 2.72Å; E313-R317 IonicContact OE1-NE 3.51Å; E313-R317 PolarHBondContact OE1-NE 2.75Å; E313-R317 IonicContact OE1-NH2 3.28Å
314	Q	98.4	Very high	98	Very high	105 Å²	105	57 Å²	57	49%	0.491	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-40.5	177.5	-173.8	179.9	5	0	0	111	K311 W312 L318	K311-Q314 HydrophobicContact CB-CB 4.16Å; K311-Q314 WeakPolarHBondContact O-CB 3.26Å; K311-Q314 PolarHBondContact O-N 3.15Å; W312-Q314 PolarHBondContact O-N 3.41Å; Q314-L318 HydrophobicContact CG-CD1 3.88Å; Q314-L318 HydrophobicContact CG-CG 4.38Å; Q314-L318 WeakPolarHBondContact O-CB 3.43Å; Q314-L318 VanDerWaalsContact O-CG 3.28Å; Q314-L318 WeakPolarHBondContact O-CG 2.93Å; Q314-L318 PolarHBondContact O-N 3.15Å
315	M	98.3	Very high	97.8	Very high	41 Å²	41	64.7 Å²	64.7	20%	0.202	29%	0.294	C	S	.	.	H	α-helix	trans	-62.5	-48.7	-178.2	-173.2	-177.3	-64.2	0	0	112.6	K311 W312 E313 T319 V341 L348	K311-M315 PolarHBondContact O-N 3.16Å; W312-M315 HydrophobicContact CE3-SD 4.31Å; W312-M315 HydrophobicContact CZ3-SD 4.41Å; W312-M315 WeakPolarHBondContact O-CB 3.42Å; W312-M315 PolarHBondContact O-N 3.42Å; W312-M315 VanDerWaalsContact O-N 3.13Å; E313-M315 VanDerWaalsContact C-N 3.29Å; E313-M315 PolarHBondContact O-N 3.08Å; M315-T319 WeakPolarHBondContact O-CB 3.45Å; M315-T319 PolarHBondContact O-N 2.9Å; M315-T319 VanDerWaalsContact O-N 3.17Å; M315-T319 PolarHBondContact O-OG1 3.02Å; M315-V341 HydrophobicContact CG-CG1 3.86Å; M315-V341 HydrophobicContact SD-CG1 3.49Å; M315-V341 WeakPolarHBondContact SD-CG1 3.45Å; M315-L348 HydrophobicContact SD-CD1 4.14Å
316	W	98.6	Very high	97.6	Very high	0 Å²	0	65 Å²	65	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-72.9	-35.7	-179.9	74.3	-111.3	0	0	0	112	V208 W210 I211 L225 V226 W312 E313 T319 A320 I337 V341	V208-W316 HydrophobicContact CG1-CH2 4.28Å; W210-W316 HydrophobicContact CZ2-CH2 4.3Å; W210-W316 AromaticContact CZ2-CZ3 3.71Å; W210-W316 HydrophobicContact CZ2-CZ3 3.71Å; I211-W316 HydrophobicContact CD1-CZ3 3.77Å; L225-W316 HydrophobicContact CB-CD2 4.13Å; L225-W316 HydrophobicContact CB-CE3 4.48Å; L225-W316 HydrophobicContact CB-CH2 4.49Å; L225-W316 HydrophobicContact CB-CZ2 4.1Å; L225-W316 HydrophobicContact CD1-CD2 4.44Å; L225-W316 HydrophobicContact CD1-CE3 4.04Å; L225-W316 HydrophobicContact CD1-CZ3 4.15Å; L225-W316 HydrophobicContact CD2-CB 4.44Å; L225-W316 HydrophobicContact CD2-CD2 4.29Å; L225-W316 HydrophobicContact CD2-CG 4.23Å; L225-W316 PolarHBondContact O-NE1 3Å; V226-W316 HydrophobicContact CG1-CZ2 4.33Å; W312-W316 AromaticContact CD1-CD1 3.65Å; W312-W316 AromaticContact CE2-CD1 3.86Å; W312-W316 HydrophobicContact CZ2-CB 4.37Å; W312-W316 AromaticContact NE1-CD1 3.41Å; W312-W316 PolarHBondContact O-N 3.36Å; E313-W316 HydrophobicContact CG-CZ2 4.21Å; W316-T319 PolarHBondContact O-N 2.92Å; W316-A320 WeakPolarHBondContact O-CB 3.38Å; W316-A320 PolarHBondContact O-N 2.94Å; W316-I337 HydrophobicContact CB-CG2 3.87Å; W316-I337 HydrophobicContact CE3-CG2 4.4Å; W316-V341 HydrophobicContact CB-CG2 4.03Å
317	R	98.7	Very high	97.3	Very high	54 Å²	54	62.1 Å²	62.1	20%	0.204	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-53.3	176.7	-76.1	177.8	174	-73.4	-3.6	111.2	E207 W210 E313 T319 A320 E321	E207-R317 PolarHBondContact O-NH1 2.89Å; E207-R317 PolarHBondContact O-NH2 3.29Å; E207-R317 IonicContact OE2-CZ 3.39Å; E207-R317 IonicContact OE2-NH2 3.45Å; E207-R317 PolarHBondContact OE2-NH2 2.81Å; W210-R317 HydrophobicContact CZ2-CG 4.28Å; E313-R317 WeakPolarHBondContact O-CB 3.44Å; E313-R317 VanDerWaalsContact O-CG 3.23Å; E313-R317 WeakPolarHBondContact O-CG 3.4Å; E313-R317 PolarHBondContact O-N 3.24Å; E313-R317 VanDerWaalsContact O-N 3.1Å; E313-R317 IonicContact OE1-CZ 2.72Å; E313-R317 IonicContact OE1-NE 3.51Å; E313-R317 PolarHBondContact OE1-NE 2.75Å; E313-R317 IonicContact OE1-NH2 3.28Å; R317-T319 PolarHBondContact O-N 3.23Å; R317-A320 PolarHBondContact O-N 3.03Å; R317-E321 WeakPolarHBondContact O-CG 3.49Å; R317-E321 PolarHBondContact O-N 3.1Å
318	L	98.6	Very high	97	Very high	86 Å²	86	69.5 Å²	69.5	45%	0.45	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-34.5	178.3	-71.3	174.1	0	0	0	112.5	Q314 R322	Q314-L318 HydrophobicContact CG-CD1 3.88Å; Q314-L318 HydrophobicContact CG-CG 4.38Å; Q314-L318 WeakPolarHBondContact O-CB 3.43Å; Q314-L318 VanDerWaalsContact O-CG 3.28Å; Q314-L318 WeakPolarHBondContact O-CG 2.93Å; Q314-L318 PolarHBondContact O-N 3.15Å; L318-R322 WeakPolarHBondContact O-CB 3.47Å; L318-R322 PolarHBondContact O-N 3.16Å; L318-R322 VanDerWaalsContact O-N 3.14Å
319	T	98.6	Very high	96.9	Very high	4 Å²	4	66.9 Å²	66.9	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-69.9	-46.9	176.9	-60.7	0	0	0	0	111	M315 W316 R317 R322 E323 A340 V341	M315-T319 WeakPolarHBondContact O-CB 3.45Å; M315-T319 PolarHBondContact O-N 2.9Å; M315-T319 VanDerWaalsContact O-N 3.17Å; M315-T319 PolarHBondContact O-OG1 3.02Å; W316-T319 PolarHBondContact O-N 2.92Å; R317-T319 PolarHBondContact O-N 3.23Å; T319-R322 PolarHBondContact O-N 2.93Å; T319-E323 HydrophobicContact CG2-CG 4.41Å; T319-E323 WeakPolarHBondContact O-CG 3.25Å; T319-E323 PolarHBondContact O-N 3.03Å; T319-A340 HydrophobicContact CG2-CB 3.59Å; T319-V341 HydrophobicContact CG2-CG2 3.85Å
320	A	98.5	Very high	96.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-46.7	177.5	0	0	0	0	0	111.8	W210 W316 R317 R322 E323 L324 I337	W210-A320 HydrophobicContact CH2-CB 3.79Å; W210-A320 HydrophobicContact CZ3-CB 4.46Å; W316-A320 WeakPolarHBondContact O-CB 3.38Å; W316-A320 PolarHBondContact O-N 2.94Å; R317-A320 PolarHBondContact O-N 3.03Å; A320-R322 VanDerWaalsContact C-N 3.3Å; A320-R322 PolarHBondContact O-N 3.49Å; A320-E323 PolarHBondContact O-N 3.24Å; A320-L324 VanDerWaalsContact O-CB 3.27Å; A320-L324 WeakPolarHBondContact O-CB 3.41Å; A320-L324 WeakPolarHBondContact O-CD1 3.2Å; A320-L324 WeakPolarHBondContact O-CG 3.15Å; A320-L324 PolarHBondContact O-N 3.4Å; A320-I337 HydrophobicContact CB-CD1 3.9Å; A320-I337 HydrophobicContact CB-CG1 4.09Å; A320-I337 HydrophobicContact CB-CG2 4.39Å
321	E	98	Very high	96.8	Very high	102 Å²	102	58.4 Å²	58.4	48%	0.477	29%	0.291	S	S	.	.	H	α-helix	trans	-56.1	-44.6	174.8	-72.5	175.1	163.4	0	0	112	W210 R317 M325	W210-E321 HydrophobicContact CH2-CG 3.81Å; W210-E321 HydrophobicContact CZ3-CG 3.81Å; R317-E321 WeakPolarHBondContact O-CG 3.49Å; R317-E321 PolarHBondContact O-N 3.1Å; E321-M325 PolarHBondContact O-N 3.37Å
322	R	97.8	Very high	96.8	Very high	121 Å²	121	53.6 Å²	53.6	46%	0.457	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-51.2	179.1	-175.4	-170.7	-59.4	152.8	5.6	112.1	L318 T319 A320 L324 M325	L318-R322 WeakPolarHBondContact O-CB 3.47Å; L318-R322 PolarHBondContact O-N 3.16Å; L318-R322 VanDerWaalsContact O-N 3.14Å; T319-R322 PolarHBondContact O-N 2.93Å; A320-R322 VanDerWaalsContact C-N 3.3Å; A320-R322 PolarHBondContact O-N 3.49Å; R322-L324 VanDerWaalsContact C-N 3.31Å; R322-L324 PolarHBondContact O-N 3.27Å; R322-M325 HydrophobicContact CB-CE 4.3Å; R322-M325 HydrophobicContact CG-CE 4.06Å; R322-M325 WeakPolarHBondContact O-CB 3.4Å; R322-M325 PolarHBondContact O-N 3.27Å
323	E	97.9	Very high	96.8	Very high	38 Å²	38	53.3 Å²	53.3	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-68.6	-33	-177	-63.4	-49.3	143	0	0	111.7	W288 P289 T319 A320 M325 G326 M327 A340	W288-E323 HydrophobicContact CE3-CB 3.74Å; W288-E323 HydrophobicContact CE3-CG 4.05Å; W288-E323 HydrophobicContact CH2-CB 3.77Å; W288-E323 HydrophobicContact CZ3-CB 3.31Å; W288-E323 HydrophobicContact CZ3-CG 3.89Å; P289-E323 HydrophobicContact CG-CG 4.25Å; P289-E323 WeakPolarHBondContact CG-OE2 3.29Å; T319-E323 HydrophobicContact CG2-CG 4.41Å; T319-E323 WeakPolarHBondContact O-CG 3.25Å; T319-E323 PolarHBondContact O-N 3.03Å; A320-E323 PolarHBondContact O-N 3.24Å; E323-M325 PolarHBondContact O-N 3.08Å; E323-G326 CarbonylContact O-C 3.57Å; E323-G326 PolarHBondContact O-N 3.08Å; E323-M327 VanDerWaalsContact O-CB 3.28Å; E323-M327 WeakPolarHBondContact O-CB 3.2Å; E323-M327 WeakPolarHBondContact O-CG 3.35Å; E323-M327 PolarHBondContact O-N 3.26Å; E323-A340 HydrophobicContact CG-CB 4.06Å
324	L	97.4	Very high	96.8	Very high	39 Å²	39	50.8 Å²	50.8	20%	0.204	26%	0.259	C	S	.	.	H	α-helix	trans	-65.6	-15.5	176.4	-73.8	169.8	0	0	0	114	W210 I211 P212 W288 A320 R322 G326 M327	W210-L324 HydrophobicContact CE3-CD1 4.45Å; W210-L324 HydrophobicContact CZ3-CD1 3.88Å; I211-L324 HydrophobicContact CG2-CD1 4.4Å; P212-L324 HydrophobicContact CG-CD2 4.45Å; W288-L324 HydrophobicContact CH2-CD2 4.05Å; W288-L324 HydrophobicContact CH2-CG 3.99Å; W288-L324 HydrophobicContact CZ2-CD2 3.84Å; W288-L324 HydrophobicContact CZ2-CG 4.28Å; A320-L324 VanDerWaalsContact O-CB 3.27Å; A320-L324 WeakPolarHBondContact O-CB 3.41Å; A320-L324 WeakPolarHBondContact O-CD1 3.2Å; A320-L324 WeakPolarHBondContact O-CG 3.15Å; A320-L324 PolarHBondContact O-N 3.4Å; R322-L324 VanDerWaalsContact C-N 3.31Å; R322-L324 PolarHBondContact O-N 3.27Å; L324-G326 VanDerWaalsContact C-N 3.26Å; L324-G326 PolarHBondContact O-N 3.01Å; L324-M327 CarbonylContact C-O 3.42Å; L324-M327 VanDerWaalsContact CA-O 3.31Å; L324-M327 WeakPolarHBondContact CA-O 3.35Å; L324-M327 VanDerWaalsContact O-O 3.05Å
325	M	94.7	Very high	96.8	Very high	161 Å²	161	46.3 Å²	46.3	79%	0.793	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-30.1	168.9	-66.8	-169.8	-88.1	0	0	112.4	E321 R322 E323	E321-M325 PolarHBondContact O-N 3.37Å; R322-M325 HydrophobicContact CB-CE 4.3Å; R322-M325 HydrophobicContact CG-CE 4.06Å; R322-M325 WeakPolarHBondContact O-CB 3.4Å; R322-M325 PolarHBondContact O-N 3.27Å; E323-M325 PolarHBondContact O-N 3.08Å
326	G	92.3	Very high	96.8	Very high	44 Å²	44	44.4 Å²	44.4	45%	0.454	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-17.9	-179.6	0	0	0	0	0	114.6	R286 E323 L324	R286-G326 PolarHBondContact NH1-O 2.91Å; E323-G326 CarbonylContact O-C 3.57Å; E323-G326 PolarHBondContact O-N 3.08Å; L324-G326 VanDerWaalsContact C-N 3.26Å; L324-G326 PolarHBondContact O-N 3.01Å
327	M	92.1	Very high	96.8	Very high	18 Å²	18	44.4 Å²	44.4	9%	0.089	23%	0.229	C	C	.	.			trans	-116.1	125.3	-177.2	-59.7	-62.5	-77.4	0	0	109.5	R286 W288 E323 L324 S329	R286-M327 HydrophobicContact CG-SD 4.35Å; R286-M327 WeakPolarHBondContact O-CE 3.45Å; W288-M327 HydrophobicContact CD2-CG 4.46Å; W288-M327 HydrophobicContact CG-CE 3.94Å; W288-M327 HydrophobicContact CZ2-CB 4.01Å; E323-M327 VanDerWaalsContact O-CB 3.28Å; E323-M327 WeakPolarHBondContact O-CB 3.2Å; E323-M327 WeakPolarHBondContact O-CG 3.35Å; E323-M327 PolarHBondContact O-N 3.26Å; L324-M327 CarbonylContact C-O 3.42Å; L324-M327 VanDerWaalsContact CA-O 3.31Å; L324-M327 WeakPolarHBondContact CA-O 3.35Å; L324-M327 VanDerWaalsContact O-O 3.05Å; M327-S329 VanDerWaalsContact C-N 3.26Å; M327-S329 PolarHBondContact O-N 3.37Å
328	L	91	Very high	96.8	Very high	156 Å²	156	41.9 Å²	41.9	82%	0.817	22%	0.22	S	C	*	.	S	Bend	trans	-68.9	-22.9	-176.8	-67.2	177.9	0	0	0	114.3
329	S	96.7	Very high	96.8	Very high	9 Å²	9	37.8 Å²	37.8	6%	0.063	20%	0.198	C	C	.	.	S	Bend	trans	-169.8	160.2	-177	65	0	0	0	0	110.9	P212 K214 W288 M327	P212-S329 CarbonylContact O-C 3.57Å; P212-S329 VanDerWaalsContact O-CA 3.22Å; P212-S329 WeakPolarHBondContact O-CA 3.49Å; P212-S329 VanDerWaalsContact O-CB 3.3Å; P212-S329 WeakPolarHBondContact O-CB 3.5Å; K214-S329 WeakPolarHBondContact CD-OG 3.25Å; K214-S329 WeakPolarHBondContact CE-OG 3.36Å; K214-S329 WeakPolarHBondContact CG-OG 3.47Å; K214-S329 PolarHBondContact NZ-OG 3.38Å; W288-S329 PolarHBondContact NE1-O 3.04Å; M327-S329 VanDerWaalsContact C-N 3.26Å; M327-S329 PolarHBondContact O-N 3.37Å
330	T	97.6	Very high	96.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-66.4	148.7	158.6	57.4	0	0	0	0	110.1	I211 P212 N213 K214 W288 D336 I337	I211-T330 HydrophobicContact CG2-CG2 3.87Å; P212-T330 PolarHBondContact O-N 3.29Å; P212-T330 PolarHBondContact O-OG1 3.49Å; N213-T330 WeakPolarHBondContact CA-OG1 3.46Å; N213-T330 WeakPolarHBondContact CB-OG1 3.29Å; N213-T330 VanDerWaalsContact CG-OG1 3.31Å; N213-T330 PolarHBondContact OD1-OG1 2.84Å; K214-T330 PolarHBondContact N-O 3.32Å; W288-T330 HydrophobicContact CH2-CG2 3.91Å; W288-T330 HydrophobicContact CZ2-CG2 3.57Å; T330-D336 HydrophobicContact CG2-CB 4.25Å; T330-I337 HydrophobicContact CG2-CD1 4.03Å; T330-I337 HydrophobicContact CG2-CG1 4.09Å
331	S	95.3	Very high	96.9	Very high	44 Å²	44	37.6 Å²	37.6	31%	0.308	20%	0.197	S	C	.	.	S	Bend	trans	-108.5	-38.6	173.5	-59	0	0	0	0	111.3	D336	S331-D336 PolarHBondContact N-OD2 3.06Å
332	L	96.1	Very high	96.9	Very high	37 Å²	37	32.8 Å²	32.8	19%	0.194	17%	0.174	C	C	.	.	S	Bend	trans	-112	32.9	177.6	-56.3	-175.6	0	0	0	111.9	W276 Y277 D334 Q335 D336	W276-L332 HydrophobicContact CD2-CD1 3.87Å; W276-L332 HydrophobicContact CG-CD1 3.92Å; W276-L332 HydrophobicContact CH2-CD2 4.35Å; W276-L332 HydrophobicContact CZ2-CD1 4.13Å; W276-L332 HydrophobicContact CZ2-CD2 4.1Å; W276-L332 HydrophobicContact CZ2-CG 3.88Å; W276-L332 VanDerWaalsContact NE1-CD1 3.3Å; Y277-L332 HydrophobicContact CE2-CD1 4.39Å; L332-D334 PolarHBondContact O-N 3.08Å; L332-Q335 HydrophobicContact CB-CB 4Å; L332-Q335 WeakPolarHBondContact O-CB 3.42Å; L332-Q335 PolarHBondContact O-N 2.76Å; L332-D336 PolarHBondContact N-OD2 3.22Å
333	A	97.7	Very high	96.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.008	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	-123.1	175.9	0	0	0	0	0	113.9	H215 G221 L222 Q335 D336	H215-A333 HydrophobicContact CB-CB 3.75Å; G221-A333 WeakPolarHBondContact O-CB 3.29Å; L222-A333 HydrophobicContact CD2-CB 4Å; L222-A333 HydrophobicContact CG-CB 4.34Å; A333-Q335 PolarHBondContact O-N 2.68Å; A333-D336 PolarHBondContact O-N 3.18Å
334	D	98.3	Very high	96.9	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.032	18%	0.181	C	C	.	.	H	α-helix	trans	-55.2	-35.9	-179.7	59.2	19.1	0	0	0	113.1	G221 K224 L225 T297 L332 D336 I337 F338	G221-D334 VanDerWaalsContact O-CB 3.27Å; G221-D334 WeakPolarHBondContact O-CB 3.34Å; G221-D334 PolarHBondContact O-N 3Å; G221-D334 VanDerWaalsContact O-N 3.08Å; K224-D334 HydrophobicContact CB-CB 4.48Å; K224-D334 VanDerWaalsContact CB-OD2 3.27Å; K224-D334 WeakPolarHBondContact CB-OD2 3.16Å; K224-D334 WeakPolarHBondContact CD-OD2 3Å; K224-D334 VanDerWaalsContact CE-OD2 3.29Å; K224-D334 WeakPolarHBondContact CE-OD2 3.27Å; K224-D334 WeakPolarHBondContact CG-OD2 3.29Å; K224-D334 IonicContact NZ-OD2 2.89Å; L225-D334 HydrophobicContact CD2-CB 4.43Å; L225-D334 HydrophobicContact CG-CB 4.17Å; T297-D334 PolarHBondContact OG1-OD1 3.34Å; L332-D334 PolarHBondContact O-N 3.08Å; D334-D336 VanDerWaalsContact C-N 3.26Å; D334-D336 PolarHBondContact O-N 2.71Å; D334-I337 PolarHBondContact O-N 3.16Å; D334-F338 HydrophobicContact CB-CD2 4.19Å; D334-F338 HydrophobicContact CB-CE2 4.36Å; D334-F338 WeakPolarHBondContact O-CD2 3.24Å; D334-F338 PolarHBondContact O-N 3.01Å
335	Q	98.6	Very high	96.9	Very high	12 Å²	12	33.1 Å²	33.1	6%	0.056	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-39.8	-175.9	-160.6	-178.2	-88.8	0	0	111.5	Y277 Y295 N296 T297 L332 A333 N339	Y277-Q335 VanDerWaalsContact CE2-NE2 3.35Å; Y277-Q335 PolarHBondContact OH-NE2 3.37Å; Y295-Q335 WeakPolarHBondContact O-CG 3.15Å; N296-Q335 VanDerWaalsContact CA-OE1 3.3Å; N296-Q335 PolarHBondContact ND2-OE1 2.74Å; T297-Q335 HydrophobicContact CG2-CB 4.08Å; T297-Q335 HydrophobicContact CG2-CG 4Å; T297-Q335 WeakPolarHBondContact OG1-CB 3.35Å; L332-Q335 HydrophobicContact CB-CB 4Å; L332-Q335 WeakPolarHBondContact O-CB 3.42Å; L332-Q335 PolarHBondContact O-N 2.76Å; A333-Q335 PolarHBondContact O-N 2.68Å; Q335-N339 VanDerWaalsContact O-CB 3.31Å; Q335-N339 WeakPolarHBondContact O-CB 3.3Å; Q335-N339 PolarHBondContact O-N 2.88Å; Q335-N339 PolarHBondContact O-ND2 3.1Å
336	D	98.6	Very high	97.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-41.2	178	-76.7	-16.9	0	0	0	111.6	Y277 W288 T330 S331 L332 A333 D334 A340	Y277-D336 VanDerWaalsContact CE1-OD1 3.29Å; Y277-D336 WeakPolarHBondContact CE1-OD1 3.26Å; Y277-D336 PolarHBondContact OH-OD1 2.85Å; W288-D336 HydrophobicContact CB-CB 3.79Å; W288-D336 HydrophobicContact CD2-CB 3.71Å; W288-D336 HydrophobicContact CE3-CB 4.08Å; W288-D336 HydrophobicContact CG-CB 3.55Å; T330-D336 HydrophobicContact CG2-CB 4.25Å; S331-D336 PolarHBondContact N-OD2 3.06Å; L332-D336 PolarHBondContact N-OD2 3.22Å; A333-D336 PolarHBondContact O-N 3.18Å; D334-D336 VanDerWaalsContact C-N 3.26Å; D334-D336 PolarHBondContact O-N 2.71Å; D336-A340 WeakPolarHBondContact O-CB 3.43Å; D336-A340 PolarHBondContact O-N 2.99Å
337	I	98.8	Very high	97.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-73.2	-44.1	-179.5	-66.5	168.6	0	0	0	110.7	I211 L222 L225 W288 W316 A320 T330 D334 N339 A340 V341	I211-I337 HydrophobicContact CD1-CD1 3.66Å; I211-I337 HydrophobicContact CG2-CD1 4.14Å; L222-I337 HydrophobicContact CD2-CD1 4.27Å; L225-I337 HydrophobicContact CD1-CB 4.4Å; L225-I337 HydrophobicContact CD1-CD1 3.63Å; L225-I337 HydrophobicContact CD1-CG2 4.32Å; L225-I337 HydrophobicContact CD2-CB 4.14Å; L225-I337 HydrophobicContact CD2-CG2 3.77Å; W288-I337 HydrophobicContact CH2-CG1 4.38Å; W288-I337 HydrophobicContact CZ3-CG1 4.07Å; W316-I337 HydrophobicContact CB-CG2 3.87Å; W316-I337 HydrophobicContact CE3-CG2 4.4Å; A320-I337 HydrophobicContact CB-CD1 3.9Å; A320-I337 HydrophobicContact CB-CG1 4.09Å; A320-I337 HydrophobicContact CB-CG2 4.39Å; T330-I337 HydrophobicContact CG2-CD1 4.03Å; T330-I337 HydrophobicContact CG2-CG1 4.09Å; D334-I337 PolarHBondContact O-N 3.16Å; I337-N339 VanDerWaalsContact C-N 3.31Å; I337-N339 PolarHBondContact O-N 3.42Å; I337-A340 PolarHBondContact O-N 3.41Å; I337-V341 WeakPolarHBondContact O-CG2 3.47Å; I337-V341 PolarHBondContact O-N 3.03Å
338	F	98.8	Very high	97.6	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.009	16%	0.157	C	C	.	.	H	α-helix	trans	-55.3	-48.4	172.7	-91.5	-87	0	0	0	110.8	L225 L267 T297 I300 L302 W312 D334 A340 V341 I342	L225-F338 HydrophobicContact CD2-CD2 3.96Å; L225-F338 HydrophobicContact CD2-CE2 3.83Å; L267-F338 HydrophobicContact CD1-CD1 4.17Å; L267-F338 HydrophobicContact CD1-CE1 4.38Å; L267-F338 HydrophobicContact CD2-CE1 4.05Å; T297-F338 HydrophobicContact CG2-CB 4.06Å; T297-F338 HydrophobicContact CG2-CD2 3.89Å; T297-F338 HydrophobicContact CG2-CG 4.01Å; I300-F338 HydrophobicContact CD1-CE2 4.4Å; I300-F338 HydrophobicContact CD1-CZ 4.22Å; L302-F338 HydrophobicContact CD2-CE1 4.44Å; W312-F338 AromaticContact CH2-CD1 3.68Å; W312-F338 HydrophobicContact CH2-CD1 3.68Å; W312-F338 AromaticContact CH2-CE1 3.7Å; W312-F338 HydrophobicContact CH2-CE1 3.7Å; W312-F338 HydrophobicContact CH2-CG 4.44Å; W312-F338 HydrophobicContact CH2-CZ 4.46Å; W312-F338 AromaticContact CZ2-CD1 3.71Å; W312-F338 HydrophobicContact CZ2-CD1 3.71Å; W312-F338 AromaticContact CZ2-CE1 3.34Å; W312-F338 HydrophobicContact CZ2-CE1 3.34Å; W312-F338 HydrophobicContact CZ2-CE2 4.3Å; W312-F338 HydrophobicContact CZ2-CG 4.34Å; W312-F338 AromaticContact CZ2-CZ 3.68Å; W312-F338 HydrophobicContact CZ2-CZ 3.68Å; D334-F338 HydrophobicContact CB-CD2 4.19Å; D334-F338 HydrophobicContact CB-CE2 4.36Å; D334-F338 WeakPolarHBondContact O-CD2 3.24Å; D334-F338 PolarHBondContact O-N 3.01Å; F338-A340 PolarHBondContact O-N 2.91Å; F338-V341 PolarHBondContact O-N 3.3Å; F338-I342 WeakPolarHBondContact O-CB 3.37Å; F338-I342 WeakPolarHBondContact O-CD1 3.27Å; F338-I342 WeakPolarHBondContact O-CG1 3.41Å; F338-I342 PolarHBondContact O-N 3.49Å
339	N	98.9	Very high	98	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64	-39.1	179.3	-84.4	-70.6	0	0	0	113.2	Y277 P289 A290 G294 Y295 Q335 I337 I342 K343	Y277-N339 HydrophobicContact CE1-CB 4.33Å; P289-N339 CarbonylContact O-C 3.58Å; A290-N339 HydrophobicContact CB-CB 3.8Å; G294-N339 WeakPolarHBondContact CA-OD1 3.34Å; Y295-N339 PolarHBondContact N-OD1 2.97Å; Y295-N339 PolarHBondContact O-ND2 3.45Å; Q335-N339 VanDerWaalsContact O-CB 3.31Å; Q335-N339 WeakPolarHBondContact O-CB 3.3Å; Q335-N339 PolarHBondContact O-N 2.88Å; Q335-N339 PolarHBondContact O-ND2 3.1Å; I337-N339 VanDerWaalsContact C-N 3.31Å; I337-N339 PolarHBondContact O-N 3.42Å; N339-I342 PolarHBondContact O-N 3.17Å; N339-K343 WeakPolarHBondContact O-CB 3.29Å; N339-K343 PolarHBondContact O-N 3.24Å
340	A	98.7	Very high	98.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.5	-40.2	176.9	0	0	0	0	0	112	W288 P289 T319 E323 D336 I337 F338 K343 Q344	W288-A340 HydrophobicContact CE3-CB 4.19Å; P289-A340 WeakPolarHBondContact O-CA 3.44Å; P289-A340 PolarHBondContact O-N 3.41Å; P289-A340 VanDerWaalsContact O-N 3.17Å; T319-A340 HydrophobicContact CG2-CB 3.59Å; E323-A340 HydrophobicContact CG-CB 4.06Å; D336-A340 WeakPolarHBondContact O-CB 3.43Å; D336-A340 PolarHBondContact O-N 2.99Å; I337-A340 PolarHBondContact O-N 3.41Å; F338-A340 PolarHBondContact O-N 2.91Å; A340-K343 PolarHBondContact O-N 3.37Å; A340-Q344 PolarHBondContact O-N 3.45Å
341	V	98.8	Very high	98.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.2	-46.4	174	173.3	0	0	0	0	110.6	W312 M315 W316 T319 I337 F338 K343 Q344 N345	W312-V341 HydrophobicContact CH2-CB 4.27Å; W312-V341 HydrophobicContact CH2-CG1 4Å; W312-V341 HydrophobicContact CH2-CG2 4.45Å; W312-V341 HydrophobicContact CZ3-CB 4.34Å; W312-V341 HydrophobicContact CZ3-CG1 3.58Å; M315-V341 HydrophobicContact CG-CG1 3.86Å; M315-V341 HydrophobicContact SD-CG1 3.49Å; M315-V341 WeakPolarHBondContact SD-CG1 3.45Å; W316-V341 HydrophobicContact CB-CG2 4.03Å; T319-V341 HydrophobicContact CG2-CG2 3.85Å; I337-V341 WeakPolarHBondContact O-CG2 3.47Å; I337-V341 PolarHBondContact O-N 3.03Å; F338-V341 PolarHBondContact O-N 3.3Å; V341-K343 VanDerWaalsContact C-N 3.31Å; V341-K343 PolarHBondContact O-N 3.42Å; V341-Q344 PolarHBondContact O-N 2.96Å; V341-Q344 VanDerWaalsContact O-N 3.15Å; V341-N345 PolarHBondContact O-N 3.48Å; V341-N345 PolarHBondContact O-ND2 2.8Å
342	I	98.8	Very high	98.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-37.3	179.1	-71.8	164.8	0	0	0	111.3	L267 L269 L291 Y295 F338 N339 Q344 N345 P346 V349	L267-I342 HydrophobicContact CD1-CD1 4.04Å; L267-I342 HydrophobicContact CD1-CG1 4.02Å; L269-I342 HydrophobicContact CD1-CD1 3.49Å; L269-I342 VanDerWaalsContact CD1-CD1 3.49Å; L291-I342 HydrophobicContact CD1-CG2 3.5Å; L291-I342 HydrophobicContact CG-CG2 4.14Å; Y295-I342 HydrophobicContact CD2-CD1 4.12Å; Y295-I342 HydrophobicContact CD2-CG2 4.08Å; Y295-I342 HydrophobicContact CE2-CG2 3.85Å; F338-I342 WeakPolarHBondContact O-CB 3.37Å; F338-I342 WeakPolarHBondContact O-CD1 3.27Å; F338-I342 WeakPolarHBondContact O-CG1 3.41Å; F338-I342 PolarHBondContact O-N 3.49Å; N339-I342 PolarHBondContact O-N 3.17Å; I342-Q344 PolarHBondContact O-N 3.46Å; I342-N345 CarbonylContact O-C 3.59Å; I342-N345 PolarHBondContact O-N 2.8Å; I342-P346 WeakPolarHBondContact O-CA 3.2Å; I342-V349 HydrophobicContact CB-CG2 4.24Å; I342-V349 HydrophobicContact CD1-CG2 3.71Å; I342-V349 HydrophobicContact CG1-CG2 3.61Å; I342-V349 HydrophobicContact CG2-CG2 3.62Å
343	K	98.4	Very high	98.3	Very high	100 Å²	100	29 Å²	29	44%	0.435	14%	0.144	S	C	.	.	H	α-helix	trans	-57	-37.1	175.6	179.8	54	163.2	-159.6	0	112.4	P289 A290 L291 N339 A340 V341	P289-K343 HydrophobicContact CB-CB 4.38Å; P289-K343 HydrophobicContact CB-CG 4.13Å; A290-K343 WeakPolarHBondContact O-CD 3.28Å; A290-K343 WeakPolarHBondContact O-CE 3.21Å; A290-K343 PolarHBondContact O-NZ 3.4Å; A290-K343 VanDerWaalsContact O-NZ 3.11Å; L291-K343 HydrophobicContact CD2-CD 3.55Å; L291-K343 HydrophobicContact CG-CD 4.2Å; N339-K343 WeakPolarHBondContact O-CB 3.29Å; N339-K343 PolarHBondContact O-N 3.24Å; A340-K343 PolarHBondContact O-N 3.37Å; V341-K343 VanDerWaalsContact C-N 3.31Å; V341-K343 PolarHBondContact O-N 3.42Å
344	Q	97.8	Very high	98.2	Very high	71 Å²	71	31 Å²	31	33%	0.332	16%	0.157	S	C	.	.	H	α-helix	trans	-83.5	-23.7	177.6	-61.4	173.9	32.6	0	0	112.2	A340 V341 I342	A340-Q344 PolarHBondContact O-N 3.45Å; V341-Q344 PolarHBondContact O-N 2.96Å; V341-Q344 VanDerWaalsContact O-N 3.15Å; I342-Q344 PolarHBondContact O-N 3.46Å
345	N	98	Very high	98.1	Very high	34 Å²	34	33.5 Å²	33.5	18%	0.182	17%	0.168	C	C	.	.			trans	-134.6	64.4	-173	-53.9	-86.1	0	0	0	111.6	V341 I342 F347 L348	V341-N345 PolarHBondContact O-N 3.48Å; V341-N345 PolarHBondContact O-ND2 2.8Å; I342-N345 CarbonylContact O-C 3.59Å; I342-N345 PolarHBondContact O-N 2.8Å; N345-F347 HydrophobicContact CB-CE1 4.13Å; N345-F347 HydrophobicContact CB-CZ 3.99Å; N345-F347 PolarHBondContact O-N 3.22Å; N345-F347 VanDerWaalsContact O-N 3.13Å; N345-L348 HydrophobicContact CB-CD1 3.49Å; N345-L348 VanDerWaalsContact CB-CD1 3.49Å; N345-L348 HydrophobicContact CB-CG 3.75Å; N345-L348 WeakPolarHBondContact O-CB 2.96Å; N345-L348 WeakPolarHBondContact O-CG 3.27Å; N345-L348 PolarHBondContact O-N 3.18Å
346	P	97.8	Very high	98	Very high	68 Å²	68	33.3 Å²	33.3	44%	0.442	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-60.7	-28	-172.8	22	-34.1	0	0	0	113.8	L291 I342 L348 V349	L291-P346 HydrophobicContact CD1-CB 3.57Å; L291-P346 HydrophobicContact CD2-CB 4.48Å; I342-P346 WeakPolarHBondContact O-CA 3.2Å; P346-L348 PolarHBondContact O-N 3.27Å; P346-V349 PolarHBondContact O-N 2.97Å
347	F	97.6	Very high	98	Very high	94 Å²	94	33.3 Å²	33.3	41%	0.412	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-68.9	-11.5	-178.6	55.6	-96.6	0	0	0	114.2	Q264 N345 V349	Q264-F347 HydrophobicContact CB-CD2 3.77Å; Q264-F347 HydrophobicContact CB-CE2 4.32Å; N345-F347 HydrophobicContact CB-CE1 4.13Å; N345-F347 HydrophobicContact CB-CZ 3.99Å; N345-F347 PolarHBondContact O-N 3.22Å; N345-F347 VanDerWaalsContact O-N 3.13Å; F347-V349 PolarHBondContact O-N 3.37Å
348	L	98.3	Very high	97.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-73.1	-17	177.6	-61.2	-179.1	0	0	0	113.2	Q265 V266 L267 M310 M315 N345 P346	Q265-L348 WeakPolarHBondContact CA-O 3.33Å; V266-L348 HydrophobicContact CG2-CB 4.03Å; V266-L348 HydrophobicContact CG2-CD2 3.89Å; V266-L348 HydrophobicContact CG2-CG 4.4Å; V266-L348 PolarHBondContact N-O 3.32Å; L267-L348 PolarHBondContact N-O 3.25Å; M310-L348 HydrophobicContact CE-CD2 3.39Å; M310-L348 HydrophobicContact SD-CD2 4.02Å; M315-L348 HydrophobicContact SD-CD1 4.14Å; N345-L348 HydrophobicContact CB-CD1 3.49Å; N345-L348 VanDerWaalsContact CB-CD1 3.49Å; N345-L348 HydrophobicContact CB-CG 3.75Å; N345-L348 WeakPolarHBondContact O-CB 2.96Å; N345-L348 WeakPolarHBondContact O-CG 3.27Å; N345-L348 PolarHBondContact O-N 3.18Å; P346-L348 PolarHBondContact O-N 3.27Å
349	V	98.5	Very high	97.6	Very high	11 Å²	11	33.2 Å²	33.2	7%	0.067	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.6	-168.3	-174.9	0	0	0	0	111.9	Q265 L267 Y295 I342 P346 F347	Q265-V349 PolarHBondContact NE2-O 3.28Å; L267-V349 HydrophobicContact CB-CG2 4.48Å; L267-V349 CarbonylContact O-C 3.46Å; L267-V349 WeakPolarHBondContact O-CA 3.45Å; Y295-V349 HydrophobicContact CD1-CG1 4.37Å; Y295-V349 HydrophobicContact CE1-CG1 3.78Å; Y295-V349 HydrophobicContact CE2-CG1 4.24Å; Y295-V349 HydrophobicContact CE2-CG2 4.49Å; I342-V349 HydrophobicContact CB-CG2 4.24Å; I342-V349 HydrophobicContact CD1-CG2 3.71Å; I342-V349 HydrophobicContact CG1-CG2 3.61Å; I342-V349 HydrophobicContact CG2-CG2 3.62Å; P346-V349 PolarHBondContact O-N 2.97Å; F347-V349 PolarHBondContact O-N 3.37Å
350	Y	98.6	Very high	97.3	Very high	48 Å²	48	33.3 Å²	33.3	19%	0.188	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113.3	155.6	-178.9	-84.2	0	0	0	108.2	V257 K260 F261 L267 G268 L269 L352	V257-Y350 HydrophobicContact CG1-CD1 4.13Å; V257-Y350 HydrophobicContact CG1-CE1 3.6Å; K260-Y350 HydrophobicContact CB-CE2 3.73Å; K260-Y350 WeakPolarHBondContact CD-OH 3.38Å; K260-Y350 WeakPolarHBondContact O-CE2 3.5Å; F261-Y350 HydrophobicContact CD1-CD1 4.06Å; F261-Y350 AromaticContact CD1-CD2 3.96Å; F261-Y350 HydrophobicContact CD1-CD2 3.96Å; F261-Y350 AromaticContact CD1-CG 3.58Å; F261-Y350 HydrophobicContact CD1-CG 3.58Å; F261-Y350 AromaticContact CE1-CD1 3.73Å; F261-Y350 HydrophobicContact CE1-CD1 3.73Å; F261-Y350 HydrophobicContact CE1-CD2 4.44Å; F261-Y350 AromaticContact CE1-CG 3.64Å; F261-Y350 HydrophobicContact CE1-CG 3.64Å; F261-Y350 HydrophobicContact CG-CG 4.5Å; L267-Y350 PolarHBondContact O-N 3.29Å; G268-Y350 WeakPolarHBondContact CA-O 3.47Å; L269-Y350 PolarHBondContact N-O 3.3Å; Y350-L352 HydrophobicContact CD1-CD2 4.01Å; Y350-L352 HydrophobicContact CE1-CD2 4.07Å; Y350-L352 PolarHBondContact O-N 3.24Å
351	Q	98.5	Very high	96.7	Very high	106 Å²	106	34.4 Å²	34.4	50%	0.495	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	116.8	178.8	-178.6	170.6	-33.5	0	0	110.3	Y295	Y295-Q351 HydrophobicContact CE1-CB 4.32Å; Y295-Q351 HydrophobicContact CE1-CG 4.14Å
352	L	98.3	Very high	95.7	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.016	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	144	175.7	-64.6	172.2	0	0	0	110.7	V257 L269 V270 L301 Y350	V257-L352 HydrophobicContact CB-CD2 4.43Å; V257-L352 HydrophobicContact CG1-CD2 3.58Å; L269-L352 PolarHBondContact O-N 2.73Å; V270-L352 HydrophobicContact CG2-CB 3.52Å; V270-L352 HydrophobicContact CG2-CD1 4.15Å; V270-L352 HydrophobicContact CG2-CG 4.48Å; L301-L352 HydrophobicContact CD1-CD1 3.58Å; L301-L352 HydrophobicContact CD1-CD2 4.24Å; L301-L352 HydrophobicContact CD2-CD2 4.41Å; Y350-L352 HydrophobicContact CD1-CD2 4.01Å; Y350-L352 HydrophobicContact CE1-CD2 4.07Å; Y350-L352 PolarHBondContact O-N 3.24Å
353	P	96.4	Very high	94.8	Very high	53 Å²	53	45.3 Å²	45.3	34%	0.344	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-54.9	141.3	165.1	-25	33	0	0	0	111.6	F355 W356	P353-F355 VanDerWaalsContact C-N 3.27Å; P353-F355 HydrophobicContact CB-CD1 3.9Å; P353-F355 HydrophobicContact CB-CD2 4.3Å; P353-F355 HydrophobicContact CB-CE1 3.32Å; P353-F355 HydrophobicContact CB-CE2 3.79Å; P353-F355 HydrophobicContact CB-CG 4.36Å; P353-F355 HydrophobicContact CB-CZ 3.27Å; P353-F355 HydrophobicContact CG-CE1 4.24Å; P353-F355 HydrophobicContact CG-CE2 4.37Å; P353-F355 HydrophobicContact CG-CZ 3.81Å; P353-F355 PolarHBondContact O-N 3.33Å; P353-W356 WeakPolarHBondContact O-CB 3.46Å; P353-W356 PolarHBondContact O-N 3.27Å; P353-W356 VanDerWaalsContact O-N 3.1Å
354	C	95.8	Very high	94.3	Very high	41 Å²	41	42.2 Å²	42.2	28%	0.277	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-74.4	-13.8	-164.6	70.8	0	0	0	0	115.5	V270 Q273 W356 N357 V358 C369	V270-C354 HydrophobicContact CG1-CB 3.83Å; Q273-C354 PolarHBondContact NE2-O 2.99Å; C354-W356 PolarHBondContact O-N 3.4Å; C354-N357 CarbonylContact O-C 3.48Å; C354-N357 PolarHBondContact O-N 3.35Å; C354-N357 VanDerWaalsContact O-N 3.13Å; C354-V358 PolarHBondContact O-N 3.43Å; C354-C369 HydrophobicContact CB-CB 4.07Å; C354-C369 WeakPolarHBondContact CB-SG 3.43Å; C354-C369 WeakPolarHBondContact SG-CA 3.38Å; C354-C369 WeakPolarHBondContact SG-CB 3.16Å; C354-C369 CovalentContact SG-SG 2.04Å; C354-C369 PolarHBondContact SG-SG 3.29Å
355	F	95.4	Very high	93.9	Very high	59 Å²	59	43.3 Å²	43.3	26%	0.259	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-66.5	-13.9	169.9	52.9	-109.8	0	0	0	114.2	P353 D375 K377 V378	P353-F355 VanDerWaalsContact C-N 3.27Å; P353-F355 HydrophobicContact CB-CD1 3.9Å; P353-F355 HydrophobicContact CB-CD2 4.3Å; P353-F355 HydrophobicContact CB-CE1 3.32Å; P353-F355 HydrophobicContact CB-CE2 3.79Å; P353-F355 HydrophobicContact CB-CG 4.36Å; P353-F355 HydrophobicContact CB-CZ 3.27Å; P353-F355 HydrophobicContact CG-CE1 4.24Å; P353-F355 HydrophobicContact CG-CE2 4.37Å; P353-F355 HydrophobicContact CG-CZ 3.81Å; P353-F355 PolarHBondContact O-N 3.33Å; F355-D375 WeakPolarHBondContact CB-O 3.2Å; F355-K377 HydrophobicContact CD2-CB 4.31Å; F355-K377 HydrophobicContact CD2-CD 3.63Å; F355-K377 HydrophobicContact CD2-CG 3.79Å; F355-K377 HydrophobicContact CE2-CD 3.71Å; F355-K377 HydrophobicContact CE2-CG 4.35Å; F355-K377 WeakPolarHBondContact O-CB 3.29Å; F355-K377 PolarHBondContact O-N 3.1Å; F355-V378 PolarHBondContact O-N 3.21Å; F355-V378 VanDerWaalsContact O-N 3.09Å
356	W	97.3	Very high	93.5	Very high	9 Å²	9	41.7 Å²	41.7	3%	0.034	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-79.2	-4.4	171.9	-76.6	122	0	0	0	113.8	T249 E253 L254 V270 V299 P353 C354 K377 V378	T249-W356 HydrophobicContact CG2-CH2 4.05Å; T249-W356 HydrophobicContact CG2-CZ3 4Å; E253-W356 HydrophobicContact CB-CH2 3.63Å; E253-W356 HydrophobicContact CB-CZ2 3.96Å; L254-W356 HydrophobicContact CB-CD2 4.46Å; L254-W356 HydrophobicContact CB-CE3 3.96Å; L254-W356 HydrophobicContact CB-CH2 3.68Å; L254-W356 HydrophobicContact CB-CZ2 4.17Å; L254-W356 HydrophobicContact CB-CZ3 3.57Å; L254-W356 HydrophobicContact CD1-CB 4.42Å; L254-W356 HydrophobicContact CD1-CD2 3.64Å; L254-W356 HydrophobicContact CD1-CE3 3.78Å; L254-W356 HydrophobicContact CD1-CG 3.95Å; L254-W356 HydrophobicContact CD1-CZ2 4.42Å; L254-W356 HydrophobicContact CD1-CZ3 4.28Å; L254-W356 HydrophobicContact CD2-CE3 4.14Å; L254-W356 HydrophobicContact CD2-CZ3 4.4Å; L254-W356 HydrophobicContact CG-CD2 4.5Å; L254-W356 HydrophobicContact CG-CE3 4.17Å; L254-W356 HydrophobicContact CG-CZ3 4.29Å; L254-W356 VanDerWaalsContact N-CH2 3.27Å; V270-W356 HydrophobicContact CG2-CB 4.12Å; V299-W356 WeakPolarHBondContact CG2-O 3.25Å; P353-W356 WeakPolarHBondContact O-CB 3.46Å; P353-W356 PolarHBondContact O-N 3.27Å; P353-W356 VanDerWaalsContact O-N 3.1Å; C354-W356 PolarHBondContact O-N 3.4Å; W356-K377 HydrophobicContact CD2-CB 4.27Å; W356-K377 HydrophobicContact CD2-CD 3.95Å; W356-K377 HydrophobicContact CE3-CB 3.73Å; W356-K377 HydrophobicContact CE3-CD 4Å; W356-K377 HydrophobicContact CH2-CB 4.33Å; W356-K377 HydrophobicContact CH2-CD 3.45Å; W356-K377 VanDerWaalsContact CH2-CD 3.45Å; W356-K377 HydrophobicContact CH2-CG 4.5Å; W356-K377 HydrophobicContact CZ2-CD 3.43Å; W356-K377 VanDerWaalsContact CZ2-CD 3.43Å; W356-K377 HydrophobicContact CZ3-CB 3.74Å; W356-K377 HydrophobicContact CZ3-CD 3.74Å; W356-K377 HydrophobicContact CZ3-CG 4.37Å; W356-V378 HydrophobicContact CE3-CG2 3.75Å; W356-V378 HydrophobicContact CZ3-CG2 4.15Å; W356-V378 WeakPolarHBondContact O-CB 3.29Å
357	N	97.7	Very high	92.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-163.3	75.1	173.9	-174.6	-4.8	0	0	0	108.7	V270 Q273 N296 V299 C354 Q359 H380	V270-N357 HydrophobicContact CB-CB 3.7Å; V270-N357 HydrophobicContact CG1-CB 4.04Å; V270-N357 HydrophobicContact CG2-CB 3.57Å; Q273-N357 PolarHBondContact NE2-O 3.14Å; N296-N357 PolarHBondContact OD1-ND2 3.08Å; V299-N357 HydrophobicContact CB-CB 4.17Å; V299-N357 HydrophobicContact CG2-CB 4.02Å; C354-N357 CarbonylContact O-C 3.48Å; C354-N357 PolarHBondContact O-N 3.35Å; C354-N357 VanDerWaalsContact O-N 3.13Å; N357-Q359 WeakPolarHBondContact O-CG 3.32Å; N357-Q359 PolarHBondContact O-N 2.95Å; N357-Q359 PolarHBondContact O-NE2 3.45Å; N357-Q359 WeakPolarHBondContact OD1-CG 3.31Å; N357-H380 WeakPolarHBondContact OD1-CB 3.5Å; N357-H380 PolarHBondContact OD1-ND1 3.49Å
358	V	95.9	Very high	92.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	104.5	177.4	-178.3	0	0	0	0	108.5	C354 L360 C369 Y370 L376 V378 H380 F397	C354-V358 PolarHBondContact O-N 3.43Å; V358-L360 HydrophobicContact CG1-CD2 4.41Å; V358-C369 HydrophobicContact CG2-CB 4.38Å; V358-Y370 HydrophobicContact CG1-CD1 4.15Å; V358-Y370 HydrophobicContact CG1-CE1 3.84Å; V358-Y370 HydrophobicContact CG2-CD1 4.47Å; V358-L376 HydrophobicContact CG1-CD2 4.39Å; V358-L376 HydrophobicContact CG2-CD2 3.9Å; V358-V378 WeakPolarHBondContact CB-O 3.35Å; V358-V378 WeakPolarHBondContact CG2-O 3.35Å; V358-V378 PolarHBondContact N-O 2.81Å; V358-H380 PolarHBondContact O-N 3.41Å; V358-F397 HydrophobicContact CG1-CZ 4.43Å
359	Q	95.2	Very high	92	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.3	-168.3	-67.3	152.6	47.8	0	0	110.8	E271 N272 Q273 N296 N357 S361 T364 S366	E271-Q359 PolarHBondContact O-NE2 3.18Å; E271-Q359 VanDerWaalsContact O-NE2 3.11Å; N272-Q359 PolarHBondContact OD1-OE1 3.05Å; Q273-Q359 HydrophobicContact CB-CB 4.22Å; N296-Q359 HydrophobicContact CB-CG 4.33Å; N357-Q359 WeakPolarHBondContact O-CG 3.32Å; N357-Q359 PolarHBondContact O-N 2.95Å; N357-Q359 PolarHBondContact O-NE2 3.45Å; N357-Q359 WeakPolarHBondContact OD1-CG 3.31Å; Q359-S361 VanDerWaalsContact C-N 3.34Å; Q359-S361 PolarHBondContact O-N 3.17Å; Q359-T364 VanDerWaalsContact O-CB 3.29Å; Q359-T364 WeakPolarHBondContact O-CB 3.47Å; Q359-T364 PolarHBondContact O-OG1 3.41Å; Q359-S366 VanDerWaalsContact O-CB 3.25Å; Q359-S366 WeakPolarHBondContact O-CB 3.45Å; Q359-S366 PolarHBondContact O-OG 3.47Å
360	L	92.1	Very high	91.3	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	23%	0.227	C	C	.	.			trans	-96.2	39.1	-178.3	-57.4	-174.3	0	0	0	113.2	V358 I379 H380 W381 N382 S383 V389 F397	V358-L360 HydrophobicContact CG1-CD2 4.41Å; L360-I379 HydrophobicContact CD1-CG2 3.53Å; L360-I379 HydrophobicContact CG-CG2 4.05Å; L360-H380 WeakPolarHBondContact CB-O 3.43Å; L360-H380 PolarHBondContact N-O 2.69Å; L360-W381 HydrophobicContact CD1-CD2 4.07Å; L360-W381 HydrophobicContact CD1-CE3 3.62Å; L360-W381 HydrophobicContact CD1-CH2 4.05Å; L360-W381 HydrophobicContact CD1-CZ2 4.44Å; L360-W381 HydrophobicContact CD1-CZ3 3.6Å; L360-N382 VanDerWaalsContact C-OD1 3.29Å; L360-N382 PolarHBondContact N-OD1 3.13Å; L360-S383 VanDerWaalsContact O-CB 3.25Å; L360-S383 WeakPolarHBondContact O-CB 3.41Å; L360-V389 HydrophobicContact CB-CG2 4.2Å; L360-V389 HydrophobicContact CD1-CG2 4.4Å; L360-V389 WeakPolarHBondContact O-CG1 3.28Å; L360-F397 HydrophobicContact CD1-CB 4.29Å; L360-F397 HydrophobicContact CD1-CD2 3.72Å; L360-F397 HydrophobicContact CD1-CE2 4.31Å; L360-F397 HydrophobicContact CD1-CG 4.18Å; L360-F397 HydrophobicContact CD2-CD2 3.91Å; L360-F397 HydrophobicContact CD2-CE2 3.64Å; L360-F397 HydrophobicContact CD2-CZ 4.41Å; L360-F397 HydrophobicContact CG-CD2 4.49Å
361	S	84.6	Confident	90.5	Very high	22 Å²	22	54.8 Å²	54.8	15%	0.154	26%	0.258	C	S	.	.			trans	-73.4	168.6	-179.9	74.1	0	0	0	0	112.7	Q359 T364 N382	Q359-S361 VanDerWaalsContact C-N 3.34Å; Q359-S361 PolarHBondContact O-N 3.17Å; S361-T364 WeakPolarHBondContact O-CB 3.36Å; S361-T364 WeakPolarHBondContact O-CG2 3.42Å; S361-T364 PolarHBondContact O-N 3.19Å; S361-N382 WeakPolarHBondContact CA-OD1 3.35Å; S361-N382 PolarHBondContact N-OD1 2.92Å
362	D	77.8	Confident	89.5	Confident	71 Å²	71	54.6 Å²	54.6	38%	0.38	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	143.2	162.6	-73	-16	0	0	0	109.6	T364 K385	D362-T364 PolarHBondContact O-N 3.29Å; D362-T364 VanDerWaalsContact O-N 3.11Å; D362-K385 IonicContact OD1-NZ 2.72Å; D362-K385 PolarHBondContact OD1-NZ 3.48Å; D362-K385 IonicContact OD2-NZ 3.84Å; D362-K385 PolarHBondContact OD2-NZ 3.42Å
363	H	81.3	Confident	88.3	Confident	159 Å²	159	57.6 Å²	57.6	74%	0.736	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	23.7	-176.9	-53.6	-78.6	0	0	0	115.2
364	T	86.4	Confident	87.5	Confident	34 Å²	34	59.8 Å²	59.8	21%	0.209	30%	0.295	C	S	.	.			trans	-65.5	150.9	176.7	-174	0	0	0	0	112.5	Q273 Q359 S361 D362 S366	Q273-T364 CarbonylContact O-C 3.27Å; Q273-T364 WeakPolarHBondContact O-CA 3.16Å; Q359-T364 VanDerWaalsContact O-CB 3.29Å; Q359-T364 WeakPolarHBondContact O-CB 3.47Å; Q359-T364 PolarHBondContact O-OG1 3.41Å; S361-T364 WeakPolarHBondContact O-CB 3.36Å; S361-T364 WeakPolarHBondContact O-CG2 3.42Å; S361-T364 PolarHBondContact O-N 3.19Å; D362-T364 PolarHBondContact O-N 3.29Å; D362-T364 VanDerWaalsContact O-N 3.11Å; T364-S366 WeakPolarHBondContact CG2-OG 3.3Å; T364-S366 WeakPolarHBondContact OG1-CB 3.38Å; T364-S366 PolarHBondContact OG1-N 3.44Å; T364-S366 VanDerWaalsContact OG1-N 3.08Å; T364-S366 PolarHBondContact OG1-OG 2.86Å
365	R	89.5	Confident	86.8	Confident	95 Å²	95	60.9 Å²	60.9	36%	0.358	30%	0.298	S	S	.	.			trans	-105.2	17.3	171.7	-59.9	178.3	172.6	-142.3	1.3	111.9	Q273 D275 E367 Q368	Q273-R365 WeakPolarHBondContact O-CB 3.41Å; Q273-R365 PolarHBondContact O-N 3.27Å; D275-R365 IonicContact OD1-CZ 3.92Å; D275-R365 IonicContact OD1-NE 2.81Å; D275-R365 PolarHBondContact OD1-NE 2.89Å; D275-R365 IonicContact OD1-NH2 3.41Å; D275-R365 PolarHBondContact OD1-NH2 3.37Å; D275-R365 IonicContact OD2-CZ 2.69Å; D275-R365 IonicContact OD2-NE 2.79Å; D275-R365 IonicContact OD2-NH2 2.7Å; D275-R365 PolarHBondContact OD2-NH2 3.02Å; R365-E367 PolarHBondContact O-N 2.84Å; R365-Q368 WeakPolarHBondContact O-CB 3.21Å; R365-Q368 PolarHBondContact O-N 2.97Å
366	S	89.8	Confident	86.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-57.3	-24.2	-173	58.1	0	0	0	0	115.4	Q273 Q359 T364 Q368 C369 Y370 N391	Q273-S366 VanDerWaalsContact OE1-CA 3.26Å; Q359-S366 VanDerWaalsContact O-CB 3.25Å; Q359-S366 WeakPolarHBondContact O-CB 3.45Å; Q359-S366 PolarHBondContact O-OG 3.47Å; T364-S366 WeakPolarHBondContact CG2-OG 3.3Å; T364-S366 WeakPolarHBondContact OG1-CB 3.38Å; T364-S366 PolarHBondContact OG1-N 3.44Å; T364-S366 VanDerWaalsContact OG1-N 3.08Å; T364-S366 PolarHBondContact OG1-OG 2.86Å; S366-Q368 PolarHBondContact O-N 2.86Å; S366-Q368 VanDerWaalsContact O-N 3.09Å; S366-C369 VanDerWaalsContact O-CB 3.3Å; S366-C369 WeakPolarHBondContact O-CB 3.48Å; S366-C369 PolarHBondContact O-N 3.17Å; S366-Y370 WeakPolarHBondContact O-CD1 3.34Å; S366-Y370 WeakPolarHBondContact O-CE1 3.47Å; S366-N391 PolarHBondContact OG-ND2 3.07Å
367	E	85.9	Confident	86.2	Confident	97 Å²	97	59.7 Å²	59.7	45%	0.453	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-61.6	-15.4	174.7	-59.8	-174.7	175.6	0	0	113.3	R365 C369 K392	R365-E367 PolarHBondContact O-N 2.84Å; E367-C369 VanDerWaalsContact C-N 3.31Å; E367-K392 WeakPolarHBondContact OE1-CB 3.28Å; E367-K392 PolarHBondContact OE1-N 3.32Å
368	Q	87.7	Confident	86.1	Confident	150 Å²	150	59.7 Å²	59.7	70%	0.701	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-82.6	-8.9	174.9	-59.6	175.6	10.7	0	0	112.8	R365 S366	R365-Q368 WeakPolarHBondContact O-CB 3.21Å; R365-Q368 PolarHBondContact O-N 2.97Å; S366-Q368 PolarHBondContact O-N 2.86Å; S366-Q368 VanDerWaalsContact O-N 3.09Å
369	C	89.4	Confident	86.1	Confident	15 Å²	15	59.8 Å²	59.8	10%	0.101	29%	0.294	C	S	.	.	S	Bend	trans	-90	-11.4	-172.7	-72.9	0	0	0	0	115.5	Q273 C354 V358 S366 E367	Q273-C369 PolarHBondContact NE2-SG 3Å; C354-C369 HydrophobicContact CB-CB 4.07Å; C354-C369 WeakPolarHBondContact CB-SG 3.43Å; C354-C369 WeakPolarHBondContact SG-CA 3.38Å; C354-C369 WeakPolarHBondContact SG-CB 3.16Å; C354-C369 CovalentContact SG-SG 2.04Å; C354-C369 PolarHBondContact SG-SG 3.29Å; V358-C369 HydrophobicContact CG2-CB 4.38Å; S366-C369 VanDerWaalsContact O-CB 3.3Å; S366-C369 WeakPolarHBondContact O-CB 3.48Å; S366-C369 PolarHBondContact O-N 3.17Å; E367-C369 VanDerWaalsContact C-N 3.31Å
370	Y	84.3	Confident	86.2	Confident	13 Å²	13	59.9 Å²	59.9	5%	0.051	29%	0.294	C	S	.	.			trans	-149.4	144.8	-177.4	56.8	-85	0	0	0	108.6	V358 S366 L376 N391 H393 F397	V358-Y370 HydrophobicContact CG1-CD1 4.15Å; V358-Y370 HydrophobicContact CG1-CE1 3.84Å; V358-Y370 HydrophobicContact CG2-CD1 4.47Å; S366-Y370 WeakPolarHBondContact O-CD1 3.34Å; S366-Y370 WeakPolarHBondContact O-CE1 3.47Å; Y370-L376 HydrophobicContact CD1-CD2 3.4Å; Y370-L376 VanDerWaalsContact CD1-CD2 3.4Å; Y370-L376 HydrophobicContact CD2-CD2 3.96Å; Y370-L376 HydrophobicContact CD2-CG 4.29Å; Y370-L376 HydrophobicContact CE1-CD2 3.91Å; Y370-L376 HydrophobicContact CE2-CD2 4.4Å; Y370-L376 HydrophobicContact CG-CD2 3.45Å; Y370-L376 VanDerWaalsContact CG-CD2 3.45Å; Y370-L376 HydrophobicContact CG-CG 4.11Å; Y370-N391 PolarHBondContact OH-OD1 2.71Å; Y370-H393 HydrophobicContact CE2-CB 4.19Å; Y370-H393 AromaticContact CE2-CD2 3.42Å; Y370-H393 VanDerWaalsContact CE2-CD2 3.42Å; Y370-H393 WeakPolarHBondContact CE2-CD2 3.17Å; Y370-H393 AromaticContact CE2-CG 3.77Å; Y370-H393 AromaticContact CE2-NE2 3.98Å; Y370-H393 AromaticContact CZ-CD2 3.81Å; Y370-H393 PolarHBondContact OH-CD2 3.11Å; Y370-H393 VanDerWaalsContact OH-CD2 3.3Å; Y370-F397 AromaticContact CE1-CZ 3.93Å; Y370-F397 HydrophobicContact CE1-CZ 3.93Å; Y370-F397 HydrophobicContact CE2-CZ 4.33Å; Y370-F397 AromaticContact CZ-CZ 3.62Å; Y370-F397 VanDerWaalsContact OH-CZ 3.3Å; Y370-F397 WeakPolarHBondContact OH-CZ 3.3Å
371	R	80.6	Confident	86.3	Confident	221 Å²	221	60 Å²	60	83%	0.834	29%	0.294	S	S	*	.	S	Bend	trans	-93.5	-44.1	172.2	-67	-178.5	176.8	-177.1	-0.1	109.7	D375	R371-D375 PolarHBondContact N-OD2 3.36Å
372	D	77.5	Confident	86.7	Confident	103 Å²	103	60.2 Å²	60.2	55%	0.551	29%	0.294	S	S	*	.	S	Bend	trans	-127.1	162.7	179.7	-68.6	-57.4	0	0	0	111.3	S374 D375	D372-S374 PolarHBondContact O-N 3.28Å; D372-S374 VanDerWaalsContact O-N 3.15Å; D372-D375 PolarHBondContact N-OD2 3.2Å; D372-D375 VanDerWaalsContact N-OD2 3.12Å; D372-D375 WeakPolarHBondContact O-CB 3.47Å; D372-D375 PolarHBondContact O-N 2.72Å
373	V	73.7	Confident	87.2	Confident	65 Å²	65	56.8 Å²	56.8	39%	0.394	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-61.2	-23.6	-179.4	-68.2	0	0	0	0	113.4	D375 L376 F396	V373-D375 VanDerWaalsContact C-N 3.27Å; V373-D375 PolarHBondContact O-N 3.39Å; V373-L376 HydrophobicContact CB-CD1 4.24Å; V373-L376 HydrophobicContact CG1-CD1 4.38Å; V373-L376 WeakPolarHBondContact O-CB 3.39Å; V373-L376 PolarHBondContact O-N 3.47Å; V373-F396 HydrophobicContact CB-CD1 4.31Å; V373-F396 HydrophobicContact CB-CD2 4.32Å; V373-F396 HydrophobicContact CB-CE1 4.01Å; V373-F396 HydrophobicContact CB-CE2 4Å; V373-F396 HydrophobicContact CB-CG 4.46Å; V373-F396 HydrophobicContact CB-CZ 3.85Å; V373-F396 HydrophobicContact CG1-CB 4.41Å; V373-F396 HydrophobicContact CG1-CD1 3.83Å; V373-F396 HydrophobicContact CG1-CD2 3.92Å; V373-F396 HydrophobicContact CG1-CE1 4.06Å; V373-F396 HydrophobicContact CG1-CE2 4.12Å; V373-F396 HydrophobicContact CG1-CG 3.77Å; V373-F396 HydrophobicContact CG1-CZ 4.2Å; V373-F396 HydrophobicContact CG2-CE2 4.4Å
374	S	79.6	Confident	87.4	Confident	99 Å²	99	54.2 Å²	54.2	69%	0.692	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-71.3	-18.5	175.9	51	0	0	0	0	113.9	D372 L376	D372-S374 PolarHBondContact O-N 3.28Å; D372-S374 VanDerWaalsContact O-N 3.15Å; S374-L376 VanDerWaalsContact C-N 3.28Å
375	D	80.8	Confident	87.3	Confident	64 Å²	64	57.3 Å²	57.3	34%	0.342	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-81.2	-13.1	178.3	-57.6	-31.8	0	0	0	112.1	F355 R371 D372 V373	F355-D375 WeakPolarHBondContact CB-O 3.2Å; R371-D375 PolarHBondContact N-OD2 3.36Å; D372-D375 PolarHBondContact N-OD2 3.2Å; D372-D375 VanDerWaalsContact N-OD2 3.12Å; D372-D375 WeakPolarHBondContact O-CB 3.47Å; D372-D375 PolarHBondContact O-N 2.72Å; V373-D375 VanDerWaalsContact C-N 3.27Å; V373-D375 PolarHBondContact O-N 3.39Å
376	L	85	Confident	87.2	Confident	7 Å²	7	55.5 Å²	55.5	4%	0.037	28%	0.278	C	S	.	.			trans	-75.8	127.4	-175.7	-64.9	166.3	0	0	0	110.8	V358 Y370 V373 S374 F396 F397	V358-L376 HydrophobicContact CG1-CD2 4.39Å; V358-L376 HydrophobicContact CG2-CD2 3.9Å; Y370-L376 HydrophobicContact CD1-CD2 3.4Å; Y370-L376 VanDerWaalsContact CD1-CD2 3.4Å; Y370-L376 HydrophobicContact CD2-CD2 3.96Å; Y370-L376 HydrophobicContact CD2-CG 4.29Å; Y370-L376 HydrophobicContact CE1-CD2 3.91Å; Y370-L376 HydrophobicContact CE2-CD2 4.4Å; Y370-L376 HydrophobicContact CG-CD2 3.45Å; Y370-L376 VanDerWaalsContact CG-CD2 3.45Å; Y370-L376 HydrophobicContact CG-CG 4.11Å; V373-L376 HydrophobicContact CB-CD1 4.24Å; V373-L376 HydrophobicContact CG1-CD1 4.38Å; V373-L376 WeakPolarHBondContact O-CB 3.39Å; V373-L376 PolarHBondContact O-N 3.47Å; S374-L376 VanDerWaalsContact C-N 3.28Å; L376-F396 HydrophobicContact CD1-CD1 3.87Å; L376-F396 HydrophobicContact CD1-CE1 3.5Å; L376-F396 VanDerWaalsContact CD1-CE1 3.5Å; L376-F397 HydrophobicContact CD1-CD1 4.26Å; L376-F397 HydrophobicContact CD1-CE1 3.47Å; L376-F397 VanDerWaalsContact CD1-CE1 3.47Å; L376-F397 HydrophobicContact CD1-CZ 4.35Å; L376-F397 HydrophobicContact CD2-CE1 3.91Å; L376-F397 HydrophobicContact CD2-CZ 4.27Å; L376-F397 HydrophobicContact CG-CE1 4.33Å
377	K	94.6	Very high	86.9	Confident	37 Å²	37	56.3 Å²	56.3	16%	0.161	28%	0.283	C	S	.	.			trans	-111.2	-46.4	176	-58.6	-161.8	174.7	-148.4	0	112.3	A248 T249 E253 F355 W356	A248-K377 PolarHBondContact N-O 3.21Å; T249-K377 HydrophobicContact CG2-CB 3.73Å; T249-K377 HydrophobicContact CG2-CD 3.97Å; T249-K377 HydrophobicContact CG2-CG 3.9Å; E253-K377 IonicContact OE2-NZ 2.78Å; E253-K377 PolarHBondContact OE2-NZ 3.45Å; F355-K377 HydrophobicContact CD2-CB 4.31Å; F355-K377 HydrophobicContact CD2-CD 3.63Å; F355-K377 HydrophobicContact CD2-CG 3.79Å; F355-K377 HydrophobicContact CE2-CD 3.71Å; F355-K377 HydrophobicContact CE2-CG 4.35Å; F355-K377 WeakPolarHBondContact O-CB 3.29Å; F355-K377 PolarHBondContact O-N 3.1Å; W356-K377 HydrophobicContact CD2-CB 4.27Å; W356-K377 HydrophobicContact CD2-CD 3.95Å; W356-K377 HydrophobicContact CE3-CB 3.73Å; W356-K377 HydrophobicContact CE3-CD 4Å; W356-K377 HydrophobicContact CH2-CB 4.33Å; W356-K377 HydrophobicContact CH2-CD 3.45Å; W356-K377 VanDerWaalsContact CH2-CD 3.45Å; W356-K377 HydrophobicContact CH2-CG 4.5Å; W356-K377 HydrophobicContact CZ2-CD 3.43Å; W356-K377 VanDerWaalsContact CZ2-CD 3.43Å; W356-K377 HydrophobicContact CZ3-CB 3.74Å; W356-K377 HydrophobicContact CZ3-CD 3.74Å; W356-K377 HydrophobicContact CZ3-CG 4.37Å
378	V	97.1	Very high	86.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	125.1	-176.2	-177	0	0	0	0	110.4	I245 F247 V299 F355 W356 V358	I245-V378 HydrophobicContact CD1-CG1 4.3Å; I245-V378 HydrophobicContact CG2-CG1 3.38Å; F247-V378 HydrophobicContact CD1-CG2 3.92Å; F247-V378 HydrophobicContact CE1-CG2 3.71Å; F247-V378 HydrophobicContact CE2-CG1 4.4Å; F247-V378 HydrophobicContact CE2-CG2 4.31Å; F247-V378 HydrophobicContact CG-CG2 4.33Å; F247-V378 HydrophobicContact CZ-CG2 3.92Å; V299-V378 HydrophobicContact CG2-CG1 4.01Å; F355-V378 PolarHBondContact O-N 3.21Å; F355-V378 VanDerWaalsContact O-N 3.09Å; W356-V378 HydrophobicContact CE3-CG2 3.75Å; W356-V378 HydrophobicContact CZ3-CG2 4.15Å; W356-V378 WeakPolarHBondContact O-CB 3.29Å; V358-V378 WeakPolarHBondContact CB-O 3.35Å; V358-V378 WeakPolarHBondContact CG2-O 3.35Å; V358-V378 PolarHBondContact N-O 2.81Å
379	I	96.3	Very high	86.5	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.9	175.9	-60.4	93	0	0	0	108.8	I245 T246 A248 L360 W381 F397 L400	I245-I379 CarbonylContact C-O 3.6Å; I245-I379 WeakPolarHBondContact CA-O 3.38Å; T246-I379 PolarHBondContact N-O 3.18Å; T246-I379 PolarHBondContact O-N 3.34Å; A248-I379 HydrophobicContact CB-CD1 4.32Å; L360-I379 HydrophobicContact CD1-CG2 3.53Å; L360-I379 HydrophobicContact CG-CG2 4.05Å; I379-W381 HydrophobicContact CG2-CD2 4.46Å; I379-W381 HydrophobicContact CG2-CZ2 4.2Å; I379-F397 HydrophobicContact CD1-CD1 4.48Å; I379-F397 HydrophobicContact CG1-CD1 3.79Å; I379-F397 HydrophobicContact CG1-CE1 3.94Å; I379-F397 HydrophobicContact CG2-CD1 4.39Å; I379-F397 HydrophobicContact CG2-CG 4.43Å; I379-L400 HydrophobicContact CD1-CD2 3.72Å
380	H	96.7	Very high	86.1	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.009	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.5	-179.5	-176.6	-172.3	0	0	0	110.7	D242 D244 I245 N296 G298 N357 V358 L360 N382	D242-H380 IonicContact OD2-CE1 3.27Å; D242-H380 IonicContact OD2-NE2 3.72Å; D242-H380 PolarHBondContact OD2-NE2 3.04Å; D244-H380 IonicContact OD1-CD2 2.8Å; D244-H380 PolarHBondContact OD1-CD2 3.34Å; D244-H380 IonicContact OD1-NE2 3.49Å; D244-H380 PolarHBondContact OD1-NE2 2.87Å; I245-H380 HydrophobicContact CD1-CB 3.54Å; I245-H380 VanDerWaalsContact CD1-CG 3.47Å; N296-H380 PolarHBondContact OD1-CE1 3.26Å; N296-H380 PolarHBondContact OD1-ND1 2.84Å; G298-H380 VanDerWaalsContact CA-CE1 3.49Å; G298-H380 WeakPolarHBondContact CA-CE1 3.31Å; N357-H380 WeakPolarHBondContact OD1-CB 3.5Å; N357-H380 PolarHBondContact OD1-ND1 3.49Å; V358-H380 PolarHBondContact O-N 3.41Å; L360-H380 WeakPolarHBondContact CB-O 3.43Å; L360-H380 PolarHBondContact N-O 2.69Å; H380-N382 WeakPolarHBondContact NE2-CB 3.28Å; H380-N382 PolarHBondContact O-N 2.89Å; H380-N382 PolarHBondContact O-OD1 2.78Å
381	W	94.4	Very high	86	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.015	30%	0.301	C	S	.	.			trans	-83.2	42	-176.7	-59.6	96.1	0	0	0	112.8	D244 T246 L360 I379 S383 K386 L387 V389 F397 R398 Y401	D244-W381 HydrophobicContact CB-CB 4.15Å; D244-W381 WeakPolarHBondContact O-CB 3.19Å; D244-W381 VanDerWaalsContact O-CD1 3.24Å; D244-W381 PolarHBondContact O-N 3.42Å; D244-W381 VanDerWaalsContact OD2-C 3.29Å; T246-W381 PolarHBondContact OG1-NE1 2.94Å; T246-W381 VanDerWaalsContact OG1-NE1 3.08Å; L360-W381 HydrophobicContact CD1-CD2 4.07Å; L360-W381 HydrophobicContact CD1-CE3 3.62Å; L360-W381 HydrophobicContact CD1-CH2 4.05Å; L360-W381 HydrophobicContact CD1-CZ2 4.44Å; L360-W381 HydrophobicContact CD1-CZ3 3.6Å; I379-W381 HydrophobicContact CG2-CD2 4.46Å; I379-W381 HydrophobicContact CG2-CZ2 4.2Å; W381-S383 PolarHBondContact O-N 2.78Å; W381-K386 HydrophobicContact CB-CD 4.44Å; W381-K386 WeakPolarHBondContact O-CD 3.4Å; W381-L387 HydrophobicContact CD2-CD2 4.06Å; W381-L387 HydrophobicContact CE3-CD2 3.78Å; W381-L387 HydrophobicContact CH2-CD2 3.54Å; W381-L387 HydrophobicContact CZ2-CD2 3.85Å; W381-L387 HydrophobicContact CZ3-CD2 3.52Å; W381-V389 HydrophobicContact CZ3-CG2 4.31Å; W381-F397 VanDerWaalsContact CH2-C 3.48Å; W381-F397 HydrophobicContact CH2-CB 3.43Å; W381-F397 VanDerWaalsContact CH2-CB 3.43Å; W381-F397 HydrophobicContact CZ2-CB 3.78Å; W381-F397 VanDerWaalsContact CZ2-O 3.28Å; W381-F397 WeakPolarHBondContact CZ2-O 3.46Å; W381-F397 HydrophobicContact CZ3-CB 4.34Å; W381-R398 HydrophobicContact CH2-CG 4.27Å; W381-Y401 HydrophobicContact CZ2-CG 4.37Å; W381-Y401 AromaticContact NE1-CD2 3.64Å
382	N	92.1	Very high	86.1	Confident	27 Å²	27	59.6 Å²	59.6	14%	0.144	29%	0.294	C	S	.	.			trans	-70.4	1.2	-169.6	67	-23.9	0	0	0	116.3	L360 S361 H380	L360-N382 VanDerWaalsContact C-OD1 3.29Å; L360-N382 PolarHBondContact N-OD1 3.13Å; S361-N382 WeakPolarHBondContact CA-OD1 3.35Å; S361-N382 PolarHBondContact N-OD1 2.92Å; H380-N382 WeakPolarHBondContact NE2-CB 3.28Å; H380-N382 PolarHBondContact O-N 2.89Å; H380-N382 PolarHBondContact O-OD1 2.78Å
383	S	89.1	Confident	86.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	-78.5	142.3	170.1	-178.4	0	0	0	0	110.8	L360 W381 K385 K386	L360-S383 VanDerWaalsContact O-CB 3.25Å; L360-S383 WeakPolarHBondContact O-CB 3.41Å; W381-S383 PolarHBondContact O-N 2.78Å; S383-K385 PolarHBondContact O-N 3.42Å; S383-K385 WeakPolarHBondContact OG-CB 3.26Å; S383-K385 PolarHBondContact OG-N 3.2Å; S383-K385 VanDerWaalsContact OG-N 3.08Å; S383-K386 WeakPolarHBondContact O-CA 3.35Å; S383-K386 WeakPolarHBondContact O-CD 3.49Å; S383-K386 PolarHBondContact O-N 3.34Å
384	P	84.8	Confident	86.7	Confident	104 Å²	104	54.4 Å²	54.4	68%	0.675	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.2	165.8	-24.6	34.6	0	0	0	113.4	K386	P384-K386 VanDerWaalsContact C-N 3.25Å; P384-K386 PolarHBondContact O-N 3.18Å
385	K	85.3	Confident	86.9	Confident	99 Å²	99	52.5 Å²	52.5	43%	0.43	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.1	175.1	-64.5	172.4	-171.1	140.1	0	112.6	D362 S383 L387 R388 V389	D362-K385 IonicContact OD1-NZ 2.72Å; D362-K385 PolarHBondContact OD1-NZ 3.48Å; D362-K385 IonicContact OD2-NZ 3.84Å; D362-K385 PolarHBondContact OD2-NZ 3.42Å; S383-K385 PolarHBondContact O-N 3.42Å; S383-K385 WeakPolarHBondContact OG-CB 3.26Å; S383-K385 PolarHBondContact OG-N 3.2Å; S383-K385 VanDerWaalsContact OG-N 3.08Å; K385-L387 PolarHBondContact O-N 3.44Å; K385-R388 HydrophobicContact CB-CB 4.17Å; K385-R388 WeakPolarHBondContact O-CA 3.47Å; K385-R388 VanDerWaalsContact O-CB 3.28Å; K385-R388 WeakPolarHBondContact O-CB 3.4Å; K385-R388 PolarHBondContact O-N 2.93Å; K385-V389 HydrophobicContact CB-CG1 4.14Å
386	K	86.4	Confident	87.2	Confident	57 Å²	57	53.1 Å²	53.1	25%	0.248	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	47.7	-117.8	-179.5	-59.2	-69.6	176.3	171	0	110.7	D244 W381 S383 P384 R388 V389	D244-K386 IonicContact OD2-NZ 3.52Å; D244-K386 PolarHBondContact OD2-NZ 3.19Å; W381-K386 HydrophobicContact CB-CD 4.44Å; W381-K386 WeakPolarHBondContact O-CD 3.4Å; S383-K386 WeakPolarHBondContact O-CA 3.35Å; S383-K386 WeakPolarHBondContact O-CD 3.49Å; S383-K386 PolarHBondContact O-N 3.34Å; P384-K386 VanDerWaalsContact C-N 3.25Å; P384-K386 PolarHBondContact O-N 3.18Å; K386-R388 PolarHBondContact O-N 3.29Å; K386-R388 VanDerWaalsContact O-N 3.1Å; K386-V389 WeakPolarHBondContact O-CG1 3.49Å; K386-V389 WeakPolarHBondContact O-CG2 3.37Å; K386-V389 PolarHBondContact O-N 2.91Å
387	L	84.1	Confident	87.4	Confident	17 Å²	17	52.8 Å²	52.8	9%	0.089	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-62.4	-19.3	179.1	-59.3	177.7	0	0	0	113.4	L79 W381 K385 V389 R398 Y401	L79-L387 HydrophobicContact CD1-CD1 4Å; L79-L387 HydrophobicContact CD2-CD1 3.7Å; L79-L387 HydrophobicContact CG-CD1 4.37Å; W381-L387 HydrophobicContact CD2-CD2 4.06Å; W381-L387 HydrophobicContact CE3-CD2 3.78Å; W381-L387 HydrophobicContact CH2-CD2 3.54Å; W381-L387 HydrophobicContact CZ2-CD2 3.85Å; W381-L387 HydrophobicContact CZ3-CD2 3.52Å; K385-L387 PolarHBondContact O-N 3.44Å; L387-V389 VanDerWaalsContact C-N 3.28Å; L387-V389 PolarHBondContact O-N 3.5Å; L387-R398 HydrophobicContact CD2-CG 4.47Å; L387-R398 PolarHBondContact O-NE 3.45Å; L387-R398 PolarHBondContact O-NH2 3.5Å; L387-Y401 HydrophobicContact CD1-CD1 3.79Å; L387-Y401 HydrophobicContact CD1-CE1 3.76Å; L387-Y401 HydrophobicContact CD2-CD1 3.7Å; L387-Y401 HydrophobicContact CD2-CD2 4.31Å; L387-Y401 HydrophobicContact CD2-CE1 4.18Å; L387-Y401 HydrophobicContact CD2-CG 3.77Å; L387-Y401 HydrophobicContact CG-CD1 4.31Å; L387-Y401 HydrophobicContact CG-CE1 4.38Å
388	R	82.8	Confident	87.1	Confident	178 Å²	178	53.1 Å²	53.1	67%	0.672	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-84.8	6.5	-175.6	-58.2	173.6	59.7	-163.6	-0.6	114.6	K385 K386	K385-R388 HydrophobicContact CB-CB 4.17Å; K385-R388 WeakPolarHBondContact O-CA 3.47Å; K385-R388 VanDerWaalsContact O-CB 3.28Å; K385-R388 WeakPolarHBondContact O-CB 3.4Å; K385-R388 PolarHBondContact O-N 2.93Å; K386-R388 PolarHBondContact O-N 3.29Å; K386-R388 VanDerWaalsContact O-N 3.1Å
389	V	82.9	Confident	86.8	Confident	6 Å²	6	55.9 Å²	55.9	4%	0.036	26%	0.256	C	S	.	.			trans	-59.1	155	175.2	-66.9	0	0	0	0	111.7	L360 W381 K385 K386 L387 V394 R398	L360-V389 HydrophobicContact CB-CG2 4.2Å; L360-V389 HydrophobicContact CD1-CG2 4.4Å; L360-V389 WeakPolarHBondContact O-CG1 3.28Å; W381-V389 HydrophobicContact CZ3-CG2 4.31Å; K385-V389 HydrophobicContact CB-CG1 4.14Å; K386-V389 WeakPolarHBondContact O-CG1 3.49Å; K386-V389 WeakPolarHBondContact O-CG2 3.37Å; K386-V389 PolarHBondContact O-N 2.91Å; L387-V389 VanDerWaalsContact C-N 3.28Å; L387-V389 PolarHBondContact O-N 3.5Å; V389-V394 HydrophobicContact CG2-CG2 3.89Å; V389-V394 WeakPolarHBondContact O-CG2 3.22Å; V389-R398 PolarHBondContact O-NH2 2.89Å
390	K	80.9	Confident	86.5	Confident	205 Å²	205	57.2 Å²	57.2	89%	0.891	26%	0.263	S	S	*	.			trans	-102.8	119.3	171.4	-66.9	-173.6	179.4	-176.9	0	107.9
391	N	82.1	Confident	86.3	Confident	18 Å²	18	57.9 Å²	57.9	10%	0.096	27%	0.266	C	S	.	.			trans	-149.7	146.4	174.2	-178.1	-78	0	0	0	107.6	S366 Y370 H393 V394 F397	S366-N391 PolarHBondContact OG-ND2 3.07Å; Y370-N391 PolarHBondContact OH-OD1 2.71Å; N391-H393 PolarHBondContact O-N 3.2Å; N391-H393 VanDerWaalsContact O-N 3.13Å; N391-H393 PolarHBondContact OD1-N 3.35Å; N391-V394 HydrophobicContact CB-CB 4.09Å; N391-V394 VanDerWaalsContact O-CB 3.29Å; N391-V394 WeakPolarHBondContact O-CB 3.46Å; N391-V394 VanDerWaalsContact O-CG1 3.29Å; N391-V394 WeakPolarHBondContact O-CG1 3.44Å; N391-V394 PolarHBondContact O-N 3.21Å; N391-F397 WeakPolarHBondContact OD1-CE2 3.32Å
392	K	81.1	Confident	86.2	Confident	158 Å²	158	58.3 Å²	58.3	69%	0.687	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-35.5	179.9	179.5	-176.6	170.1	-158.7	0	113.2	E367	E367-K392 WeakPolarHBondContact OE1-CB 3.28Å; E367-K392 PolarHBondContact OE1-N 3.32Å
393	H	83.3	Confident	86.2	Confident	46 Å²	46	60.8 Å²	60.8	21%	0.213	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	18.8	-177.7	-59.9	-86.5	0	0	0	113	Y370 N391 E395 F396 F397	Y370-H393 HydrophobicContact CE2-CB 4.19Å; Y370-H393 AromaticContact CE2-CD2 3.42Å; Y370-H393 VanDerWaalsContact CE2-CD2 3.42Å; Y370-H393 WeakPolarHBondContact CE2-CD2 3.17Å; Y370-H393 AromaticContact CE2-CG 3.77Å; Y370-H393 AromaticContact CE2-NE2 3.98Å; Y370-H393 AromaticContact CZ-CD2 3.81Å; Y370-H393 PolarHBondContact OH-CD2 3.11Å; Y370-H393 VanDerWaalsContact OH-CD2 3.3Å; N391-H393 PolarHBondContact O-N 3.2Å; N391-H393 VanDerWaalsContact O-N 3.13Å; N391-H393 PolarHBondContact OD1-N 3.35Å; H393-E395 VanDerWaalsContact C-N 3.26Å; H393-E395 PolarHBondContact O-N 3.35Å; H393-F396 WeakPolarHBondContact O-CB 3.49Å; H393-F396 PolarHBondContact O-N 3.21Å; H393-F396 VanDerWaalsContact O-N 3.08Å; H393-F397 HydrophobicContact CB-CE2 4.09Å; H393-F397 HydrophobicContact CB-CZ 4.12Å; H393-F397 WeakPolarHBondContact O-CD2 3.49Å; H393-F397 PolarHBondContact O-N 3.41Å
394	V	82.4	Confident	86.5	Confident	14 Å²	14	61 Å²	61	9%	0.085	29%	0.285	C	S	.	.	H	α-helix	trans	-59	-33.4	-174.2	72.7	0	0	0	0	113.8	V389 N391 F396 F397 R398	V389-V394 HydrophobicContact CG2-CG2 3.89Å; V389-V394 WeakPolarHBondContact O-CG2 3.22Å; N391-V394 HydrophobicContact CB-CB 4.09Å; N391-V394 VanDerWaalsContact O-CB 3.29Å; N391-V394 WeakPolarHBondContact O-CB 3.46Å; N391-V394 VanDerWaalsContact O-CG1 3.29Å; N391-V394 WeakPolarHBondContact O-CG1 3.44Å; N391-V394 PolarHBondContact O-N 3.21Å; V394-F396 VanDerWaalsContact C-N 3.35Å; V394-F396 PolarHBondContact O-N 3.4Å; V394-F397 PolarHBondContact O-N 3.47Å; V394-R398 HydrophobicContact CG2-CG 4.2Å; V394-R398 WeakPolarHBondContact O-CB 3.43Å; V394-R398 VanDerWaalsContact O-CG 3.26Å; V394-R398 WeakPolarHBondContact O-CG 3.11Å; V394-R398 PolarHBondContact O-N 2.93Å
395	E	83.6	Confident	86.8	Confident	58 Å²	58	57 Å²	57	27%	0.271	26%	0.258	S	S	.	.	H	α-helix	trans	-64.4	-40.5	178.1	-66.3	-56.5	126.2	0	0	111.8	L83 A86 H393 R398 N399	L83-E395 WeakPolarHBondContact CD1-OE2 3.38Å; A86-E395 WeakPolarHBondContact CB-OE1 3.31Å; H393-E395 VanDerWaalsContact C-N 3.26Å; H393-E395 PolarHBondContact O-N 3.35Å; E395-R398 PolarHBondContact O-N 3.07Å; E395-R398 IonicContact OE1-CZ 3.84Å; E395-R398 IonicContact OE1-NH1 3.53Å; E395-R398 PolarHBondContact OE1-NH1 3.29Å; E395-N399 WeakPolarHBondContact O-CB 3.35Å; E395-N399 PolarHBondContact O-N 3.4Å; E395-N399 PolarHBondContact O-ND2 3.07Å
396	F	85.8	Confident	87.1	Confident	77 Å²	77	56.8 Å²	56.8	34%	0.338	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-48.2	174.2	174	-95.5	0	0	0	110.9	V373 L376 H393 V394 R398 N399 L400	V373-F396 HydrophobicContact CB-CD1 4.31Å; V373-F396 HydrophobicContact CB-CD2 4.32Å; V373-F396 HydrophobicContact CB-CE1 4.01Å; V373-F396 HydrophobicContact CB-CE2 4Å; V373-F396 HydrophobicContact CB-CG 4.46Å; V373-F396 HydrophobicContact CB-CZ 3.85Å; V373-F396 HydrophobicContact CG1-CB 4.41Å; V373-F396 HydrophobicContact CG1-CD1 3.83Å; V373-F396 HydrophobicContact CG1-CD2 3.92Å; V373-F396 HydrophobicContact CG1-CE1 4.06Å; V373-F396 HydrophobicContact CG1-CE2 4.12Å; V373-F396 HydrophobicContact CG1-CG 3.77Å; V373-F396 HydrophobicContact CG1-CZ 4.2Å; V373-F396 HydrophobicContact CG2-CE2 4.4Å; L376-F396 HydrophobicContact CD1-CD1 3.87Å; L376-F396 HydrophobicContact CD1-CE1 3.5Å; L376-F396 VanDerWaalsContact CD1-CE1 3.5Å; H393-F396 WeakPolarHBondContact O-CB 3.49Å; H393-F396 PolarHBondContact O-N 3.21Å; H393-F396 VanDerWaalsContact O-N 3.08Å; V394-F396 VanDerWaalsContact C-N 3.35Å; V394-F396 PolarHBondContact O-N 3.4Å; F396-R398 VanDerWaalsContact C-N 3.33Å; F396-R398 PolarHBondContact O-N 3.44Å; F396-N399 PolarHBondContact O-N 3.16Å; F396-L400 PolarHBondContact O-N 2.8Å
397	F	89.1	Confident	87.3	Confident	1 Å²	1	56.4 Å²	56.4	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-58.6	-45.5	177.9	-57.9	-39	0	0	0	111.8	V358 L360 Y370 L376 I379 W381 N391 H393 V394 L400 Y401	V358-F397 HydrophobicContact CG1-CZ 4.43Å; L360-F397 HydrophobicContact CD1-CB 4.29Å; L360-F397 HydrophobicContact CD1-CD2 3.72Å; L360-F397 HydrophobicContact CD1-CE2 4.31Å; L360-F397 HydrophobicContact CD1-CG 4.18Å; L360-F397 HydrophobicContact CD2-CD2 3.91Å; L360-F397 HydrophobicContact CD2-CE2 3.64Å; L360-F397 HydrophobicContact CD2-CZ 4.41Å; L360-F397 HydrophobicContact CG-CD2 4.49Å; Y370-F397 AromaticContact CE1-CZ 3.93Å; Y370-F397 HydrophobicContact CE1-CZ 3.93Å; Y370-F397 HydrophobicContact CE2-CZ 4.33Å; Y370-F397 AromaticContact CZ-CZ 3.62Å; Y370-F397 VanDerWaalsContact OH-CZ 3.3Å; Y370-F397 WeakPolarHBondContact OH-CZ 3.3Å; L376-F397 HydrophobicContact CD1-CD1 4.26Å; L376-F397 HydrophobicContact CD1-CE1 3.47Å; L376-F397 VanDerWaalsContact CD1-CE1 3.47Å; L376-F397 HydrophobicContact CD1-CZ 4.35Å; L376-F397 HydrophobicContact CD2-CE1 3.91Å; L376-F397 HydrophobicContact CD2-CZ 4.27Å; L376-F397 HydrophobicContact CG-CE1 4.33Å; I379-F397 HydrophobicContact CD1-CD1 4.48Å; I379-F397 HydrophobicContact CG1-CD1 3.79Å; I379-F397 HydrophobicContact CG1-CE1 3.94Å; I379-F397 HydrophobicContact CG2-CD1 4.39Å; I379-F397 HydrophobicContact CG2-CG 4.43Å; W381-F397 VanDerWaalsContact CH2-C 3.48Å; W381-F397 HydrophobicContact CH2-CB 3.43Å; W381-F397 VanDerWaalsContact CH2-CB 3.43Å; W381-F397 HydrophobicContact CZ2-CB 3.78Å; W381-F397 VanDerWaalsContact CZ2-O 3.28Å; W381-F397 WeakPolarHBondContact CZ2-O 3.46Å; W381-F397 HydrophobicContact CZ3-CB 4.34Å; N391-F397 WeakPolarHBondContact OD1-CE2 3.32Å; H393-F397 HydrophobicContact CB-CE2 4.09Å; H393-F397 HydrophobicContact CB-CZ 4.12Å; H393-F397 WeakPolarHBondContact O-CD2 3.49Å; H393-F397 PolarHBondContact O-N 3.41Å; V394-F397 PolarHBondContact O-N 3.47Å; F397-L400 PolarHBondContact O-N 2.73Å; F397-Y401 PolarHBondContact O-N 2.7Å
398	R	89.7	Confident	87.6	Confident	44 Å²	44	59.4 Å²	59.4	17%	0.166	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-45	178.5	-75.2	171.3	178.8	153.7	6.9	111.5	L83 W381 L387 V389 V394 E395 F396 L400 Y401 L402	L83-R398 HydrophobicContact CD1-CB 3.86Å; W381-R398 HydrophobicContact CH2-CG 4.27Å; L387-R398 HydrophobicContact CD2-CG 4.47Å; L387-R398 PolarHBondContact O-NE 3.45Å; L387-R398 PolarHBondContact O-NH2 3.5Å; V389-R398 PolarHBondContact O-NH2 2.89Å; V394-R398 HydrophobicContact CG2-CG 4.2Å; V394-R398 WeakPolarHBondContact O-CB 3.43Å; V394-R398 VanDerWaalsContact O-CG 3.26Å; V394-R398 WeakPolarHBondContact O-CG 3.11Å; V394-R398 PolarHBondContact O-N 2.93Å; E395-R398 PolarHBondContact O-N 3.07Å; E395-R398 IonicContact OE1-CZ 3.84Å; E395-R398 IonicContact OE1-NH1 3.53Å; E395-R398 PolarHBondContact OE1-NH1 3.29Å; F396-R398 VanDerWaalsContact C-N 3.33Å; F396-R398 PolarHBondContact O-N 3.44Å; R398-L400 VanDerWaalsContact C-N 3.29Å; R398-L400 PolarHBondContact O-N 2.72Å; R398-Y401 PolarHBondContact O-N 3.31Å; R398-L402 WeakPolarHBondContact O-CB 3.49Å; R398-L402 VanDerWaalsContact O-CG 3.28Å; R398-L402 WeakPolarHBondContact O-CG 3.5Å; R398-L402 PolarHBondContact O-N 3.35Å
399	N	89.2	Confident	87.7	Confident	58 Å²	58	51 Å²	51	31%	0.31	24%	0.242	S	C	.	.	H	α-helix	trans	-60.1	-42	177.8	-73	-16.4	0	0	0	111.2	L83 Q87 E395 F396 L402 T403	L83-N399 WeakPolarHBondContact CD1-OD1 3.42Å; L83-N399 WeakPolarHBondContact CD2-OD1 3.46Å; Q87-N399 PolarHBondContact NE2-OD1 3.24Å; E395-N399 WeakPolarHBondContact O-CB 3.35Å; E395-N399 PolarHBondContact O-N 3.4Å; E395-N399 PolarHBondContact O-ND2 3.07Å; F396-N399 PolarHBondContact O-N 3.16Å; N399-L402 PolarHBondContact O-N 3.04Å; N399-T403 WeakPolarHBondContact O-CB 3.37Å; N399-T403 PolarHBondContact O-N 3.49Å; N399-T403 PolarHBondContact O-OG1 3.09Å
400	L	90.8	Very high	87.8	Confident	28 Å²	28	54.3 Å²	54.3	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-48.2	176.5	-173.2	68.9	0	0	0	111.7	T246 A248 I379 F396 F397 R398 L402 T403 F404	T246-L400 HydrophobicContact CG2-CD2 4Å; T246-L400 HydrophobicContact CG2-CG 4.07Å; A248-L400 HydrophobicContact CB-CD2 3.98Å; I379-L400 HydrophobicContact CD1-CD2 3.72Å; F396-L400 PolarHBondContact O-N 2.8Å; F397-L400 PolarHBondContact O-N 2.73Å; R398-L400 VanDerWaalsContact C-N 3.29Å; R398-L400 PolarHBondContact O-N 2.72Å; L400-L402 VanDerWaalsContact C-N 3.35Å; L400-L402 PolarHBondContact O-N 3.46Å; L400-T403 WeakPolarHBondContact O-CB 3.5Å; L400-T403 PolarHBondContact O-N 3.37Å; L400-F404 HydrophobicContact CD1-CD2 4.34Å; L400-F404 HydrophobicContact CD1-CE2 3.6Å; L400-F404 HydrophobicContact CD1-CZ 4.3Å; L400-F404 HydrophobicContact CG-CD2 4.29Å; L400-F404 HydrophobicContact CG-CE2 3.91Å; L400-F404 VanDerWaalsContact O-CD2 3.29Å; L400-F404 WeakPolarHBondContact O-CD2 3.32Å; L400-F404 PolarHBondContact O-N 3.4Å
401	Y	92.4	Very high	88.1	Confident	17 Å²	17	49.6 Å²	49.6	7%	0.067	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-46.7	176.5	177.4	-86.1	0	0	0	111.6	D152 T155 W381 L387 F397 R398 T403 F404 L405	D152-Y401 PolarHBondContact OD1-OH 3.44Å; T155-Y401 HydrophobicContact CG2-CD2 3.87Å; T155-Y401 HydrophobicContact CG2-CE2 3.76Å; T155-Y401 HydrophobicContact CG2-CG 4.37Å; W381-Y401 HydrophobicContact CZ2-CG 4.37Å; W381-Y401 AromaticContact NE1-CD2 3.64Å; L387-Y401 HydrophobicContact CD1-CD1 3.79Å; L387-Y401 HydrophobicContact CD1-CE1 3.76Å; L387-Y401 HydrophobicContact CD2-CD1 3.7Å; L387-Y401 HydrophobicContact CD2-CD2 4.31Å; L387-Y401 HydrophobicContact CD2-CE1 4.18Å; L387-Y401 HydrophobicContact CD2-CG 3.77Å; L387-Y401 HydrophobicContact CG-CD1 4.31Å; L387-Y401 HydrophobicContact CG-CE1 4.38Å; F397-Y401 PolarHBondContact O-N 2.7Å; R398-Y401 PolarHBondContact O-N 3.31Å; Y401-T403 VanDerWaalsContact C-N 3.3Å; Y401-T403 PolarHBondContact O-N 2.91Å; Y401-F404 PolarHBondContact O-N 2.95Å; Y401-L405 HydrophobicContact CD1-CB 4.5Å; Y401-L405 HydrophobicContact CE1-CB 4.31Å; Y401-L405 HydrophobicContact CE1-CD1 4.37Å; Y401-L405 HydrophobicContact CE1-CD2 4.16Å; Y401-L405 WeakPolarHBondContact O-CB 3.49Å; Y401-L405 PolarHBondContact O-N 2.71Å
402	L	92	Very high	88.3	Confident	12 Å²	12	49.2 Å²	49.2	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-33.7	-179.6	-72	169.8	0	0	0	112.3	L79 L83 R398 N399 L400 F404 L405 E406	L79-L402 HydrophobicContact CB-CD2 4.16Å; L83-L402 HydrophobicContact CB-CD1 3.96Å; L83-L402 HydrophobicContact CD1-CD1 4.22Å; L83-L402 HydrophobicContact CD2-CD1 3.35Å; L83-L402 HydrophobicContact CG-CD1 4.02Å; R398-L402 WeakPolarHBondContact O-CB 3.49Å; R398-L402 VanDerWaalsContact O-CG 3.28Å; R398-L402 WeakPolarHBondContact O-CG 3.5Å; R398-L402 PolarHBondContact O-N 3.35Å; N399-L402 PolarHBondContact O-N 3.04Å; L400-L402 VanDerWaalsContact C-N 3.35Å; L400-L402 PolarHBondContact O-N 3.46Å; L402-F404 VanDerWaalsContact C-N 3.31Å; L402-F404 PolarHBondContact O-N 3.32Å; L402-L405 HydrophobicContact CD2-CD2 3.74Å; L402-L405 PolarHBondContact O-N 3.3Å; L402-E406 WeakPolarHBondContact O-CB 3.41Å; L402-E406 VanDerWaalsContact O-CG 3.31Å; L402-E406 WeakPolarHBondContact O-CG 3.46Å; L402-E406 PolarHBondContact O-N 3.45Å
403	T	92.6	Very high	88.5	Confident	79 Å²	79	46.6 Å²	46.6	49%	0.485	23%	0.227	S	C	.	.	H	α-helix	trans	-55.7	-48.9	172.4	-60.6	0	0	0	0	110.3	N399 L400 Y401 E406 Y407	N399-T403 WeakPolarHBondContact O-CB 3.37Å; N399-T403 PolarHBondContact O-N 3.49Å; N399-T403 PolarHBondContact O-OG1 3.09Å; L400-T403 WeakPolarHBondContact O-CB 3.5Å; L400-T403 PolarHBondContact O-N 3.37Å; Y401-T403 VanDerWaalsContact C-N 3.3Å; Y401-T403 PolarHBondContact O-N 2.91Å; T403-E406 PolarHBondContact O-N 2.89Å; T403-Y407 WeakPolarHBondContact O-CB 3.42Å; T403-Y407 PolarHBondContact O-N 2.87Å
404	F	94.3	Very high	88.5	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-77.6	-30.8	-179.7	-64.7	-57.6	0	0	0	113.8	T155 K158 S159 F162 H163 T246 L400 Y401 L402 E406 Y407	T155-F404 HydrophobicContact CG2-CB 3.87Å; K158-F404 HydrophobicContact CB-CB 4.31Å; K158-F404 HydrophobicContact CB-CD1 4.39Å; K158-F404 WeakPolarHBondContact CD-O 3.35Å; K158-F404 PolarHBondContact NZ-O 3.37Å; S159-F404 VanDerWaalsContact CB-CE2 3.49Å; F162-F404 HydrophobicContact CB-CD1 4.46Å; F162-F404 HydrophobicContact CB-CE1 3.59Å; F162-F404 HydrophobicContact CB-CZ 4.26Å; F162-F404 AromaticContact CD1-CE1 3.88Å; F162-F404 HydrophobicContact CD1-CE1 3.88Å; F162-F404 AromaticContact CD1-CZ 3.98Å; F162-F404 HydrophobicContact CD1-CZ 3.98Å; F162-F404 HydrophobicContact CD2-CE1 4.23Å; F162-F404 AromaticContact CG-CE1 3.64Å; F162-F404 HydrophobicContact CG-CE1 3.64Å; F162-F404 HydrophobicContact CG-CZ 4.21Å; H163-F404 AromaticContact NE2-CZ 3.87Å; T246-F404 HydrophobicContact CG2-CD2 3.81Å; T246-F404 HydrophobicContact CG2-CE2 4.15Å; L400-F404 HydrophobicContact CD1-CD2 4.34Å; L400-F404 HydrophobicContact CD1-CE2 3.6Å; L400-F404 HydrophobicContact CD1-CZ 4.3Å; L400-F404 HydrophobicContact CG-CD2 4.29Å; L400-F404 HydrophobicContact CG-CE2 3.91Å; L400-F404 VanDerWaalsContact O-CD2 3.29Å; L400-F404 WeakPolarHBondContact O-CD2 3.32Å; L400-F404 PolarHBondContact O-N 3.4Å; Y401-F404 PolarHBondContact O-N 2.95Å; L402-F404 VanDerWaalsContact C-N 3.31Å; L402-F404 PolarHBondContact O-N 3.32Å; F404-E406 PolarHBondContact O-N 3.31Å; F404-Y407 PolarHBondContact O-N 3.26Å
405	L	92.6	Very high	88.4	Confident	21 Å²	21	58.9 Å²	58.9	11%	0.11	28%	0.275	C	S	.	.	H	α-helix	trans	-56.5	-44.8	171.6	-175.4	69.8	0	0	0	110.1	N76 L79 K158 Y401 L402	N76-L405 WeakPolarHBondContact OD1-CD2 3.37Å; L79-L405 HydrophobicContact CD1-CD2 4.14Å; K158-L405 PolarHBondContact NZ-O 2.92Å; Y401-L405 HydrophobicContact CD1-CB 4.5Å; Y401-L405 HydrophobicContact CE1-CB 4.31Å; Y401-L405 HydrophobicContact CE1-CD1 4.37Å; Y401-L405 HydrophobicContact CE1-CD2 4.16Å; Y401-L405 WeakPolarHBondContact O-CB 3.49Å; Y401-L405 PolarHBondContact O-N 2.71Å; L402-L405 HydrophobicContact CD2-CD2 3.74Å; L402-L405 PolarHBondContact O-N 3.3Å
406	E	90.9	Very high	88.2	Confident	94 Å²	94	60.8 Å²	60.8	44%	0.439	29%	0.286	S	S	.	.	H	α-helix	trans	-87.8	-14.4	-176.5	-62.8	-172.8	-164	0	0	114.5	R80 L402 T403 F404 D408	R80-E406 WeakPolarHBondContact CG-OE1 3.44Å; R80-E406 IonicContact CZ-OE1 2.63Å; R80-E406 IonicContact CZ-OE2 3.43Å; R80-E406 VanDerWaalsContact NE-CD 3.34Å; R80-E406 IonicContact NE-OE1 3.08Å; R80-E406 PolarHBondContact NE-OE1 2.9Å; R80-E406 IonicContact NE-OE2 2.71Å; R80-E406 IonicContact NH2-OE1 2.58Å; R80-E406 PolarHBondContact NH2-OE1 3.28Å; R80-E406 IonicContact NH2-OE2 3.31Å; R80-E406 PolarHBondContact NH2-OE2 3.5Å; L402-E406 WeakPolarHBondContact O-CB 3.41Å; L402-E406 VanDerWaalsContact O-CG 3.31Å; L402-E406 WeakPolarHBondContact O-CG 3.46Å; L402-E406 PolarHBondContact O-N 3.45Å; T403-E406 PolarHBondContact O-N 2.89Å; F404-E406 PolarHBondContact O-N 3.31Å; E406-D408 PolarHBondContact O-N 3.02Å
407	Y	91.1	Very high	88.1	Confident	49 Å²	49	58.2 Å²	58.2	19%	0.192	28%	0.275	C	S	.	.			trans	-58.4	126.9	-176.9	-167.7	-87.3	0	0	0	111.2	K158 F162 T403 F404 G409 L411 L412	K158-Y407 WeakPolarHBondContact CE-O 3.37Å; K158-Y407 PolarHBondContact NZ-O 3.43Å; F162-Y407 HydrophobicContact CD2-CD2 4.43Å; F162-Y407 AromaticContact CD2-CE2 3.66Å; F162-Y407 HydrophobicContact CD2-CE2 3.66Å; F162-Y407 AromaticContact CD2-CZ 3.85Å; F162-Y407 AromaticContact CE2-CE2 3.85Å; F162-Y407 HydrophobicContact CE2-CE2 3.85Å; T403-Y407 WeakPolarHBondContact O-CB 3.42Å; T403-Y407 PolarHBondContact O-N 2.87Å; F404-Y407 PolarHBondContact O-N 3.26Å; Y407-G409 PolarHBondContact O-N 3.21Å; Y407-L411 HydrophobicContact CE1-CB 3.96Å; Y407-L411 HydrophobicContact CE1-CD1 4.46Å; Y407-L412 HydrophobicContact CD1-CD2 4.33Å; Y407-L412 HydrophobicContact CD1-CG 4.38Å; Y407-L412 HydrophobicContact CE1-CD1 4.43Å; Y407-L412 HydrophobicContact CE1-CD2 3.51Å; Y407-L412 HydrophobicContact CE1-CG 3.77Å
408	D	89.2	Confident	87.6	Confident	80 Å²	80	60.1 Å²	60.1	43%	0.428	30%	0.295	S	S	.	.			trans	-72.4	115.4	177.5	-177.2	-2.8	0	0	0	109.9	E406 N410 L411	E406-D408 PolarHBondContact O-N 3.02Å; D408-N410 PolarHBondContact O-N 3.06Å; D408-N410 VanDerWaalsContact O-N 3.17Å; D408-N410 WeakPolarHBondContact OD1-CB 3.47Å; D408-N410 PolarHBondContact OD1-N 3.32Å; D408-N410 PolarHBondContact OD1-ND2 3.42Å; D408-L411 HydrophobicContact CB-CD1 4.14Å; D408-L411 HydrophobicContact CB-CG 4.12Å; D408-L411 WeakPolarHBondContact O-CB 3.4Å; D408-L411 PolarHBondContact O-N 3.05Å; D408-L411 VanDerWaalsContact O-N 3.08Å
409	G	84.8	Confident	87.3	Confident	3 Å²	3	59.6 Å²	59.6	3%	0.031	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-60.8	-23.3	179.6	0	0	0	0	0	113.5	Y407 L411 L412	Y407-G409 PolarHBondContact O-N 3.21Å; G409-L411 PolarHBondContact O-N 3.38Å; G409-L412 VanDerWaalsContact O-CB 3.27Å; G409-L412 WeakPolarHBondContact O-CB 3.43Å; G409-L412 PolarHBondContact O-N 2.9Å
410	N	85.8	Confident	86.6	Confident	74 Å²	74	61.6 Å²	61.6	40%	0.396	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-62.7	-27.2	175.8	-66.1	-51.8	0	0	0	112.6	D408 L412 R413	D408-N410 PolarHBondContact O-N 3.06Å; D408-N410 VanDerWaalsContact O-N 3.17Å; D408-N410 WeakPolarHBondContact OD1-CB 3.47Å; D408-N410 PolarHBondContact OD1-N 3.32Å; D408-N410 PolarHBondContact OD1-ND2 3.42Å; N410-L412 PolarHBondContact O-N 3.33Å; N410-R413 WeakPolarHBondContact O-CB 3.49Å; N410-R413 PolarHBondContact O-N 3.01Å; N410-R413 VanDerWaalsContact OD1-CZ 3.22Å; N410-R413 PolarHBondContact OD1-NH2 3.45Å
411	L	87.5	Confident	85.3	Confident	107 Å²	107	62.7 Å²	62.7	56%	0.56	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-67.8	-18.4	176.8	-58.3	176.1	0	0	0	112.2	Y407 D408 G409 R413	Y407-L411 HydrophobicContact CE1-CB 3.96Å; Y407-L411 HydrophobicContact CE1-CD1 4.46Å; D408-L411 HydrophobicContact CB-CD1 4.14Å; D408-L411 HydrophobicContact CB-CG 4.12Å; D408-L411 WeakPolarHBondContact O-CB 3.4Å; D408-L411 PolarHBondContact O-N 3.05Å; D408-L411 VanDerWaalsContact O-N 3.08Å; G409-L411 PolarHBondContact O-N 3.38Å; L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 3.03Å
412	L	85.9	Confident	83.5	Confident	10 Å²	10	67.8 Å²	67.8	5%	0.052	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-79.5	-10.8	179	-56.2	172.4	0	0	0	113.1	K158 L161 W189 V191 Y407 G409 N410 R414	K158-L412 HydrophobicContact CG-CD1 4.31Å; L161-L412 HydrophobicContact CB-CD1 4Å; L161-L412 HydrophobicContact CB-CD2 4.04Å; L161-L412 HydrophobicContact CD1-CD1 3.8Å; L161-L412 HydrophobicContact CG-CD1 4.47Å; W189-L412 HydrophobicContact CE3-CD1 4.19Å; W189-L412 HydrophobicContact CZ3-CD1 4.14Å; V191-L412 HydrophobicContact CG1-CB 4.4Å; V191-L412 WeakPolarHBondContact CG1-O 3.45Å; V191-L412 HydrophobicContact CG2-CB 4.04Å; Y407-L412 HydrophobicContact CD1-CD2 4.33Å; Y407-L412 HydrophobicContact CD1-CG 4.38Å; Y407-L412 HydrophobicContact CE1-CD1 4.43Å; Y407-L412 HydrophobicContact CE1-CD2 3.51Å; Y407-L412 HydrophobicContact CE1-CG 3.77Å; G409-L412 VanDerWaalsContact O-CB 3.27Å; G409-L412 WeakPolarHBondContact O-CB 3.43Å; G409-L412 PolarHBondContact O-N 2.9Å; N410-L412 PolarHBondContact O-N 3.33Å; L412-R414 PolarHBondContact O-N 3.33Å
413	R	85.9	Confident	81.6	Confident	103 Å²	103	70.4 Å²	70.4	39%	0.389	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-65.8	-20.7	179.5	-77.1	178.2	-175.4	163	8	114	T188 W189 P192 N410 L411 E415	T188-R413 PolarHBondContact O-NH2 3.05Å; W189-R413 WeakPolarHBondContact O-CD 3.09Å; W189-R413 WeakPolarHBondContact O-CG 3.39Å; W189-R413 PolarHBondContact O-NE 2.81Å; P192-R413 VanDerWaalsContact CD-O 3.26Å; P192-R413 WeakPolarHBondContact CD-O 3.35Å; P192-R413 VanDerWaalsContact CG-O 3.29Å; P192-R413 WeakPolarHBondContact CG-O 3.37Å; N410-R413 WeakPolarHBondContact O-CB 3.49Å; N410-R413 PolarHBondContact O-N 3.01Å; N410-R413 VanDerWaalsContact OD1-CZ 3.22Å; N410-R413 PolarHBondContact OD1-NH2 3.45Å; L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 3.03Å; R413-E415 PolarHBondContact O-N 3.23Å
414	R	83.3	Confident	79.5	Confident	194 Å²	194	70.6 Å²	70.6	73%	0.732	37%	0.37	S	S	*	.	S	Bend	trans	-64.7	127.5	179.7	-176.5	176.7	174.4	177.1	-0.8	109.2	L412 L416	L412-R414 PolarHBondContact O-N 3.33Å; R414-L416 PolarHBondContact O-N 3.09Å
415	E	79.3	Confident	77.3	Confident	123 Å²	123	74 Å²	74	58%	0.575	39%	0.391	S	S	*	.			trans	-65.3	121.1	170.1	-168.5	175.9	-177.1	0	0	109.3	P192 R413 G418	P192-E415 HydrophobicContact CB-CG 4.47Å; P192-E415 HydrophobicContact CG-CB 4.36Å; R413-E415 PolarHBondContact O-N 3.23Å; E415-G418 WeakPolarHBondContact OE1-CA 3.26Å
416	L	80.6	Confident	75	Confident	98 Å²	98	78.8 Å²	78.8	51%	0.513	42%	0.417	S	S	.	.			trans	-96.6	-24.8	-176.8	-61	179.5	0	0	0	112.1	R414	R414-L416 PolarHBondContact O-N 3.09Å
417	F	82.5	Confident	72.9	Confident	24 Å²	24	78.3 Å²	78.3	11%	0.105	42%	0.424	C	S	.	.	S	Bend	trans	-154.1	136.9	-179.3	50.4	-90.7	0	0	0	108.6	R164 R165 N166 P167 A193	R164-F417 HydrophobicContact CG-CE1 4.13Å; R165-F417 VanDerWaalsContact C-CE1 3.44Å; R165-F417 WeakPolarHBondContact O-CD1 3.41Å; N166-F417 VanDerWaalsContact O-CZ 3.24Å; N166-F417 WeakPolarHBondContact O-CZ 3.46Å; P167-F417 HydrophobicContact CG-CE2 3.98Å; A193-F417 HydrophobicContact CB-CE2 3.98Å; A193-F417 HydrophobicContact CB-CZ 4.3Å
418	G	78.9	Confident	70.7	Confident	41 Å²	41	84.1 Å²	84.1	42%	0.423	45%	0.453	S	S	.	.			trans	-85.6	129.9	172.8	0	0	0	0	0	111.3	K134 E415	K134-G418 PolarHBondContact NZ-O 2.96Å; E415-G418 WeakPolarHBondContact OE1-CA 3.26Å
419	C	84.1	Confident	68.3	Low	33 Å²	33	86 Å²	86	22%	0.223	46%	0.463	C	S	.	.			trans	-130.1	139	168.7	-75.8	0	0	0	0	108.8	C135 P167 S421	C135-C419 WeakPolarHBondContact CA-SG 3.41Å; C135-C419 HydrophobicContact CB-CB 3.78Å; C135-C419 WeakPolarHBondContact CB-SG 3.25Å; C135-C419 WeakPolarHBondContact SG-CA 3.44Å; C135-C419 WeakPolarHBondContact SG-CB 3.41Å; C135-C419 CovalentContact SG-SG 2.05Å; C135-C419 PolarHBondContact SG-SG 2.91Å; P167-C419 HydrophobicContact CG-CB 4.47Å; C419-S421 PolarHBondContact O-N 2.98Å
420	P	75.1	Confident	65.9	Low	100 Å²	100	89.4 Å²	89.4	65%	0.649	49%	0.49	S	S	*	.			trans	-59.4	130.8	179.2	20.7	-27.3	0	0	0	109.5
421	S	63.3	Low	63.6	Low	50 Å²	50	91.5 Å²	91.5	35%	0.35	51%	0.508	S	S	.	.			trans	-76.1	156.4	178.1	72.1	0	0	0	0	110.3	C419 A423 D424 V425	C419-S421 PolarHBondContact O-N 2.98Å; S421-A423 PolarHBondContact O-N 2.91Å; S421-A423 VanDerWaalsContact O-N 3.09Å; S421-A423 PolarHBondContact OG-N 3.32Å; S421-D424 WeakPolarHBondContact CB-OD2 3.45Å; S421-D424 PolarHBondContact N-OD2 3.29Å; S421-D424 PolarHBondContact O-N 3.31Å; S421-D424 PolarHBondContact OG-N 3.47Å; S421-D424 PolarHBondContact OG-OD2 3.24Å; S421-V425 PolarHBondContact O-N 3.1Å
422	E	55	Low	61.5	Low	124 Å²	124	94.2 Å²	94.2	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-58.1	-20.9	170.6	-77.8	172.4	-159.5	0	0	112.3	R195 N426	R195-E422 IonicContact CZ-OE1 3.68Å; R195-E422 VanDerWaalsContact CZ-OE1 3.27Å; R195-E422 IonicContact NH1-OE1 3.28Å; R195-E422 PolarHBondContact NH1-OE1 3.47Å; R195-E422 IonicContact NH2-OE1 3.46Å; R195-E422 PolarHBondContact NH2-OE1 3Å; R195-E422 IonicContact NH2-OE2 2.59Å; R195-E422 PolarHBondContact NH2-OE2 3.07Å; E422-N426 PolarHBondContact O-ND2 3.12Å
423	A	50.8	Low	58.9	Low	68 Å²	68	98 Å²	98	56%	0.562	56%	0.556	S	S	*	*	H	α-helix	trans	-76	-32.4	173.4	0	0	0	0	0	112.7	S421 N426 S427	S421-A423 PolarHBondContact O-N 2.91Å; S421-A423 VanDerWaalsContact O-N 3.09Å; S421-A423 PolarHBondContact OG-N 3.32Å; A423-N426 PolarHBondContact O-N 3.04Å; A423-S427 PolarHBondContact O-N 3.5Å; A423-S427 PolarHBondContact O-OG 2.95Å
424	D	48.5	Very low	56.8	Low	83 Å²	83	96.9 Å²	96.9	44%	0.444	58%	0.576	S	S	.	*	H	α-helix	trans	-73.2	-30.6	178.9	-60	-45.1	0	0	0	112.1	S421 N426 S427	S421-D424 WeakPolarHBondContact CB-OD2 3.45Å; S421-D424 PolarHBondContact N-OD2 3.29Å; S421-D424 PolarHBondContact O-N 3.31Å; S421-D424 PolarHBondContact OG-N 3.47Å; S421-D424 PolarHBondContact OG-OD2 3.24Å; D424-N426 VanDerWaalsContact C-N 3.33Å; D424-S427 PolarHBondContact O-OG 3.21Å
425	V	49.2	Very low	54.2	Low	74 Å²	74	90.8 Å²	90.8	45%	0.448	57%	0.573	S	S	.	*	H	α-helix	trans	-74.3	-26.6	177.2	-175.6	0	0	0	0	111.9	S421 N429	S421-V425 PolarHBondContact O-N 3.1Å; V425-N429 PolarHBondContact O-ND2 3.11Å
426	N	44.2	Very low	52.2	Low	123 Å²	123	94.2 Å²	94.2	66%	0.658	59%	0.589	S	S	*	*	H	α-helix	trans	-83.7	-19.5	178	-77.5	-30.2	0	0	0	113.4	E422 A423 D424	E422-N426 PolarHBondContact O-ND2 3.12Å; A423-N426 PolarHBondContact O-N 3.04Å; D424-N426 VanDerWaalsContact C-N 3.33Å
427	S	45.3	Very low	49.9	Very low	84 Å²	84	97.7 Å²	97.7	59%	0.587	61%	0.608	S	S	*	*	H	α-helix	trans	-82.3	-23	174.1	52.1	0	0	0	0	113.1	A423 D424	A423-S427 PolarHBondContact O-N 3.5Å; A423-S427 PolarHBondContact O-OG 2.95Å; D424-S427 PolarHBondContact O-OG 3.21Å
428	E	44.9	Very low	47.4	Very low	171 Å²	171	105.2 Å²	105.2	80%	0.799	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-12.1	174.7	-71	-171.5	151	0	0	114.3
429	N	39.9	Very low	45.1	Very low	120 Å²	120	108 Å²	108	64%	0.642	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	13.7	-177.7	-74.2	-54.6	0	0	0	114.7	V425 P431	V425-N429 PolarHBondContact O-ND2 3.11Å; N429-P431 WeakPolarHBondContact O-CD 3.42Å
430	A	34.1	Very low	42.6	Very low	74 Å²	74	114.7 Å²	114.7	61%	0.612	69%	0.694	S	S	*	*			trans	-72	119.8	171.3	0	0	0	0	0	109.6	D432	A430-D432 PolarHBondContact O-N 3.27Å
431	P	38.3	Very low	40.4	Very low	117 Å²	117	114.1 Å²	114.1	76%	0.76	71%	0.706	S	S	*	*			trans	-66	132.1	174.4	27.6	-31.6	0	0	0	108.9	N429 A433	N429-P431 WeakPolarHBondContact O-CD 3.42Å; P431-A433 VanDerWaalsContact C-N 3.26Å; P431-A433 PolarHBondContact O-N 2.81Å
432	D	42.1	Very low	38.8	Very low	164 Å²	164	115.2 Å²	115.2	88%	0.877	73%	0.725	S	S	*	*			trans	-62.1	87.6	173.2	-162.2	13.4	0	0	0	109.1	A430 G434	A430-D432 PolarHBondContact O-N 3.27Å; D432-G434 VanDerWaalsContact C-N 3.33Å; D432-G434 PolarHBondContact O-N 3.49Å
433	A	32.8	Very low	37.8	Very low	91 Å²	91	114.2 Å²	114.2	75%	0.752	74%	0.738	S	S	*	*			trans	-78.6	88.9	174.8	0	0	0	0	0	108	P431 G435	P431-A433 VanDerWaalsContact C-N 3.26Å; P431-A433 PolarHBondContact O-N 2.81Å; A433-G435 PolarHBondContact O-N 3.08Å
434	G	40.8	Very low	37	Very low	79 Å²	79	120.2 Å²	120.2	81%	0.814	76%	0.755	S	S	*	*			trans	-50.7	110	164.9	0	0	0	0	0	110.7	D432	D432-G434 VanDerWaalsContact C-N 3.33Å; D432-G434 PolarHBondContact O-N 3.49Å
435	G	29.6	Very low	36.4	Very low	65 Å²	65	125 Å²	125	67%	0.67	77%	0.774	S	S	*	*			trans	-122	97.4	175.8	0	0	0	0	0	110	A433 L437	A433-G435 PolarHBondContact O-N 3.08Å; G435-L437 PolarHBondContact O-N 3.18Å
436	H	36.4	Very low	35.7	Very low	195 Å²	195	127.7 Å²	127.7	90%	0.903	79%	0.793	S	S	*	*			trans	-48.8	117.4	168.4	-134	55.7	0	0	0	110.4
437	L	31.3	Very low	35.3	Very low	172 Å²	172	125 Å²	125	90%	0.901	79%	0.794	S	S	*	*			trans	-134.5	120.5	164	-111.4	130.3	0	0	0	110.2	G435	G435-L437 PolarHBondContact O-N 3.18Å
438	Q	31.1	Very low	35	Very low	182 Å²	182	127.3 Å²	127.3	85%	0.85	81%	0.808	S	S	*	*			trans	-57.9	144.4	-174.7	-77.6	164.7	-27.7	0	0	112.8	L440	Q438-L440 PolarHBondContact O-N 3.07Å
439	A	30.8	Very low	34.7	Very low	98 Å²	98	126.9 Å²	126.9	81%	0.81	81%	0.81	S	S	*	*			trans	-57.8	126	169.8	0	0	0	0	0	112
440	L	30.6	Very low	34.5	Very low	175 Å²	175	127.1 Å²	127.1	92%	0.916	82%	0.818	S	S	*	*			trans	-129.2	117.3	147.8	-82	169.1	0	0	0	107.4	Q438	Q438-L440 PolarHBondContact O-N 3.07Å
441	G	30.3	Very low	34.7	Very low	87 Å²	87	130 Å²	130	90%	0.897	83%	0.828	S	S	*	*			trans	-70.5	140.6	-175.4	0	0	0	0	0	112.9
442	G	28.2	Very low	34.5	Very low	73 Å²	73	136.1 Å²	136.1	75%	0.753	84%	0.835	S	S	*	*			trans	-158.9	100.9	167.2	0	0	0	0	0	108.3	H444	G442-H444 PolarHBondContact O-N 3.34Å
443	A	35.4	Very low	34.2	Very low	103 Å²	103	139.8 Å²	139.8	85%	0.851	84%	0.837	S	S	*	*			trans	-66.4	124.9	179.3	0	0	0	0	0	110.7
444	H	32.8	Very low	34.4	Very low	195 Å²	195	147.4 Å²	147.4	90%	0.903	85%	0.846	S	S	*	*			trans	-138.3	122.1	161.5	-103.9	-53.4	0	0	0	110.6	G442	G442-H444 PolarHBondContact O-N 3.34Å
445	Q	35.6	Very low	34.3	Very low	183 Å²	183	146.8 Å²	146.8	86%	0.855	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-65.5	148.7	177.2	-66.7	-178.3	-9.1	0	0	112
446	P	35.2	Very low	34.7	Very low	130 Å²	130	149.9 Å²	149.9	84%	0.844	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-80.5	125.2	171.1	30.8	-29.4	0	0	0	111.1
447	G	35.9	Very low	34.7	Very low	66 Å²	66	145.4 Å²	145.4	68%	0.68	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-73.1	162.8	169.9	0	0	0	0	0	112.8
448	P	38.8	Very low	35.2	Very low	134 Å²	134	143.6 Å²	143.6	87%	0.87	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-77.4	145.9	-169.9	30	-32.7	0	0	0	113.6
449	L	39	Very low	35.7	Very low	162 Å²	162	140 Å²	140	85%	0.848	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-59.6	143.6	173.6	-71	158	0	0	0	112.2
450	P	36.2	Very low	36.2	Very low	125 Å²	125	141.4 Å²	141.4	81%	0.812	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-78.3	133.3	178	29.8	-31	0	0	0	112.5
451	V	38.3	Very low	36.4	Very low	134 Å²	134	141.3 Å²	141.3	81%	0.812	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-68	126.8	177.6	174.1	0	0	0	0	111.3	R453	V451-R453 PolarHBondContact O-N 3.08Å
452	R	33.9	Very low	36.7	Very low	245 Å²	245	148.9 Å²	148.9	93%	0.925	84%	0.835	S	S	*	*			trans	-63.8	109.3	170.3	-122.5	179.1	178.2	-171.8	-0	110.1
453	R	34.6	Very low	37.4	Very low	242 Å²	242	152.3 Å²	152.3	91%	0.913	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-81.3	123.1	166.2	-80.9	-173.7	175.3	-174.3	-0.5	110	V451 G455	V451-R453 PolarHBondContact O-N 3.08Å; R453-G455 PolarHBondContact O-N 3.06Å
454	R	38.2	Very low	37.6	Very low	250 Å²	250	150.8 Å²	150.8	94%	0.943	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-67.6	122.2	167.9	-73.9	179.9	177	-178.2	-1.8	109.1
455	G	37.7	Very low	37.7	Very low	67 Å²	67	153.6 Å²	153.6	69%	0.691	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-78.7	157.4	165.7	0	0	0	0	0	111.5	R453	R453-G455 PolarHBondContact O-N 3.06Å
456	P	38.3	Very low	37.8	Very low	129 Å²	129	152.2 Å²	152.2	84%	0.838	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-75.6	150.3	-174.5	31.4	-32.9	0	0	0	112.4
457	A	37.2	Very low	37.9	Very low	101 Å²	101	153.3 Å²	153.3	84%	0.835	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-67.2	136.9	-179.3	0	0	0	0	0	112.5
458	V	41	Very low	38	Very low	134 Å²	134	158.2 Å²	158.2	81%	0.812	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-90.2	128.8	171	179.2	0	0	0	0	108.6
459	P	41.8	Very low	38	Very low	108 Å²	108	159.6 Å²	159.6	70%	0.701	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-78.7	151.8	177.4	30.7	-31.8	0	0	0	111.9
460	P	40.6	Very low	37.9	Very low	126 Å²	126	159.4 Å²	159.4	82%	0.818	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-75.4	136.5	-176.6	29.2	-32.4	0	0	0	112.4
461	L	34.8	Very low	38	Very low	174 Å²	174	161.7 Å²	161.7	91%	0.911	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-68.2	124.6	170.3	-94.1	137.1	0	0	0	110.5
462	R	37.3	Very low	38	Very low	245 Å²	245	163.7 Å²	163.7	93%	0.925	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-66	125.6	170	-81.7	177.6	167.5	179.9	-4.3	110.5
463	T	42.4	Very low	38.3	Very low	145 Å²	145	157.5 Å²	157.5	89%	0.89	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-75.6	129.3	158.6	45.7	0	0	0	0	109.8
464	G	39.1	Very low	38.6	Very low	72 Å²	72	150.4 Å²	150.4	74%	0.742	87%	0.87	S	S	*	*			trans	-142.7	115.6	172.7	0	0	0	0	0	110.7
465	L	35	Very low	38.7	Very low	254 Å²	254	141.4 Å²	141.4	100%	1.33	86%	0.863	S	S	*	*			trans	42.2	0	155.5	-73.9	158.8	0	0	0	120.1

Retrieved 465 of 465 residues in 102.5 ms (Link to these results)

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