A0A096NBC9_PAPAN Loading...

Kelch like family member 13

Substrate-specific adapter of a BCR (BTB-CUL3-RBX1) E3 ubiquitin-protein ligase complex required for mitotic progression and cytokinesis. The BCR(KLHL9-KLHL13) E3 ubiquitin ligase complex mediates the ubiquitination of AURKB and controls the dynamic behavior of AURKB on mitotic chromosomes and thereby coordinates faithful mitotic progression and completion of cytokinesis.

AlphaFold DB (A0A2K5XPH8), UniProt , Accession A0A096NBC9, Species PAPAN (Papio anubis, Olive baboon), Gene KLHL13, Length 658 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	34.4	Very low	219 Å²	219	151.9 Å²	151.9	100%	1.079	69%	0.693	S	S	*	*				0	-41.4	0	-83.4	175	180	0	0	114.2	R3	M1-R3 PolarHBondContact O-N 3.43Å
2	M	24.5	Very low	34.9	Very low	170 Å²	170	142.8 Å²	142.8	84%	0.837	66%	0.664	S	S	*	*	H	α-helix	trans	-67.4	-19.6	-177.8	-87.2	176.2	169.4	0	0	117.4	T6	M2-T6 PolarHBondContact O-OG1 3.26Å
3	R	29.7	Very low	35.2	Very low	222 Å²	222	142.8 Å²	142.8	84%	0.838	66%	0.656	S	S	*	*	H	α-helix	trans	-83.1	-19.3	179	-83.6	-177.5	175.2	178	-0.6	115.1	M1 T6	M1-R3 PolarHBondContact O-N 3.43Å; R3-T6 PolarHBondContact O-OG1 3.35Å
4	V	36.2	Very low	35.7	Very low	96 Å²	96	144.6 Å²	144.6	58%	0.582	66%	0.655	S	S	*	*	H	α-helix	trans	-83.5	-29	-178.9	179.9	0	0	0	0	111.4	L7 R8	V4-L7 PolarHBondContact O-N 3.04Å; V4-R8 PolarHBondContact O-N 3.37Å
5	Q	29.8	Very low	36.2	Very low	126 Å²	126	145.9 Å²	145.9	59%	0.589	65%	0.652	S	S	*	*	H	α-helix	trans	-67.7	-41.7	175.2	-116.3	164.1	-22.8	0	0	112.1	L7 R8 E9	Q5-L7 VanDerWaalsContact C-N 3.29Å; Q5-L7 PolarHBondContact O-N 2.98Å; Q5-R8 PolarHBondContact O-N 3.15Å; Q5-E9 PolarHBondContact O-N 3.33Å; Q5-E9 VanDerWaalsContact O-N 3.08Å
6	T	33.2	Very low	36.5	Very low	71 Å²	71	148.1 Å²	148.1	44%	0.436	65%	0.654	S	S	.	*	H	α-helix	trans	-65.3	-24.8	177.2	31.5	0	0	0	0	114.7	M2 R3 K10	M2-T6 PolarHBondContact O-OG1 3.26Å; R3-T6 PolarHBondContact O-OG1 3.35Å; T6-K10 WeakPolarHBondContact O-CB 3.11Å; T6-K10 WeakPolarHBondContact O-CG 3.32Å; T6-K10 PolarHBondContact O-N 3.25Å
7	L	36.7	Very low	36.4	Very low	113 Å²	113	147.5 Å²	147.5	59%	0.592	65%	0.647	S	S	*	*	H	α-helix	trans	-80.6	-37.1	175.1	-84.7	159.6	0	0	0	111.9	V4 Q5 K10 W11	V4-L7 PolarHBondContact O-N 3.04Å; Q5-L7 VanDerWaalsContact C-N 3.29Å; Q5-L7 PolarHBondContact O-N 2.98Å; L7-K10 PolarHBondContact O-N 3.33Å; L7-W11 WeakPolarHBondContact O-CB 3.44Å; L7-W11 PolarHBondContact O-N 3.06Å
8	R	37	Very low	36.6	Very low	196 Å²	196	145.8 Å²	145.8	74%	0.74	64%	0.641	S	S	*	*	H	α-helix	trans	-65.7	-38	173.5	-81.3	-176	168.9	-176.5	-2.9	112.5	V4 Q5 W11 A12	V4-R8 PolarHBondContact O-N 3.37Å; Q5-R8 PolarHBondContact O-N 3.15Å; R8-W11 PolarHBondContact O-N 2.98Å; R8-A12 PolarHBondContact O-N 3.3Å
9	E	35.3	Very low	36.7	Very low	133 Å²	133	145.1 Å²	145.1	62%	0.621	64%	0.644	S	S	*	*	H	α-helix	trans	-71.7	-37.5	177.2	-72.7	175.3	170.9	0	0	112.6	Q5 A12 Y13	Q5-E9 PolarHBondContact O-N 3.33Å; Q5-E9 VanDerWaalsContact O-N 3.08Å; E9-A12 PolarHBondContact O-N 2.86Å; E9-Y13 PolarHBondContact O-N 3.46Å; E9-Y13 VanDerWaalsContact O-N 3.08Å
10	K	35.9	Very low	36.4	Very low	143 Å²	143	142 Å²	142	62%	0.622	64%	0.64	S	S	*	*	H	α-helix	trans	-65.7	-38.1	170.8	-76.9	-178.1	178.3	-174.5	0	112	T6 L7 Y13 W14	T6-K10 WeakPolarHBondContact O-CB 3.11Å; T6-K10 WeakPolarHBondContact O-CG 3.32Å; T6-K10 PolarHBondContact O-N 3.25Å; L7-K10 PolarHBondContact O-N 3.33Å; K10-Y13 PolarHBondContact O-N 3.42Å; K10-W14 VanDerWaalsContact O-CD1 3.26Å; K10-W14 PolarHBondContact O-N 2.87Å; K10-W14 VanDerWaalsContact O-N 3.15Å
11	W	42.2	Very low	36.3	Very low	182 Å²	182	140.7 Å²	140.7	69%	0.689	64%	0.639	S	S	*	*	H	α-helix	trans	-63.3	-40.5	172.8	-101.5	58	0	0	0	113.2	L7 R8 Y13 W14 R15	L7-W11 WeakPolarHBondContact O-CB 3.44Å; L7-W11 PolarHBondContact O-N 3.06Å; R8-W11 PolarHBondContact O-N 2.98Å; W11-Y13 VanDerWaalsContact C-N 3.32Å; W11-Y13 PolarHBondContact O-N 3.47Å; W11-W14 PolarHBondContact O-N 3.45Å; W11-R15 PolarHBondContact O-N 2.71Å; W11-R15 VanDerWaalsContact O-N 3.1Å
12	A	40	Very low	36.2	Very low	42 Å²	42	137.2 Å²	137.2	35%	0.347	62%	0.617	S	S	.	*	H	α-helix	trans	-69	-28.9	176.2	0	0	0	0	0	113.2	R8 E9 R16	R8-A12 PolarHBondContact O-N 3.3Å; E9-A12 PolarHBondContact O-N 2.86Å; A12-R16 PolarHBondContact O-N 3.34Å; A12-R16 PolarHBondContact O-NE 2.72Å
13	Y	39.5	Very low	36.6	Very low	143 Å²	143	137.6 Å²	137.6	56%	0.561	62%	0.617	S	S	*	*	H	α-helix	trans	-70.2	-42.9	173.6	-179.2	-101.6	0	0	0	112	E9 K10 W11 R16 R17	E9-Y13 PolarHBondContact O-N 3.46Å; E9-Y13 VanDerWaalsContact O-N 3.08Å; K10-Y13 PolarHBondContact O-N 3.42Å; W11-Y13 VanDerWaalsContact C-N 3.32Å; W11-Y13 PolarHBondContact O-N 3.47Å; Y13-R16 PolarHBondContact O-N 2.61Å; Y13-R17 PolarHBondContact O-N 3.01Å
14	W	41.8	Very low	36.6	Very low	169 Å²	169	130.9 Å²	130.9	64%	0.64	61%	0.609	S	S	*	*	H	α-helix	trans	-68.4	-36.1	176.3	-81.4	99.7	0	0	0	113.4	K10 W11 R16 R17 Q18	K10-W14 VanDerWaalsContact O-CD1 3.26Å; K10-W14 PolarHBondContact O-N 2.87Å; K10-W14 VanDerWaalsContact O-N 3.15Å; W11-W14 PolarHBondContact O-N 3.45Å; W14-R16 PolarHBondContact O-N 2.8Å; W14-R17 PolarHBondContact O-N 3.35Å; W14-Q18 PolarHBondContact O-N 3.21Å
15	R	43.8	Very low	36.5	Very low	163 Å²	163	132.9 Å²	132.9	62%	0.615	62%	0.617	S	S	*	*	H	α-helix	trans	-60.2	-41.2	172.7	-102.3	-172.9	-172.6	-167.5	2.3	113.4	W11 R17 Q18 L19	W11-R15 PolarHBondContact O-N 2.71Å; W11-R15 VanDerWaalsContact O-N 3.1Å; R15-R17 VanDerWaalsContact C-N 3.28Å; R15-R17 PolarHBondContact O-N 3.28Å; R15-Q18 PolarHBondContact O-N 3.21Å; R15-L19 PolarHBondContact O-N 3.08Å
16	R	39.9	Very low	36.5	Very low	181 Å²	181	135.5 Å²	135.5	68%	0.683	63%	0.626	S	S	*	*	H	α-helix	trans	-66.5	-30.8	178.5	-85.7	-176.1	-83.5	-155.6	-1.4	112.6	A12 Y13 W14	A12-R16 PolarHBondContact O-N 3.34Å; A12-R16 PolarHBondContact O-NE 2.72Å; Y13-R16 PolarHBondContact O-N 2.61Å; W14-R16 PolarHBondContact O-N 2.8Å
17	R	34.5	Very low	36.3	Very low	138 Å²	138	141.6 Å²	141.6	52%	0.521	65%	0.647	S	S	.	*	H	α-helix	trans	-76.1	-30.1	177.7	-151.4	172.4	176.6	179.3	-1.2	113	Y13 W14 R15	Y13-R17 PolarHBondContact O-N 3.01Å; W14-R17 PolarHBondContact O-N 3.35Å; R15-R17 VanDerWaalsContact C-N 3.28Å; R15-R17 PolarHBondContact O-N 3.28Å
18	Q	40.7	Very low	36	Very low	118 Å²	118	143.7 Å²	143.7	55%	0.551	66%	0.659	S	S	*	*	H	α-helix	trans	-72	-34.2	173	-92.3	-166.9	-24.6	0	0	113.7	W14 R15 S20 L21 K22	W14-Q18 PolarHBondContact O-N 3.21Å; R15-Q18 PolarHBondContact O-N 3.21Å; Q18-S20 VanDerWaalsContact C-N 3.3Å; Q18-S20 PolarHBondContact O-N 3.25Å; Q18-L21 PolarHBondContact O-N 3.29Å; Q18-K22 PolarHBondContact O-N 3.5Å
19	L	38.2	Very low	35.6	Very low	132 Å²	132	141.6 Å²	141.6	69%	0.691	66%	0.661	S	S	*	*	H	α-helix	trans	-65.8	-31.8	176.2	-89.8	150.1	0	0	0	112.5	R15	R15-L19 PolarHBondContact O-N 3.08Å
20	S	31.4	Very low	35.2	Very low	82 Å²	82	144.9 Å²	144.9	57%	0.573	67%	0.673	S	S	*	*	H	α-helix	trans	-80	-19.8	177.1	101.3	0	0	0	0	113.9	Q18	Q18-S20 VanDerWaalsContact C-N 3.3Å; Q18-S20 PolarHBondContact O-N 3.25Å
21	L	33.6	Very low	34.9	Very low	116 Å²	116	147.6 Å²	147.6	61%	0.607	69%	0.685	S	S	*	*	H	α-helix	trans	-87.3	-27.9	177.3	-77.4	160.7	0	0	0	112.4	Q18 Q23 A24	Q18-L21 PolarHBondContact O-N 3.29Å; L21-Q23 VanDerWaalsContact C-N 3.29Å; L21-Q23 PolarHBondContact O-N 3.08Å; L21-A24 PolarHBondContact O-N 3.38Å
22	K	36.3	Very low	34.3	Very low	145 Å²	145	149.1 Å²	149.1	63%	0.63	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-11.4	176.7	-79	-171.6	174.7	-175.1	0	115.1	Q18 A24	Q18-K22 PolarHBondContact O-N 3.5Å; K22-A24 VanDerWaalsContact C-N 3.34Å
23	Q	32.5	Very low	33.6	Very low	178 Å²	178	152.4 Å²	152.4	83%	0.832	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-10.7	176.1	-110	173.3	-2.8	0	0	113.8	L21	L21-Q23 VanDerWaalsContact C-N 3.29Å; L21-Q23 PolarHBondContact O-N 3.08Å
24	A	30.8	Very low	33	Very low	81 Å²	81	152.4 Å²	152.4	67%	0.669	73%	0.732	S	S	*	*	S	Bend	trans	-93.2	-24.2	-176.6	0	0	0	0	0	114.8	L21 K22	L21-A24 PolarHBondContact O-N 3.38Å; K22-A24 VanDerWaalsContact C-N 3.34Å
25	D	33.5	Very low	32.2	Very low	138 Å²	138	150.5 Å²	150.5	74%	0.738	75%	0.745	S	S	*	*	S	Bend	trans	-112	8.9	-168.6	-77.2	-30.2	0	0	0	115.7	K27	D25-K27 PolarHBondContact O-N 3.3Å
26	F	29.5	Very low	31.4	Very low	181 Å²	181	146.4 Å²	146.4	79%	0.794	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	12.9	-173	-113.7	-85.5	0	0	0	115.9
27	K	28.5	Very low	30.6	Very low	200 Å²	200	142.8 Å²	142.8	87%	0.87	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-10	-174.2	-93.4	-174.1	176.3	-179.7	0	117.4	D25	D25-K27 PolarHBondContact O-N 3.3Å
28	D	30.4	Very low	30.2	Very low	157 Å²	157	143.2 Å²	143.2	84%	0.84	77%	0.767	S	S	*	*	S	Bend	trans	-120.8	11.7	-167.7	-86	-31.6	0	0	0	117.9
29	I	29.5	Very low	29.6	Very low	152 Å²	152	143.6 Å²	143.6	78%	0.779	78%	0.777	S	S	*	*	S	Bend	trans	-111.2	0.7	-176	-61.3	179	0	0	0	114.9
30	F	27.1	Very low	29	Very low	202 Å²	202	146.1 Å²	146.1	89%	0.886	79%	0.785	S	S	*	*			trans	-124.9	68.3	175.8	-90.1	-86.4	0	0	0	113.4
31	K	29.1	Very low	28.7	Very low	200 Å²	200	151 Å²	151	87%	0.87	80%	0.799	S	S	*	*			trans	-147	80.3	157.9	-88.5	-171.9	178.8	174.1	0	110
32	K	30.1	Very low	28.3	Very low	214 Å²	214	154.9 Å²	154.9	93%	0.93	81%	0.814	S	S	*	*			trans	170.5	84.4	148.6	-97.3	168.1	-178.7	-177.2	0	111.2
33	S	26	Very low	27.8	Very low	110 Å²	110	156 Å²	156	77%	0.769	83%	0.827	S	S	*	*			trans	-169.3	86.5	145.7	55.6	0	0	0	0	110.5
34	T	25.4	Very low	27.7	Very low	143 Å²	143	155.9 Å²	155.9	88%	0.877	83%	0.827	S	S	*	*			trans	-168.1	105.1	156.4	29.3	0	0	0	0	109.1
35	S	26.3	Very low	27.4	Very low	130 Å²	130	161 Å²	161	91%	0.909	84%	0.836	S	S	*	*			trans	148.7	123.7	156.5	64.2	0	0	0	0	106.6
36	G	25.7	Very low	27.1	Very low	77 Å²	77	162.6 Å²	162.6	79%	0.794	84%	0.841	S	S	*	*			cis	-179.2	161.3	8.7	0	0	0	0	0	106.6
37	S	24.2	Very low	27	Very low	104 Å²	104	163.6 Å²	163.6	73%	0.727	85%	0.845	S	S	*	*			trans	-64.6	159.6	-173.3	53.4	0	0	0	0	116.4
38	L	25.5	Very low	26.8	Very low	148 Å²	148	161.5 Å²	161.5	78%	0.775	84%	0.843	S	S	*	*				160.5	112.3	113.6	-80.7	164.8	0	0	0	108.5
39	V	27.4	Very low	26.6	Very low	125 Å²	125	159.3 Å²	159.3	76%	0.758	84%	0.84	S	S	*	*				61.5	110.7	108.1	-177	0	0	0	0	113.2
40	E	25.8	Very low	26.5	Very low	185 Å²	185	160.4 Å²	160.4	86%	0.864	85%	0.846	S	S	*	*			trans	-165.9	129	132	-107	168	-161.1	0	0	111.8
41	E	25.1	Very low	26.5	Very low	186 Å²	186	154.8 Å²	154.8	87%	0.869	85%	0.846	S	S	*	*			trans	-1.5	133.5	168.3	-66.5	173.5	156.8	0	0	121.6
42	E	25.9	Very low	26.3	Very low	197 Å²	197	148.7 Å²	148.7	92%	0.921	84%	0.84	S	S	*	*			trans	-72.7	131.1	159.8	-72.9	-177.2	146.9	0	0	110.1
43	D	24.7	Very low	26.7	Very low	168 Å²	168	144.5 Å²	144.5	90%	0.898	84%	0.837	S	S	*	*			trans	-134.5	130.3	154	-130.8	-9.8	0	0	0	110.1
44	Q	30.6	Very low	26.8	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.822	84%	0.842	S	S	*	*			trans	-72	143.9	-176.6	-70.4	175.3	-9.8	0	0	111.1
45	H	25.9	Very low	27.3	Very low	189 Å²	189	150.2 Å²	150.2	88%	0.875	84%	0.844	S	S	*	*				-167.4	132.5	126.7	-109.5	-74.8	0	0	0	113.2
46	M	26.9	Very low	27.6	Very low	170 Å²	170	146.4 Å²	146.4	84%	0.837	83%	0.825	S	S	*	*			trans	-45.2	148	170.6	-67.7	179.2	-175.6	0	0	114.5
47	K	26.2	Very low	27.9	Very low	202 Å²	202	149.8 Å²	149.8	88%	0.878	82%	0.824	S	S	*	*				-160.3	111.8	126.8	-111	167.2	-173.3	177.7	0	113.6
48	L	24.2	Very low	28.6	Very low	157 Å²	157	147.5 Å²	147.5	82%	0.822	81%	0.809	S	S	*	*			trans	19.5	121.7	141.8	-75.1	128.6	0	0	0	119.3
49	S	27.5	Very low	29.2	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	79%	0.792	S	S	*	*			trans	-61.1	136.1	156.5	57.9	0	0	0	0	112
50	L	26.5	Very low	30	Very low	175 Å²	175	144.5 Å²	144.5	92%	0.916	79%	0.789	S	S	*	*			trans	-127.7	130.7	151.9	-89.6	159.4	0	0	0	107.7
51	G	28.1	Very low	30.7	Very low	85 Å²	85	142.7 Å²	142.7	88%	0.876	78%	0.784	S	S	*	*			trans	-67.1	148.1	-172.3	0	0	0	0	0	113.6
52	G	23.9	Very low	31.6	Very low	72 Å²	72	142.6 Å²	142.6	74%	0.742	78%	0.784	S	S	*	*			trans	-169.6	111.2	169.2	0	0	0	0	0	107.6	E54	G52-E54 PolarHBondContact O-N 2.95Å
53	S	38.2	Very low	32.4	Very low	125 Å²	125	139.2 Å²	139.2	87%	0.874	78%	0.782	S	S	*	*			trans	-58.4	114	169.4	50.4	0	0	0	0	109.5
54	E	29.9	Very low	33.3	Very low	188 Å²	188	136.5 Å²	136.5	88%	0.879	78%	0.776	S	S	*	*			trans	-157.6	140.4	165	-114.6	171	-161.3	0	0	110.2	G52 G56	G52-E54 PolarHBondContact O-N 2.95Å; E54-G56 PolarHBondContact O-N 3.37Å; E54-G56 VanDerWaalsContact O-N 3.17Å
55	M	35.7	Very low	34.2	Very low	185 Å²	185	138 Å²	138	91%	0.911	78%	0.78	S	S	*	*			trans	-47	118.5	179.1	-74.3	-171.6	-107.5	0	0	111.3	L57	M55-L57 PolarHBondContact O-N 3.49Å
56	G	31	Very low	35.7	Very low	51 Å²	51	134.1 Å²	134.1	53%	0.526	78%	0.781	S	S	.	*			trans	-66.2	91.9	-178.1	0	0	0	0	0	113	E54 T76	E54-G56 PolarHBondContact O-N 3.37Å; E54-G56 VanDerWaalsContact O-N 3.17Å; G56-T76 PolarHBondContact O-OG1 3.37Å
57	L	33.1	Very low	37.4	Very low	147 Å²	147	128.8 Å²	128.8	77%	0.77	77%	0.769	S	S	*	*			trans	-94.3	92.9	159.2	-84.4	153.9	0	0	0	108.1	M55	M55-L57 PolarHBondContact O-N 3.49Å
58	S	37.6	Very low	39.6	Very low	57 Å²	57	125.7 Å²	125.7	40%	0.399	77%	0.77	S	S	.	*			trans	-91.9	99.2	162.1	176	0	0	0	0	107.8
59	S	39	Very low	42	Very low	62 Å²	62	123.9 Å²	123.9	43%	0.434	77%	0.765	S	S	.	*			trans	-88.4	105.2	174.8	59.2	0	0	0	0	110	L61	S59-L61 PolarHBondContact O-N 3.43Å
60	H	43.5	Very low	44.7	Very low	147 Å²	147	128.6 Å²	128.6	68%	0.681	77%	0.766	S	S	*	*			trans	-76.4	107.7	160.5	-87.2	-70.1	0	0	0	108.7	Q62	H60-Q62 PolarHBondContact O-N 3.15Å
61	L	41.6	Very low	47.5	Very low	147 Å²	147	127.1 Å²	127.1	77%	0.77	76%	0.758	S	S	*	*			trans	-70.1	107.7	168	-89.9	103.5	0	0	0	109.2	S59 S63	S59-L61 PolarHBondContact O-N 3.43Å; L61-S63 PolarHBondContact O-N 3.43Å
62	Q	44.1	Very low	50.5	Low	185 Å²	185	130.2 Å²	130.2	86%	0.864	75%	0.747	S	S	*	*			trans	-78.4	113.9	156.7	-81	-177.5	-10.5	0	0	108.2	H60 S64	H60-Q62 PolarHBondContact O-N 3.15Å; Q62-S64 PolarHBondContact O-N 3.41Å
63	S	41.9	Very low	53.6	Low	126 Å²	126	131 Å²	131	88%	0.881	74%	0.738	S	S	*	*			trans	-73.1	94.2	174.1	58.8	0	0	0	0	109.9	L61	L61-S63 PolarHBondContact O-N 3.43Å
64	S	43.8	Very low	56.2	Low	110 Å²	110	127.7 Å²	127.7	77%	0.769	72%	0.715	S	S	*	*			trans	-96.4	129.5	164	123.1	0	0	0	0	109	Q62	Q62-S64 PolarHBondContact O-N 3.41Å
65	K	50.2	Low	59.2	Low	207 Å²	207	123.4 Å²	123.4	90%	0.9	70%	0.698	S	S	*	*			trans	-60.3	131.7	-176.5	-73.9	177	174.1	177.8	0	112.3
66	A	57.1	Low	61.9	Low	109 Å²	109	117.1 Å²	117.1	90%	0.901	67%	0.67	S	S	*	*	S	Bend	trans	49.3	84.4	152.6	0	0	0	0	0	119.3
67	G	61.3	Low	64.9	Low	57 Å²	57	120.5 Å²	120.5	59%	0.588	67%	0.672	S	S	*	*			trans	-160.7	158.9	154.6	0	0	0	0	0	109.4	T69	G67-T69 PolarHBondContact O-N 3.48Å; G67-T69 VanDerWaalsContact O-N 3.15Å
68	P	72.8	Confident	67.6	Low	138 Å²	138	117.2 Å²	117.2	90%	0.896	66%	0.661	S	S	*	*	S	Bend	trans	-68.7	-8.4	-178	28.4	-34.7	0	0	0	113.8
69	T	74.4	Confident	70.2	Confident	118 Å²	118	117 Å²	117	72%	0.724	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-89.3	122	-176.8	-49.4	0	0	0	0	110.9	G67	G67-T69 PolarHBondContact O-N 3.48Å; G67-T69 VanDerWaalsContact O-N 3.15Å
70	R	85.1	Confident	72.8	Confident	210 Å²	210	118 Å²	118	79%	0.792	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-100.5	130.5	168.9	-63.8	-178	-177	178.7	0.7	109.1	F72	R70-F72 HydrophobicContact CB-CE2 3.93Å; R70-F72 HydrophobicContact CB-CZ 4.28Å
71	I	86.3	Confident	75.2	Confident	144 Å²	144	113.9 Å²	113.9	74%	0.738	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-101.5	126.5	176.3	-58.7	175.4	0	0	0	108	T73	I71-T73 HydrophobicContact CG2-CG2 4.46Å
72	F	90.2	Very high	77.7	Confident	149 Å²	149	109.1 Å²	109.1	65%	0.654	62%	0.623	S	S	*	*			trans	-111.1	135.9	174	-61.6	-90	0	0	0	109.3	R70	R70-F72 HydrophobicContact CB-CE2 3.93Å; R70-F72 HydrophobicContact CB-CZ 4.28Å
73	T	89.9	Confident	80.1	Confident	90 Å²	90	106.6 Å²	106.6	55%	0.552	61%	0.611	S	S	*	*			trans	-124.3	131.1	177.7	52.9	0	0	0	0	109.8	I71	I71-T73 HydrophobicContact CG2-CG2 4.46Å
74	S	91.5	Very high	82.7	Confident	54 Å²	54	102.3 Å²	102.3	38%	0.378	59%	0.587	S	S	.	*			trans	-95.7	132.7	172.4	169.3	0	0	0	0	110.3	T76 H77	S74-T76 PolarHBondContact OG-N 2.81Å; S74-T76 PolarHBondContact OG-OG1 3.34Å; S74-H77 PolarHBondContact OG-N 2.71Å
75	N	92.3	Very high	85.2	Confident	98 Å²	98	100.1 Å²	100.1	52%	0.524	56%	0.564	S	S	.	*	S	Bend	trans	-86.4	-12.2	175.5	60.2	-10.4	0	0	0	113.7
76	T	92.4	Very high	87.4	Confident	54 Å²	54	91.7 Å²	91.7	33%	0.331	53%	0.528	S	S	.	.	S	Bend	trans	-102.3	-18.2	-178.5	52.3	0	0	0	0	113.1	G56 S74 S78 S79 V80	G56-T76 PolarHBondContact O-OG1 3.37Å; S74-T76 PolarHBondContact OG-N 2.81Å; S74-T76 PolarHBondContact OG-OG1 3.34Å; T76-S78 VanDerWaalsContact C-N 3.34Å; T76-S78 PolarHBondContact O-N 2.86Å; T76-S79 PolarHBondContact O-N 3.47Å; T76-S79 VanDerWaalsContact O-N 3.12Å; T76-S79 PolarHBondContact O-OG 2.9Å; T76-V80 WeakPolarHBondContact O-CG2 3.35Å; T76-V80 PolarHBondContact O-N 2.9Å
77	H	94.2	Very high	89.2	Confident	122 Å²	122	91.1 Å²	91.1	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-54.7	-45.8	-173.8	-177.5	61.7	0	0	0	113	S74 S79 V80 V81	S74-H77 PolarHBondContact OG-N 2.71Å; H77-S79 PolarHBondContact O-N 2.92Å; H77-V80 PolarHBondContact O-N 3.24Å; H77-V81 VanDerWaalsContact O-CG2 3.31Å; H77-V81 WeakPolarHBondContact O-CG2 3.38Å; H77-V81 PolarHBondContact O-N 3.41Å
78	S	90.4	Very high	90.9	Very high	78 Å²	78	90.9 Å²	90.9	55%	0.545	49%	0.492	S	S	.	.	H	α-helix	trans	-60	-43.5	178.7	52.8	0	0	0	0	112.7	T76 V81 L82	T76-S78 VanDerWaalsContact C-N 3.34Å; T76-S78 PolarHBondContact O-N 2.86Å; S78-V81 PolarHBondContact O-N 2.91Å; S78-L82 WeakPolarHBondContact O-CB 3.21Å; S78-L82 PolarHBondContact O-N 2.92Å
79	S	91.6	Very high	92	Very high	53 Å²	53	86 Å²	86	37%	0.371	46%	0.456	S	S	.	.	H	α-helix	trans	-66.8	-38.2	177.5	58.2	0	0	0	0	113	T76 H77 L82 Q83	T76-S79 PolarHBondContact O-N 3.47Å; T76-S79 VanDerWaalsContact O-N 3.12Å; T76-S79 PolarHBondContact O-OG 2.9Å; H77-S79 PolarHBondContact O-N 2.92Å; S79-L82 PolarHBondContact O-N 3.2Å; S79-Q83 WeakPolarHBondContact O-CB 3.41Å; S79-Q83 VanDerWaalsContact O-CG 3.27Å; S79-Q83 WeakPolarHBondContact O-CG 3.48Å; S79-Q83 PolarHBondContact O-N 3.46Å
80	V	94.2	Very high	93	Very high	83 Å²	83	85.8 Å²	85.8	50%	0.503	45%	0.45	S	S	.	.	H	α-helix	trans	-67.7	-40.9	178.2	172.9	0	0	0	0	110.4	T76 H77 Q83 G84	T76-V80 WeakPolarHBondContact O-CG2 3.35Å; T76-V80 PolarHBondContact O-N 2.9Å; H77-V80 PolarHBondContact O-N 3.24Å; V80-Q83 PolarHBondContact O-N 3.15Å; V80-G84 PolarHBondContact O-N 3.06Å
81	V	94.4	Very high	93.5	Very high	59 Å²	59	81.1 Å²	81.1	36%	0.358	44%	0.437	S	S	.	.	H	α-helix	trans	-62.8	-46.3	175.4	171	0	0	0	0	111.1	H77 S78 G84 F85	H77-V81 VanDerWaalsContact O-CG2 3.31Å; H77-V81 WeakPolarHBondContact O-CG2 3.38Å; H77-V81 PolarHBondContact O-N 3.41Å; S78-V81 PolarHBondContact O-N 2.91Å; V81-G84 PolarHBondContact O-N 2.85Å; V81-F85 HydrophobicContact CG1-CD2 3.82Å; V81-F85 HydrophobicContact CG1-CE2 3.74Å; V81-F85 WeakPolarHBondContact O-CD2 3.47Å; V81-F85 PolarHBondContact O-N 3.12Å
82	L	94.6	Very high	93.8	Very high	47 Å²	47	76.3 Å²	76.3	25%	0.246	42%	0.423	C	S	.	.	H	α-helix	trans	-59.3	-46.3	175.8	-90.9	151.9	0	0	0	112.2	S78 S79 G84 F85 D86 M114 I155 Y156	S78-L82 WeakPolarHBondContact O-CB 3.21Å; S78-L82 PolarHBondContact O-N 2.92Å; S79-L82 PolarHBondContact O-N 3.2Å; L82-G84 VanDerWaalsContact C-N 3.31Å; L82-G84 PolarHBondContact O-N 2.86Å; L82-F85 PolarHBondContact O-N 3.04Å; L82-D86 PolarHBondContact O-N 3.37Å; L82-M114 HydrophobicContact CD2-CE 3.92Å; L82-I155 WeakPolarHBondContact CD2-O 3.29Å; L82-Y156 VanDerWaalsContact CD2-O 3.29Å; L82-Y156 WeakPolarHBondContact CD2-O 3.4Å
83	Q	94.3	Very high	94	Very high	133 Å²	133	73.3 Å²	73.3	62%	0.621	41%	0.413	S	S	*	.	H	α-helix	trans	-59.4	-41.3	175	-75.6	173	-1.6	0	0	112.2	S79 V80 D86 Q87	S79-Q83 WeakPolarHBondContact O-CB 3.41Å; S79-Q83 VanDerWaalsContact O-CG 3.27Å; S79-Q83 WeakPolarHBondContact O-CG 3.48Å; S79-Q83 PolarHBondContact O-N 3.46Å; V80-Q83 PolarHBondContact O-N 3.15Å; Q83-D86 PolarHBondContact O-N 3.38Å; Q83-Q87 PolarHBondContact O-N 3.03Å
84	G	95.9	Very high	94.2	Very high	36 Å²	36	75.7 Å²	75.7	37%	0.371	42%	0.422	S	S	.	.	H	α-helix	trans	-60.6	-45.5	174.7	0	0	0	0	0	112.5	V80 V81 L82 D86 Q87 L88	V80-G84 PolarHBondContact O-N 3.06Å; V81-G84 PolarHBondContact O-N 2.85Å; L82-G84 VanDerWaalsContact C-N 3.31Å; L82-G84 PolarHBondContact O-N 2.86Å; G84-D86 VanDerWaalsContact C-N 3.34Å; G84-D86 PolarHBondContact O-N 2.89Å; G84-Q87 PolarHBondContact O-N 3.19Å; G84-L88 WeakPolarHBondContact O-CG 3.29Å; G84-L88 PolarHBondContact O-N 3.07Å
85	F	96.2	Very high	94.4	Very high	63 Å²	63	74.8 Å²	74.8	28%	0.276	42%	0.415	S	S	.	.	H	α-helix	trans	-64.8	-36.2	175.7	-85.5	-67.6	0	0	0	113.2	V81 L82 R89 H111 M114 Y156	V81-F85 HydrophobicContact CG1-CD2 3.82Å; V81-F85 HydrophobicContact CG1-CE2 3.74Å; V81-F85 WeakPolarHBondContact O-CD2 3.47Å; V81-F85 PolarHBondContact O-N 3.12Å; L82-F85 PolarHBondContact O-N 3.04Å; F85-R89 WeakPolarHBondContact O-CB 3.38Å; F85-R89 PolarHBondContact O-N 2.97Å; F85-H111 AromaticContact CD1-ND1 3.95Å; F85-M114 HydrophobicContact CB-CE 4.44Å; F85-M114 HydrophobicContact CB-SD 4.36Å; F85-M114 HydrophobicContact CD1-CG 4.06Å; F85-M114 HydrophobicContact CD1-SD 4.22Å; F85-M114 HydrophobicContact CD2-SD 3.84Å; F85-M114 HydrophobicContact CE1-CG 4.44Å; F85-M114 HydrophobicContact CE1-SD 4.49Å; F85-M114 HydrophobicContact CE2-SD 4.14Å; F85-M114 HydrophobicContact CG-CG 4.2Å; F85-M114 HydrophobicContact CG-SD 3.89Å; F85-M114 HydrophobicContact CZ-SD 4.46Å; F85-Y156 HydrophobicContact CB-CD1 4.03Å; F85-Y156 HydrophobicContact CB-CE1 4.01Å; F85-Y156 WeakPolarHBondContact O-CE1 3.27Å
86	D	95.9	Very high	94.5	Very high	30 Å²	30	73.1 Å²	73.1	16%	0.16	41%	0.407	C	S	.	.	H	α-helix	trans	-67.2	-42.3	176.6	-164.8	40.5	0	0	0	111.3	L82 Q83 G84 R89 L90 Y156	L82-D86 PolarHBondContact O-N 3.37Å; Q83-D86 PolarHBondContact O-N 3.38Å; G84-D86 VanDerWaalsContact C-N 3.34Å; G84-D86 PolarHBondContact O-N 2.89Å; D86-R89 WeakPolarHBondContact O-CB 3.5Å; D86-R89 PolarHBondContact O-N 3.4Å; D86-R89 IonicContact OD1-CZ 3.54Å; D86-R89 VanDerWaalsContact OD1-CZ 3.32Å; D86-R89 IonicContact OD1-NE 3.32Å; D86-R89 PolarHBondContact OD1-NE 3.47Å; D86-R89 VanDerWaalsContact OD1-NE 3.1Å; D86-R89 IonicContact OD1-NH2 3.95Å; D86-R89 PolarHBondContact OD1-NH2 3.1Å; D86-L90 WeakPolarHBondContact O-CG 3.45Å; D86-L90 PolarHBondContact O-N 2.88Å; D86-Y156 HydrophobicContact CB-CD1 4.27Å; D86-Y156 WeakPolarHBondContact OD1-CB 3.49Å
87	Q	96.1	Very high	94.7	Very high	97 Å²	97	70.7 Å²	70.7	45%	0.453	39%	0.391	S	S	.	.	H	α-helix	trans	-61.3	-46.8	175	-171.6	63	29.3	0	0	111.8	Q83 G84 R89 L90 E91	Q83-Q87 PolarHBondContact O-N 3.03Å; G84-Q87 PolarHBondContact O-N 3.19Å; Q87-R89 VanDerWaalsContact C-N 3.27Å; Q87-R89 PolarHBondContact O-N 3.4Å; Q87-L90 PolarHBondContact O-N 3.31Å; Q87-E91 PolarHBondContact NE2-OE1 3.37Å; Q87-E91 WeakPolarHBondContact O-CG 3.36Å; Q87-E91 PolarHBondContact O-N 3.46Å
88	L	96.7	Very high	94.8	Very high	53 Å²	53	66.6 Å²	66.6	28%	0.277	38%	0.375	S	S	.	.	H	α-helix	trans	-57.2	-42.4	175.8	-72.2	171.9	0	0	0	111.6	G84 E91 G92 L93 L94	G84-L88 WeakPolarHBondContact O-CG 3.29Å; G84-L88 PolarHBondContact O-N 3.07Å; L88-E91 PolarHBondContact O-N 3.5Å; L88-G92 PolarHBondContact O-N 3.22Å; L88-L93 HydrophobicContact CD2-CB 3.92Å; L88-L93 HydrophobicContact CD2-CD1 4.14Å; L88-L93 PolarHBondContact O-N 3.27Å; L88-L94 HydrophobicContact CD1-CD1 4.46Å
89	R	96.1	Very high	95	Very high	35 Å²	35	62.9 Å²	62.9	13%	0.132	35%	0.349	C	S	.	.	H	α-helix	trans	-62.9	-46.2	177	180	-172.2	67.7	104.6	-9.7	112	F85 D86 Q87 E91 G92 P109 D153 Y156	F85-R89 WeakPolarHBondContact O-CB 3.38Å; F85-R89 PolarHBondContact O-N 2.97Å; D86-R89 WeakPolarHBondContact O-CB 3.5Å; D86-R89 PolarHBondContact O-N 3.4Å; D86-R89 IonicContact OD1-CZ 3.54Å; D86-R89 VanDerWaalsContact OD1-CZ 3.32Å; D86-R89 IonicContact OD1-NE 3.32Å; D86-R89 PolarHBondContact OD1-NE 3.47Å; D86-R89 VanDerWaalsContact OD1-NE 3.1Å; D86-R89 IonicContact OD1-NH2 3.95Å; D86-R89 PolarHBondContact OD1-NH2 3.1Å; Q87-R89 VanDerWaalsContact C-N 3.27Å; Q87-R89 PolarHBondContact O-N 3.4Å; R89-E91 VanDerWaalsContact C-N 3.27Å; R89-E91 PolarHBondContact O-N 3.31Å; R89-G92 PolarHBondContact O-N 3.43Å; R89-P109 WeakPolarHBondContact CG-O 3.5Å; R89-D153 IonicContact NH1-OD1 3.72Å; R89-D153 IonicContact NH2-OD1 3.75Å; R89-Y156 HydrophobicContact CB-CD1 4.33Å; R89-Y156 HydrophobicContact CB-CE1 3.88Å; R89-Y156 HydrophobicContact CG-CE1 4.36Å
90	L	94.1	Very high	95.3	Very high	114 Å²	114	62.2 Å²	62.2	60%	0.597	34%	0.341	S	S	*	.	H	α-helix	trans	-63.4	-34.1	179.7	-70.7	172.3	0	0	0	112.2	D86 Q87 G92	D86-L90 WeakPolarHBondContact O-CG 3.45Å; D86-L90 PolarHBondContact O-N 2.88Å; Q87-L90 PolarHBondContact O-N 3.31Å; L90-G92 VanDerWaalsContact C-N 3.28Å
91	E	95.5	Very high	95.3	Very high	111 Å²	111	58.3 Å²	58.3	52%	0.519	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-6.7	174.2	-66.9	176	-171.2	0	0	113.2	Q87 L88 R89 L93	Q87-E91 PolarHBondContact NE2-OE1 3.37Å; Q87-E91 WeakPolarHBondContact O-CG 3.36Å; Q87-E91 PolarHBondContact O-N 3.46Å; L88-E91 PolarHBondContact O-N 3.5Å; R89-E91 VanDerWaalsContact C-N 3.27Å; R89-E91 PolarHBondContact O-N 3.31Å; E91-L93 HydrophobicContact CB-CD1 4.07Å; E91-L93 HydrophobicContact CB-CG 3.89Å; E91-L93 PolarHBondContact O-N 3.27Å; E91-L93 WeakPolarHBondContact OE2-CD1 3.17Å
92	G	93.1	Very high	95.1	Very high	44 Å²	44	56.6 Å²	56.6	45%	0.454	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	17.6	-176.7	0	0	0	0	0	113.9	L88 R89 L90	L88-G92 PolarHBondContact O-N 3.22Å; R89-G92 PolarHBondContact O-N 3.43Å; L90-G92 VanDerWaalsContact C-N 3.28Å
93	L	94.3	Very high	94.8	Very high	85 Å²	85	58.9 Å²	58.9	45%	0.445	32%	0.324	S	S	.	.			trans	-84.3	133.5	-178.5	-64.3	179.5	0	0	0	110.4	L88 E91 C95 H111	L88-L93 HydrophobicContact CD2-CB 3.92Å; L88-L93 HydrophobicContact CD2-CD1 4.14Å; L88-L93 PolarHBondContact O-N 3.27Å; E91-L93 HydrophobicContact CB-CD1 4.07Å; E91-L93 HydrophobicContact CB-CG 3.89Å; E91-L93 PolarHBondContact O-N 3.27Å; E91-L93 WeakPolarHBondContact OE2-CD1 3.17Å; L93-C95 PolarHBondContact O-N 2.9Å; L93-H111 PolarHBondContact O-NE2 2.98Å; L93-H111 VanDerWaalsContact O-NE2 3.12Å
94	L	94.4	Very high	94.8	Very high	140 Å²	140	54.6 Å²	54.6	73%	0.733	31%	0.307	S	S	*	.	S	Bend	trans	62.2	4.7	177.2	-52.9	175.3	0	0	0	115.6	L88 D96 H111	L88-L94 HydrophobicContact CD1-CD1 4.46Å; L94-D96 PolarHBondContact O-N 3.21Å; L94-H111 VanDerWaalsContact C-CD2 3.49Å; L94-H111 PolarHBondContact O-CD2 3.07Å
95	C	95.3	Very high	94.5	Very high	35 Å²	35	58.9 Å²	58.9	24%	0.236	32%	0.321	C	S	.	.			trans	-60.7	118	170.9	-68.2	0	0	0	0	110.6	L93 P109 V110	L93-C95 PolarHBondContact O-N 2.9Å; C95-P109 HydrophobicContact CB-CB 3.92Å; C95-V110 WeakPolarHBondContact CA-O 3.27Å
96	D	94.7	Very high	94.4	Very high	64 Å²	64	58.3 Å²	58.3	34%	0.342	32%	0.321	S	S	.	.			trans	-111.1	6.4	-172.5	63.1	-15.6	0	0	0	112.9	L94 V110 H111 R112	L94-D96 PolarHBondContact O-N 3.21Å; D96-V110 PolarHBondContact N-O 3.37Å; D96-H111 VanDerWaalsContact OD1-CA 3.29Å; D96-H111 WeakPolarHBondContact OD1-CA 3.36Å; D96-R112 PolarHBondContact O-NE 2.92Å; D96-R112 WeakPolarHBondContact OD1-CG 3.34Å; D96-R112 PolarHBondContact OD1-N 3.48Å; D96-R112 WeakPolarHBondContact OD2-CB 3.45Å
97	V	96	Very high	94.3	Very high	2 Å²	2	60 Å²	60	1%	0.012	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	148.4	170.4	68.6	0	0	0	0	111.2	L99 V110 R112 F126 I138	V97-L99 HydrophobicContact CG2-CD2 4.44Å; V97-V110 HydrophobicContact CG1-CG2 3.52Å; V97-V110 PolarHBondContact N-O 3.34Å; V97-V110 PolarHBondContact O-N 3.46Å; V97-V110 VanDerWaalsContact O-O 3.06Å; V97-R112 HydrophobicContact CB-CG 3.78Å; V97-R112 HydrophobicContact CG1-CG 3.55Å; V97-F126 HydrophobicContact CG1-CZ 4.36Å; V97-I138 HydrophobicContact CG2-CD1 3.63Å; V97-I138 HydrophobicContact CG2-CG1 4.1Å
98	T	96.4	Very high	94.4	Very high	37 Å²	37	56.4 Å²	56.4	23%	0.227	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.9	170.8	-59.6	0	0	0	0	109.5	A107 F108 M136 C137 I138	T98-A107 HydrophobicContact CG2-CB 3.65Å; T98-F108 WeakPolarHBondContact CA-O 3.32Å; T98-M136 PolarHBondContact N-O 3.27Å; T98-C137 WeakPolarHBondContact O-CA 3.22Å; T98-I138 PolarHBondContact O-N 3.32Å
99	L	96.3	Very high	94.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.3	173.7	-58.9	-179.6	0	0	0	109.5	V97 F108 V110 M115 F122 I138 L140 L148 I152	V97-L99 HydrophobicContact CG2-CD2 4.44Å; L99-F108 PolarHBondContact N-O 3.48Å; L99-F108 WeakPolarHBondContact O-CB 3.37Å; L99-F108 PolarHBondContact O-N 2.87Å; L99-V110 HydrophobicContact CD1-CG2 3.86Å; L99-V110 HydrophobicContact CG-CG2 3.83Å; L99-M115 HydrophobicContact CD1-CE 3.83Å; L99-F122 HydrophobicContact CD1-CE1 3.9Å; L99-F122 HydrophobicContact CD1-CZ 3.73Å; L99-F122 HydrophobicContact CD2-CE1 4.09Å; L99-I138 HydrophobicContact CD2-CB 4.14Å; L99-L140 HydrophobicContact CB-CD1 4.33Å; L99-L140 HydrophobicContact CD1-CD1 4.24Å; L99-L140 HydrophobicContact CD2-CD1 4.3Å; L99-L148 HydrophobicContact CB-CD2 4.17Å; L99-L148 HydrophobicContact CD1-CD1 4.33Å; L99-I152 HydrophobicContact CD1-CD1 4.44Å
100	M	95.9	Very high	94.4	Very high	39 Å²	39	54.9 Å²	54.9	19%	0.192	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.1	172.2	-60.8	-172.2	-54.9	0	0	109	D106 C137 I138 K139 L140	M100-D106 WeakPolarHBondContact CA-O 3.33Å; M100-C137 WeakPolarHBondContact CE-SG 3.42Å; M100-C137 PolarHBondContact SD-SG 3.28Å; M100-I138 PolarHBondContact N-O 3.47Å; M100-K139 HydrophobicContact CB-CG 4.38Å; M100-K139 HydrophobicContact CE-CB 4.09Å; M100-K139 HydrophobicContact CE-CD 4.29Å; M100-K139 HydrophobicContact CE-CG 4.43Å; M100-K139 WeakPolarHBondContact O-CA 3.37Å; M100-L140 PolarHBondContact O-N 3.38Å
101	P	94.9	Very high	94.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	167.3	175.6	35.5	-36.5	0	0	0	110.1	D103 T104 D106 F108 K139 V143 K145 L148	P101-D103 VanDerWaalsContact CB-OD1 3.31Å; P101-D103 WeakPolarHBondContact CB-OD1 3.38Å; P101-T104 VanDerWaalsContact CG-OG1 3.25Å; P101-T104 WeakPolarHBondContact CG-OG1 3.49Å; P101-D106 WeakPolarHBondContact CD-O 3.48Å; P101-D106 HydrophobicContact CG-CB 4.47Å; P101-F108 HydrophobicContact CG-CE2 4.24Å; P101-K139 WeakPolarHBondContact O-CE 3.45Å; P101-V143 WeakPolarHBondContact CB-O 3.49Å; P101-K145 HydrophobicContact CB-CB 4.38Å; P101-K145 HydrophobicContact CG-CB 4.04Å; P101-L148 HydrophobicContact CB-CD2 4.01Å
102	G	89.4	Confident	94.5	Very high	24 Å²	24	46.1 Å²	46.1	25%	0.247	28%	0.275	C	S	.	.	S	Bend	trans	-76	-27.6	-175.9	0	0	0	0	0	113.6	L140 V143	G102-L140 WeakPolarHBondContact CA-O 3.31Å; G102-L140 PolarHBondContact N-O 3.08Å; G102-L140 VanDerWaalsContact N-O 3.07Å; G102-V143 PolarHBondContact N-O 3.44Å
103	D	90.1	Very high	94.6	Very high	95 Å²	95	48.6 Å²	48.6	51%	0.508	28%	0.28	S	S	.	.	S	Bend	trans	-93.2	-23.6	-170.3	59.3	-17.6	0	0	0	114	P101 S144 K145	P101-D103 VanDerWaalsContact CB-OD1 3.31Å; P101-D103 WeakPolarHBondContact CB-OD1 3.38Å; D103-S144 WeakPolarHBondContact OD2-CA 3.25Å; D103-S144 WeakPolarHBondContact OD2-CB 3.27Å; D103-K145 PolarHBondContact OD1-N 3.1Å; D103-K145 PolarHBondContact OD2-N 3.45Å; D103-K145 VanDerWaalsContact OD2-N 3.12Å
104	T	92.5	Very high	94.7	Very high	43 Å²	43	45.4 Å²	45.4	26%	0.264	26%	0.264	S	S	.	.	S	Bend	trans	-133.8	172.7	177.2	74	0	0	0	0	111.6	P101 D106 K145	P101-T104 VanDerWaalsContact CG-OG1 3.25Å; P101-T104 WeakPolarHBondContact CG-OG1 3.49Å; T104-D106 VanDerWaalsContact CB-OD2 3.27Å; T104-D106 WeakPolarHBondContact CB-OD2 3.24Å; T104-D106 WeakPolarHBondContact OG1-CB 3.21Å; T104-D106 PolarHBondContact OG1-N 3.16Å; T104-D106 PolarHBondContact OG1-OD2 3.33Å; T104-K145 HydrophobicContact CG2-CB 4.43Å; T104-K145 HydrophobicContact CG2-CD 4.46Å
105	D	91	Very high	94.7	Very high	126 Å²	126	38.8 Å²	38.8	67%	0.674	23%	0.229	S	C	*	.			trans	-100.9	25.3	171.9	-64.3	-40.4	0	0	0	111.7	A107 K139	D105-A107 PolarHBondContact O-N 3.22Å; D105-K139 IonicContact OD1-NZ 2.71Å; D105-K139 PolarHBondContact OD1-NZ 2.85Å
106	D	93.6	Very high	94.7	Very high	51 Å²	51	38 Å²	38	27%	0.273	23%	0.225	S	C	.	.			trans	-65	130.9	173.1	-72.1	-88.7	0	0	0	110.6	M100 P101 T104 F108 K145	M100-D106 WeakPolarHBondContact CA-O 3.33Å; P101-D106 WeakPolarHBondContact CD-O 3.48Å; P101-D106 HydrophobicContact CG-CB 4.47Å; T104-D106 VanDerWaalsContact CB-OD2 3.27Å; T104-D106 WeakPolarHBondContact CB-OD2 3.24Å; T104-D106 WeakPolarHBondContact OG1-CB 3.21Å; T104-D106 PolarHBondContact OG1-N 3.16Å; T104-D106 PolarHBondContact OG1-OD2 3.33Å; D106-F108 HydrophobicContact CB-CE2 3.77Å; D106-F108 HydrophobicContact CB-CZ 4.35Å; D106-K145 WeakPolarHBondContact OD1-CE 3.31Å; D106-K145 IonicContact OD1-NZ 2.76Å; D106-K145 PolarHBondContact OD1-NZ 3.41Å; D106-K145 WeakPolarHBondContact OD2-CD 3.21Å; D106-K145 WeakPolarHBondContact OD2-CE 3.37Å; D106-K145 IonicContact OD2-NZ 2.73Å; D106-K145 PolarHBondContact OD2-NZ 2.93Å
107	A	94.5	Very high	94.7	Very high	65 Å²	65	39.2 Å²	39.2	54%	0.537	24%	0.239	S	C	.	.			trans	-95.9	128.2	179.8	0	0	0	0	0	111.3	T98 D105	T98-A107 HydrophobicContact CG2-CB 3.65Å; D105-A107 PolarHBondContact O-N 3.22Å
108	F	96.9	Very high	94.6	Very high	21 Å²	21	41.1 Å²	41.1	9%	0.092	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	95.2	174.5	-63.3	-93.8	0	0	0	110.2	T98 L99 P101 D106 V110 K145 L148 R149 I152	T98-F108 WeakPolarHBondContact CA-O 3.32Å; L99-F108 PolarHBondContact N-O 3.48Å; L99-F108 WeakPolarHBondContact O-CB 3.37Å; L99-F108 PolarHBondContact O-N 2.87Å; P101-F108 HydrophobicContact CG-CE2 4.24Å; D106-F108 HydrophobicContact CB-CE2 3.77Å; D106-F108 HydrophobicContact CB-CZ 4.35Å; F108-V110 PolarHBondContact O-N 3.34Å; F108-K145 HydrophobicContact CE2-CG 4.41Å; F108-K145 HydrophobicContact CZ-CG 4.09Å; F108-L148 HydrophobicContact CD2-CD2 3.93Å; F108-L148 HydrophobicContact CE2-CD2 4.29Å; F108-R149 HydrophobicContact CE1-CB 3.94Å; F108-R149 HydrophobicContact CE1-CG 4.22Å; F108-R149 HydrophobicContact CZ-CB 4.24Å; F108-I152 HydrophobicContact CB-CD1 3.65Å; F108-I152 HydrophobicContact CD1-CD1 4.12Å; F108-I152 HydrophobicContact CG-CD1 4Å
109	P	96.8	Very high	94.6	Very high	56 Å²	56	39.4 Å²	39.4	36%	0.364	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	129.4	172.6	-19.2	32.2	0	0	0	110.6	R89 C95	R89-P109 WeakPolarHBondContact CG-O 3.5Å; C95-P109 HydrophobicContact CB-CB 3.92Å
110	V	97.3	Very high	94.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	172.3	-179.6	-60.4	0	0	0	0	111.3	C95 D96 V97 L99 F108 M115 I152 Y156	C95-V110 WeakPolarHBondContact CA-O 3.27Å; D96-V110 PolarHBondContact N-O 3.37Å; V97-V110 HydrophobicContact CG1-CG2 3.52Å; V97-V110 PolarHBondContact N-O 3.34Å; V97-V110 PolarHBondContact O-N 3.46Å; V97-V110 VanDerWaalsContact O-O 3.06Å; L99-V110 HydrophobicContact CD1-CG2 3.86Å; L99-V110 HydrophobicContact CG-CG2 3.83Å; F108-V110 PolarHBondContact O-N 3.34Å; V110-M115 HydrophobicContact CB-CG 4.21Å; V110-M115 HydrophobicContact CB-SD 4.28Å; V110-M115 HydrophobicContact CG1-SD 4.37Å; V110-M115 HydrophobicContact CG2-CG 3.77Å; V110-M115 HydrophobicContact CG2-SD 4.28Å; V110-I152 HydrophobicContact CG1-CD1 3.86Å; V110-I152 HydrophobicContact CG1-CG1 4.18Å; V110-I152 HydrophobicContact CG1-CG2 3.87Å; V110-Y156 HydrophobicContact CG1-CE2 4.44Å
111	H	96.8	Very high	94.4	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.037	27%	0.272	C	S	.	.			trans	-99	123	175.2	-56	113.8	0	0	0	110	F85 L93 L94 D96 V113 M114 M115 Y156	F85-H111 AromaticContact CD1-ND1 3.95Å; L93-H111 PolarHBondContact O-NE2 2.98Å; L93-H111 VanDerWaalsContact O-NE2 3.12Å; L94-H111 VanDerWaalsContact C-CD2 3.49Å; L94-H111 PolarHBondContact O-CD2 3.07Å; D96-H111 VanDerWaalsContact OD1-CA 3.29Å; D96-H111 WeakPolarHBondContact OD1-CA 3.36Å; H111-V113 HydrophobicContact CB-CG1 4.27Å; H111-V113 PolarHBondContact O-N 3.23Å; H111-M114 HydrophobicContact CB-CB 4.13Å; H111-M114 HydrophobicContact CB-CG 3.98Å; H111-M114 PolarHBondContact O-N 3.36Å; H111-M115 PolarHBondContact O-N 3.32Å; H111-M115 VanDerWaalsContact O-N 3.15Å; H111-Y156 WeakPolarHBondContact CB-OH 3.47Å; H111-Y156 PolarHBondContact N-OH 3.01Å; H111-Y156 AromaticContact ND1-CE1 3.56Å; H111-Y156 AromaticContact ND1-CZ 3.67Å; H111-Y156 PolarHBondContact ND1-OH 3.02Å
112	R	94.9	Very high	94.4	Very high	34 Å²	34	45.3 Å²	45.3	13%	0.128	27%	0.272	C	S	.	.	H	α-helix	trans	-52.7	-42	177.7	-72.6	174.8	172.5	-92.1	-1.8	111.8	D96 V97 M114 M115 A116 F126 E132 Q133 L135	D96-R112 PolarHBondContact O-NE 2.92Å; D96-R112 WeakPolarHBondContact OD1-CG 3.34Å; D96-R112 PolarHBondContact OD1-N 3.48Å; D96-R112 WeakPolarHBondContact OD2-CB 3.45Å; V97-R112 HydrophobicContact CB-CG 3.78Å; V97-R112 HydrophobicContact CG1-CG 3.55Å; R112-M114 VanDerWaalsContact C-N 3.35Å; R112-M114 PolarHBondContact O-N 3.49Å; R112-M115 PolarHBondContact O-N 2.94Å; R112-A116 WeakPolarHBondContact O-CB 3.47Å; R112-A116 PolarHBondContact O-N 3.4Å; R112-F126 HydrophobicContact CB-CD2 3.71Å; R112-F126 HydrophobicContact CB-CE2 3.92Å; R112-F126 HydrophobicContact CB-CG 4.41Å; R112-F126 HydrophobicContact CG-CD2 3.93Å; R112-F126 HydrophobicContact CG-CE2 3.92Å; R112-F126 HydrophobicContact CG-CG 4.32Å; R112-F126 HydrophobicContact CG-CZ 4.31Å; R112-E132 PolarHBondContact NH2-O 2.9Å; R112-Q133 PolarHBondContact NH1-O 3.34Å; R112-Q133 PolarHBondContact NH2-O 3.31Å; R112-L135 PolarHBondContact NH2-O 2.76Å
113	V	94.4	Very high	94.7	Very high	95 Å²	95	49.4 Å²	49.4	58%	0.576	28%	0.283	S	S	*	.	H	α-helix	trans	-64	-37.4	-179.3	69.8	0	0	0	0	112.7	H111 S117	H111-V113 HydrophobicContact CB-CG1 4.27Å; H111-V113 PolarHBondContact O-N 3.23Å; V113-S117 VanDerWaalsContact O-CB 3.27Å; V113-S117 WeakPolarHBondContact O-CB 3.21Å; V113-S117 PolarHBondContact O-N 2.94Å; V113-S117 PolarHBondContact O-OG 3.04Å
114	M	95.6	Very high	94.8	Very high	19 Å²	19	47.6 Å²	47.6	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-70.8	-42.4	177.7	-72.8	-60.3	-64.7	0	0	111.2	L82 F85 H111 R112 S117 A118 I155 Y156	L82-M114 HydrophobicContact CD2-CE 3.92Å; F85-M114 HydrophobicContact CB-CE 4.44Å; F85-M114 HydrophobicContact CB-SD 4.36Å; F85-M114 HydrophobicContact CD1-CG 4.06Å; F85-M114 HydrophobicContact CD1-SD 4.22Å; F85-M114 HydrophobicContact CD2-SD 3.84Å; F85-M114 HydrophobicContact CE1-CG 4.44Å; F85-M114 HydrophobicContact CE1-SD 4.49Å; F85-M114 HydrophobicContact CE2-SD 4.14Å; F85-M114 HydrophobicContact CG-CG 4.2Å; F85-M114 HydrophobicContact CG-SD 3.89Å; F85-M114 HydrophobicContact CZ-SD 4.46Å; H111-M114 HydrophobicContact CB-CB 4.13Å; H111-M114 HydrophobicContact CB-CG 3.98Å; H111-M114 PolarHBondContact O-N 3.36Å; R112-M114 VanDerWaalsContact C-N 3.35Å; R112-M114 PolarHBondContact O-N 3.49Å; M114-S117 PolarHBondContact O-OG 3.35Å; M114-A118 PolarHBondContact O-N 3.02Å; M114-I155 HydrophobicContact CB-CG2 4.26Å; M114-I155 HydrophobicContact CE-CG2 4.3Å; M114-Y156 HydrophobicContact CB-CE1 4.41Å; M114-Y156 HydrophobicContact CB-CE2 4.25Å; M114-Y156 HydrophobicContact CG-CE1 4.05Å
115	M	96.1	Very high	94.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-43.1	177.9	-56.9	-56	-65.1	0	0	111.2	L99 V110 H111 R112 S117 A118 S119 F122 F126 I152 I155 Y156	L99-M115 HydrophobicContact CD1-CE 3.83Å; V110-M115 HydrophobicContact CB-CG 4.21Å; V110-M115 HydrophobicContact CB-SD 4.28Å; V110-M115 HydrophobicContact CG1-SD 4.37Å; V110-M115 HydrophobicContact CG2-CG 3.77Å; V110-M115 HydrophobicContact CG2-SD 4.28Å; H111-M115 PolarHBondContact O-N 3.32Å; H111-M115 VanDerWaalsContact O-N 3.15Å; R112-M115 PolarHBondContact O-N 2.94Å; M115-S117 PolarHBondContact O-N 3.42Å; M115-A118 PolarHBondContact O-N 3.21Å; M115-S119 VanDerWaalsContact O-CB 3.26Å; M115-S119 WeakPolarHBondContact O-CB 3.36Å; M115-S119 PolarHBondContact O-N 3Å; M115-F122 HydrophobicContact CB-CB 3.94Å; M115-F122 HydrophobicContact CB-CD1 4.47Å; M115-F122 HydrophobicContact CB-CD2 3.78Å; M115-F122 HydrophobicContact CB-CE2 4.41Å; M115-F122 HydrophobicContact CB-CG 3.82Å; M115-F122 HydrophobicContact CE-CD2 3.7Å; M115-F122 HydrophobicContact CE-CE2 3.2Å; M115-F122 HydrophobicContact CE-CZ 3.71Å; M115-F126 HydrophobicContact CB-CE2 4Å; M115-I152 HydrophobicContact CE-CG1 4.12Å; M115-I152 HydrophobicContact SD-CG1 4.44Å; M115-I155 HydrophobicContact CE-CD1 3.46Å; M115-I155 VanDerWaalsContact CE-CD1 3.46Å; M115-I155 HydrophobicContact SD-CD1 3.69Å; M115-I155 HydrophobicContact SD-CG2 4.35Å; M115-Y156 HydrophobicContact SD-CE2 4.45Å
116	A	95.1	Very high	94.9	Very high	18 Å²	18	41 Å²	41	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-69.8	-27.3	179	0	0	0	0	0	113.8	R112 K123 F126	R112-A116 WeakPolarHBondContact O-CB 3.47Å; R112-A116 PolarHBondContact O-N 3.4Å; A116-K123 HydrophobicContact CB-CB 4.16Å; A116-K123 WeakPolarHBondContact O-CB 3.48Å; A116-F126 HydrophobicContact CB-CD2 4.21Å
117	S	94.4	Very high	94.7	Very high	91 Å²	91	43.4 Å²	43.4	64%	0.636	26%	0.26	S	S	*	.	H	α-helix	trans	-74.5	-31.1	175.1	67.5	0	0	0	0	112.2	V113 M114 M115	V113-S117 VanDerWaalsContact O-CB 3.27Å; V113-S117 WeakPolarHBondContact O-CB 3.21Å; V113-S117 PolarHBondContact O-N 2.94Å; V113-S117 PolarHBondContact O-OG 3.04Å; M114-S117 PolarHBondContact O-OG 3.35Å; M115-S117 PolarHBondContact O-N 3.42Å
118	A	94.3	Very high	94	Very high	41 Å²	41	42.8 Å²	42.8	34%	0.339	26%	0.26	S	S	.	.	H	α-helix	trans	-94.9	-12.8	-177.9	0	0	0	0	0	114.5	M114 M115 I155 I179	M114-A118 PolarHBondContact O-N 3.02Å; M115-A118 PolarHBondContact O-N 3.21Å; A118-I155 HydrophobicContact CB-CB 4.43Å; A118-I155 HydrophobicContact CB-CD1 4.03Å; A118-I155 HydrophobicContact CB-CG1 3.73Å; A118-I155 HydrophobicContact CB-CG2 3.99Å; A118-I179 WeakPolarHBondContact O-CD1 3.32Å
119	S	96.4	Very high	93.2	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.014	29%	0.287	C	S	.	.			trans	-142.3	122.6	-172.9	174.8	0	0	0	0	112.3	M115 Y121 F122 K123 L177	M115-S119 VanDerWaalsContact O-CB 3.26Å; M115-S119 WeakPolarHBondContact O-CB 3.36Å; M115-S119 PolarHBondContact O-N 3Å; S119-Y121 PolarHBondContact O-N 3.21Å; S119-Y121 WeakPolarHBondContact OG-CB 3.1Å; S119-Y121 PolarHBondContact OG-N 3.23Å; S119-F122 PolarHBondContact O-N 3.38Å; S119-F122 WeakPolarHBondContact OG-CD2 3.44Å; S119-F122 PolarHBondContact OG-N 3.48Å; S119-F122 VanDerWaalsContact OG-N 3.16Å; S119-K123 WeakPolarHBondContact O-CB 3.26Å; S119-K123 PolarHBondContact O-N 2.75Å; S119-L177 PolarHBondContact OG-O 2.92Å
120	D	93.8	Very high	92.4	Very high	102 Å²	102	47.2 Å²	47.2	55%	0.545	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-29.1	171.5	-74.8	-34.9	0	0	0	112.4	A124	D120-A124 VanDerWaalsContact O-CB 3.32Å; D120-A124 WeakPolarHBondContact O-CB 3.41Å; D120-A124 PolarHBondContact O-N 3.15Å
121	Y	94.3	Very high	91.6	Very high	61 Å²	61	55 Å²	55	24%	0.239	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-51.9	174.6	175.7	-93.8	0	0	0	111.1	S119 A124 M125 L140 F176 L177	S119-Y121 PolarHBondContact O-N 3.21Å; S119-Y121 WeakPolarHBondContact OG-CB 3.1Å; S119-Y121 PolarHBondContact OG-N 3.23Å; Y121-A124 PolarHBondContact O-N 3.02Å; Y121-M125 HydrophobicContact CD1-CE 4.24Å; Y121-M125 HydrophobicContact CE1-CE 3.26Å; Y121-M125 HydrophobicContact CE1-SD 4.49Å; Y121-M125 HydrophobicContact CE2-CE 4.45Å; Y121-M125 WeakPolarHBondContact O-CB 3.48Å; Y121-M125 PolarHBondContact O-N 3.12Å; Y121-M125 WeakPolarHBondContact OH-CE 3.4Å; Y121-L140 HydrophobicContact CE1-CD2 4.19Å; Y121-F176 HydrophobicContact CE1-CE1 4.16Å; Y121-F176 HydrophobicContact CE2-CE1 4.17Å; Y121-F176 HydrophobicContact CE2-CZ 4.45Å; Y121-F176 AromaticContact CZ-CE1 3.7Å; Y121-L177 HydrophobicContact CD1-CD2 3.6Å; Y121-L177 HydrophobicContact CE1-CD2 3.68Å; Y121-L177 HydrophobicContact CG-CD2 4.46Å
122	F	95.2	Very high	91	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-68.1	-36.3	177.4	-71.8	-60.3	0	0	0	112.1	L99 M115 S119 A124 M125 F126 L140 L177	L99-F122 HydrophobicContact CD1-CE1 3.9Å; L99-F122 HydrophobicContact CD1-CZ 3.73Å; L99-F122 HydrophobicContact CD2-CE1 4.09Å; M115-F122 HydrophobicContact CB-CB 3.94Å; M115-F122 HydrophobicContact CB-CD1 4.47Å; M115-F122 HydrophobicContact CB-CD2 3.78Å; M115-F122 HydrophobicContact CB-CE2 4.41Å; M115-F122 HydrophobicContact CB-CG 3.82Å; M115-F122 HydrophobicContact CE-CD2 3.7Å; M115-F122 HydrophobicContact CE-CE2 3.2Å; M115-F122 HydrophobicContact CE-CZ 3.71Å; S119-F122 PolarHBondContact O-N 3.38Å; S119-F122 WeakPolarHBondContact OG-CD2 3.44Å; S119-F122 PolarHBondContact OG-N 3.48Å; S119-F122 VanDerWaalsContact OG-N 3.16Å; F122-A124 PolarHBondContact O-N 2.89Å; F122-M125 HydrophobicContact CD1-SD 4.27Å; F122-M125 PolarHBondContact O-N 3.01Å; F122-F126 HydrophobicContact CB-CD2 4.25Å; F122-F126 HydrophobicContact CB-CE2 3.89Å; F122-F126 HydrophobicContact CB-CZ 4.32Å; F122-F126 HydrophobicContact CD1-CE1 4.28Å; F122-F126 HydrophobicContact CD1-CE2 4.07Å; F122-F126 AromaticContact CD1-CZ 3.66Å; F122-F126 HydrophobicContact CD1-CZ 3.66Å; F122-F126 HydrophobicContact CE1-CZ 4.4Å; F122-F126 HydrophobicContact CG-CE2 4.28Å; F122-F126 HydrophobicContact CG-CZ 4.33Å; F122-F126 WeakPolarHBondContact O-CB 3.45Å; F122-F126 WeakPolarHBondContact O-CD2 3.42Å; F122-F126 VanDerWaalsContact O-CG 3.24Å; F122-F126 WeakPolarHBondContact O-CG 3.39Å; F122-F126 PolarHBondContact O-N 2.6Å; F122-L140 HydrophobicContact CE1-CD1 4.12Å; F122-L140 HydrophobicContact CE1-CD2 4.28Å; F122-L140 HydrophobicContact CZ-CD1 3.93Å; F122-L177 HydrophobicContact CE1-CD2 4.23Å; F122-L177 HydrophobicContact CE2-CB 4.3Å; F122-L177 HydrophobicContact CE2-CD1 3.98Å; F122-L177 HydrophobicContact CE2-CD2 3.76Å; F122-L177 HydrophobicContact CE2-CG 4.23Å; F122-L177 HydrophobicContact CZ-CD1 4.06Å; F122-L177 HydrophobicContact CZ-CD2 3.52Å; F122-L177 HydrophobicContact CZ-CG 4.34Å
123	K	94.2	Very high	90.5	Very high	110 Å²	110	59.2 Å²	59.2	48%	0.478	35%	0.35	S	S	.	.	H	α-helix	trans	-57	-50.5	173.9	-170.3	174.9	178.5	179.1	0	111.2	A116 S119 F126 T127	A116-K123 HydrophobicContact CB-CB 4.16Å; A116-K123 WeakPolarHBondContact O-CB 3.48Å; S119-K123 WeakPolarHBondContact O-CB 3.26Å; S119-K123 PolarHBondContact O-N 2.75Å; K123-F126 PolarHBondContact O-N 3.33Å; K123-T127 WeakPolarHBondContact O-CB 3.43Å; K123-T127 PolarHBondContact O-N 3.35Å; K123-T127 PolarHBondContact O-OG1 2.95Å
124	A	92.4	Very high	90.1	Very high	57 Å²	57	61.2 Å²	61.2	47%	0.471	36%	0.357	S	S	.	.	H	α-helix	trans	-63.9	-41.6	176.7	0	0	0	0	0	112	D120 Y121 F122 F126 G128	D120-A124 VanDerWaalsContact O-CB 3.32Å; D120-A124 WeakPolarHBondContact O-CB 3.41Å; D120-A124 PolarHBondContact O-N 3.15Å; Y121-A124 PolarHBondContact O-N 3.02Å; F122-A124 PolarHBondContact O-N 2.89Å; A124-F126 PolarHBondContact O-N 3.42Å; A124-G128 WeakPolarHBondContact O-CA 3.35Å; A124-G128 PolarHBondContact O-N 3.42Å
125	M	92.1	Very high	89.9	Confident	16 Å²	16	63.5 Å²	63.5	8%	0.079	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-42.2	178.3	-177.1	-177.3	-75.1	0	0	112.6	Y121 F122 E132 I138 L140	Y121-M125 HydrophobicContact CD1-CE 4.24Å; Y121-M125 HydrophobicContact CE1-CE 3.26Å; Y121-M125 HydrophobicContact CE1-SD 4.49Å; Y121-M125 HydrophobicContact CE2-CE 4.45Å; Y121-M125 WeakPolarHBondContact O-CB 3.48Å; Y121-M125 PolarHBondContact O-N 3.12Å; Y121-M125 WeakPolarHBondContact OH-CE 3.4Å; F122-M125 HydrophobicContact CD1-SD 4.27Å; F122-M125 PolarHBondContact O-N 3.01Å; M125-E132 HydrophobicContact CG-CB 3.64Å; M125-E132 HydrophobicContact CG-CG 4.33Å; M125-E132 HydrophobicContact SD-CB 4.02Å; M125-E132 HydrophobicContact SD-CG 4.37Å; M125-I138 HydrophobicContact SD-CD1 4.08Å; M125-I138 HydrophobicContact SD-CG2 4.05Å; M125-L140 HydrophobicContact CE-CD2 4.1Å
126	F	93.2	Very high	89.5	Confident	15 Å²	15	70 Å²	70	7%	0.066	40%	0.402	C	S	.	.	H	α-helix	trans	-90.1	-17.7	-173.7	-58.3	-22.8	0	0	0	114.1	V97 R112 M115 A116 F122 K123 A124 Q133 I138	V97-F126 HydrophobicContact CG1-CZ 4.36Å; R112-F126 HydrophobicContact CB-CD2 3.71Å; R112-F126 HydrophobicContact CB-CE2 3.92Å; R112-F126 HydrophobicContact CB-CG 4.41Å; R112-F126 HydrophobicContact CG-CD2 3.93Å; R112-F126 HydrophobicContact CG-CE2 3.92Å; R112-F126 HydrophobicContact CG-CG 4.32Å; R112-F126 HydrophobicContact CG-CZ 4.31Å; M115-F126 HydrophobicContact CB-CE2 4Å; A116-F126 HydrophobicContact CB-CD2 4.21Å; F122-F126 HydrophobicContact CB-CD2 4.25Å; F122-F126 HydrophobicContact CB-CE2 3.89Å; F122-F126 HydrophobicContact CB-CZ 4.32Å; F122-F126 HydrophobicContact CD1-CE1 4.28Å; F122-F126 HydrophobicContact CD1-CE2 4.07Å; F122-F126 AromaticContact CD1-CZ 3.66Å; F122-F126 HydrophobicContact CD1-CZ 3.66Å; F122-F126 HydrophobicContact CE1-CZ 4.4Å; F122-F126 HydrophobicContact CG-CE2 4.28Å; F122-F126 HydrophobicContact CG-CZ 4.33Å; F122-F126 WeakPolarHBondContact O-CB 3.45Å; F122-F126 WeakPolarHBondContact O-CD2 3.42Å; F122-F126 VanDerWaalsContact O-CG 3.24Å; F122-F126 WeakPolarHBondContact O-CG 3.39Å; F122-F126 PolarHBondContact O-N 2.6Å; K123-F126 PolarHBondContact O-N 3.33Å; A124-F126 PolarHBondContact O-N 3.42Å; F126-Q133 WeakPolarHBondContact O-CG 3.31Å; F126-I138 HydrophobicContact CD1-CD1 4.45Å; F126-I138 HydrophobicContact CE1-CD1 3.61Å; F126-I138 HydrophobicContact CZ-CD1 4.43Å
127	T	89.5	Confident	89.4	Confident	100 Å²	100	72 Å²	72	61%	0.613	41%	0.413	S	S	*	.	H	α-helix	trans	-120.1	-7.3	-177.2	67.9	0	0	0	0	113.9	K123	K123-T127 WeakPolarHBondContact O-CB 3.43Å; K123-T127 PolarHBondContact O-N 3.35Å; K123-T127 PolarHBondContact O-OG1 2.95Å
128	G	81.2	Confident	89.4	Confident	53 Å²	53	67.9 Å²	67.9	55%	0.546	39%	0.385	S	S	.	.	S	Bend	trans	-91.3	10.6	-172.3	0	0	0	0	0	116	A124 M130	A124-G128 WeakPolarHBondContact O-CA 3.35Å; A124-G128 PolarHBondContact O-N 3.42Å; G128-M130 VanDerWaalsContact C-N 3.28Å; G128-M130 PolarHBondContact O-N 3.34Å
129	G	78.4	Confident	89.4	Confident	64 Å²	64	69.4 Å²	69.4	66%	0.66	38%	0.383	S	S	*	.			trans	70.7	22.5	-178	0	0	0	0	0	114.1	Q133	G129-Q133 VanDerWaalsContact CA-OE1 3.27Å
130	M	80.9	Confident	89.2	Confident	106 Å²	106	69.4 Å²	69.4	52%	0.522	38%	0.383	S	S	.	.			trans	-76.8	155.9	175.2	-62	-71.3	-78.9	0	0	109.8	G128 E132 Q133	G128-M130 VanDerWaalsContact C-N 3.28Å; G128-M130 PolarHBondContact O-N 3.34Å; M130-E132 WeakPolarHBondContact CB-OE2 3.49Å; M130-E132 PolarHBondContact O-N 2.59Å; M130-E132 VanDerWaalsContact O-N 3.15Å; M130-Q133 WeakPolarHBondContact O-CB 3.34Å; M130-Q133 PolarHBondContact O-N 2.9Å
131	K	80.5	Confident	89	Confident	163 Å²	163	71 Å²	71	71%	0.709	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-58.3	-33.6	-178.3	-174.3	-179.7	177.7	-176.1	0	111.9	Q133 D134	K131-Q133 PolarHBondContact O-N 2.85Å; K131-D134 PolarHBondContact O-N 3.45Å
132	E	83.9	Confident	88.5	Confident	61 Å²	61	70.1 Å²	70.1	29%	0.285	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-63.8	-18.7	178.7	-65	78.3	-174.7	0	0	113.4	R112 M125 M130 D134 L135 I138	R112-E132 PolarHBondContact NH2-O 2.9Å; M125-E132 HydrophobicContact CG-CB 3.64Å; M125-E132 HydrophobicContact CG-CG 4.33Å; M125-E132 HydrophobicContact SD-CB 4.02Å; M125-E132 HydrophobicContact SD-CG 4.37Å; M130-E132 WeakPolarHBondContact CB-OE2 3.49Å; M130-E132 PolarHBondContact O-N 2.59Å; M130-E132 VanDerWaalsContact O-N 3.15Å; E132-D134 PolarHBondContact O-N 3.06Å; E132-L135 HydrophobicContact CG-CD1 4.48Å; E132-L135 PolarHBondContact O-N 2.73Å; E132-I138 HydrophobicContact CB-CD1 4.06Å; E132-I138 HydrophobicContact CB-CG1 4.39Å; E132-I138 HydrophobicContact CG-CG2 4.18Å; E132-I138 WeakPolarHBondContact O-CD1 3.33Å
133	Q	85.1	Confident	88.4	Confident	70 Å²	70	70.3 Å²	70.3	33%	0.327	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-57.1	-39.6	174.7	178.3	170.5	-25.1	0	0	111.8	R112 F126 G129 M130 K131	R112-Q133 PolarHBondContact NH1-O 3.34Å; R112-Q133 PolarHBondContact NH2-O 3.31Å; F126-Q133 WeakPolarHBondContact O-CG 3.31Å; G129-Q133 VanDerWaalsContact CA-OE1 3.27Å; M130-Q133 WeakPolarHBondContact O-CB 3.34Å; M130-Q133 PolarHBondContact O-N 2.9Å; K131-Q133 PolarHBondContact O-N 2.85Å
134	D	86.1	Confident	88.5	Confident	136 Å²	136	65.8 Å²	65.8	73%	0.727	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-98.5	-1.5	-175.9	-56.6	-45	0	0	0	113.3	K131 E132	K131-D134 PolarHBondContact O-N 3.45Å; E132-D134 PolarHBondContact O-N 3.06Å
135	L	89.9	Confident	88.7	Confident	67 Å²	67	66 Å²	66	35%	0.351	37%	0.371	S	S	.	.			trans	-86.2	127.6	-177.8	-66.3	-179.6	0	0	0	111.8	R112 E132 C137 I138	R112-L135 PolarHBondContact NH2-O 2.76Å; E132-L135 HydrophobicContact CG-CD1 4.48Å; E132-L135 PolarHBondContact O-N 2.73Å; L135-C137 VanDerWaalsContact C-N 3.28Å; L135-C137 PolarHBondContact O-N 2.96Å; L135-I138 HydrophobicContact CB-CG1 4.1Å
136	M	89.4	Confident	88.9	Confident	138 Å²	138	68.2 Å²	68.2	68%	0.68	39%	0.385	S	S	*	.	S	Bend	trans	-73.3	-20.8	172.4	-70.3	-60.1	173.1	0	0	113.4	T98	T98-M136 PolarHBondContact N-O 3.27Å
137	C	93	Very high	89	Confident	58 Å²	58	67.5 Å²	67.5	39%	0.392	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	122.1	-179.8	-168.6	0	0	0	0	110.2	T98 M100 L135	T98-C137 WeakPolarHBondContact O-CA 3.22Å; M100-C137 WeakPolarHBondContact CE-SG 3.42Å; M100-C137 PolarHBondContact SD-SG 3.28Å; L135-C137 VanDerWaalsContact C-N 3.28Å; L135-C137 PolarHBondContact O-N 2.96Å
138	I	93.9	Very high	89.3	Confident	6 Å²	6	62.8 Å²	62.8	3%	0.031	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.3	-173.2	-58.1	171.1	0	0	0	109.1	V97 T98 L99 M100 M125 F126 E132 L135 L140	V97-I138 HydrophobicContact CG2-CD1 3.63Å; V97-I138 HydrophobicContact CG2-CG1 4.1Å; T98-I138 PolarHBondContact O-N 3.32Å; L99-I138 HydrophobicContact CD2-CB 4.14Å; M100-I138 PolarHBondContact N-O 3.47Å; M125-I138 HydrophobicContact SD-CD1 4.08Å; M125-I138 HydrophobicContact SD-CG2 4.05Å; F126-I138 HydrophobicContact CD1-CD1 4.45Å; F126-I138 HydrophobicContact CE1-CD1 3.61Å; F126-I138 HydrophobicContact CZ-CD1 4.43Å; E132-I138 HydrophobicContact CB-CD1 4.06Å; E132-I138 HydrophobicContact CB-CG1 4.39Å; E132-I138 HydrophobicContact CG-CG2 4.18Å; E132-I138 WeakPolarHBondContact O-CD1 3.33Å; L135-I138 HydrophobicContact CB-CG1 4.1Å; I138-L140 HydrophobicContact CG2-CD2 4.17Å
139	K	93.3	Very high	90.1	Very high	72 Å²	72	65.8 Å²	65.8	31%	0.313	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	120.2	175.2	-163.3	159.8	-170.3	160.6	0	110.5	M100 P101 D105 H141	M100-K139 HydrophobicContact CB-CG 4.38Å; M100-K139 HydrophobicContact CE-CB 4.09Å; M100-K139 HydrophobicContact CE-CD 4.29Å; M100-K139 HydrophobicContact CE-CG 4.43Å; M100-K139 WeakPolarHBondContact O-CA 3.37Å; P101-K139 WeakPolarHBondContact O-CE 3.45Å; D105-K139 IonicContact OD1-NZ 2.71Å; D105-K139 PolarHBondContact OD1-NZ 2.85Å; K139-H141 PolarHBondContact O-N 3.4Å
140	L	93.4	Very high	90.9	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	84.6	-178.3	-63.8	175.3	0	0	0	110.1	L99 M100 G102 Y121 F122 M125 I138 G142 V143 L148 L177	L99-L140 HydrophobicContact CB-CD1 4.33Å; L99-L140 HydrophobicContact CD1-CD1 4.24Å; L99-L140 HydrophobicContact CD2-CD1 4.3Å; M100-L140 PolarHBondContact O-N 3.38Å; G102-L140 WeakPolarHBondContact CA-O 3.31Å; G102-L140 PolarHBondContact N-O 3.08Å; G102-L140 VanDerWaalsContact N-O 3.07Å; Y121-L140 HydrophobicContact CE1-CD2 4.19Å; F122-L140 HydrophobicContact CE1-CD1 4.12Å; F122-L140 HydrophobicContact CE1-CD2 4.28Å; F122-L140 HydrophobicContact CZ-CD1 3.93Å; M125-L140 HydrophobicContact CE-CD2 4.1Å; I138-L140 HydrophobicContact CG2-CD2 4.17Å; L140-G142 PolarHBondContact O-N 3.27Å; L140-V143 HydrophobicContact CB-CB 4.3Å; L140-V143 HydrophobicContact CB-CG2 4.26Å; L140-V143 PolarHBondContact O-N 2.95Å; L140-L148 HydrophobicContact CD1-CD1 3.8Å; L140-L148 HydrophobicContact CD1-CD2 4.32Å; L140-L177 HydrophobicContact CD1-CD2 4.34Å
141	H	88.4	Confident	91.7	Very high	135 Å²	135	59.9 Å²	59.9	63%	0.625	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	124.7	174.8	-64	-64.5	0	0	0	110.8	K139 F176	K139-H141 PolarHBondContact O-N 3.4Å; H141-F176 WeakPolarHBondContact O-CZ 3.27Å
142	G	84.5	Confident	92.5	Very high	43 Å²	43	52.1 Å²	52.1	44%	0.443	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.5	7.6	-177.1	0	0	0	0	0	114.9	L140	L140-G142 PolarHBondContact O-N 3.27Å
143	V	93.8	Very high	93	Very high	4 Å²	4	52 Å²	52	2%	0.024	27%	0.268	C	S	.	.			trans	-122.9	126.4	171.7	-172.7	0	0	0	0	109.1	P101 G102 L140 L148 A173 F176 L177	P101-V143 WeakPolarHBondContact CB-O 3.49Å; G102-V143 PolarHBondContact N-O 3.44Å; L140-V143 HydrophobicContact CB-CB 4.3Å; L140-V143 HydrophobicContact CB-CG2 4.26Å; L140-V143 PolarHBondContact O-N 2.95Å; V143-L148 HydrophobicContact CG1-CB 3.81Å; V143-A173 HydrophobicContact CG1-CB 3.68Å; V143-F176 HydrophobicContact CG2-CB 4.29Å; V143-F176 HydrophobicContact CG2-CD1 3.38Å; V143-F176 HydrophobicContact CG2-CE1 3.86Å; V143-F176 HydrophobicContact CG2-CG 3.93Å; V143-L177 HydrophobicContact CG2-CD2 4.45Å; V143-L177 HydrophobicContact CG2-CG 4.37Å
144	S	95.6	Very high	93.6	Very high	16 Å²	16	49.9 Å²	49.9	11%	0.112	26%	0.258	C	S	.	.			trans	-76.4	159.4	177.4	70.3	0	0	0	0	112.1	D103 V146 G147 L148 D169	D103-S144 WeakPolarHBondContact OD2-CA 3.25Å; D103-S144 WeakPolarHBondContact OD2-CB 3.27Å; S144-V146 VanDerWaalsContact C-N 3.27Å; S144-V146 PolarHBondContact O-N 3.14Å; S144-G147 PolarHBondContact O-N 3.3Å; S144-G147 PolarHBondContact OG-N 2.71Å; S144-L148 WeakPolarHBondContact O-CB 3.37Å; S144-L148 PolarHBondContact O-N 3.31Å; S144-D169 WeakPolarHBondContact CB-OD1 3.38Å; S144-D169 WeakPolarHBondContact OG-CB 3.19Å; S144-D169 VanDerWaalsContact OG-CG 3.25Å; S144-D169 PolarHBondContact OG-OD1 3.43Å
145	K	96.3	Very high	94.1	Very high	62 Å²	62	43.9 Å²	43.9	27%	0.27	23%	0.226	S	C	.	.	H	α-helix	trans	-53.3	-44.1	174.4	-179.9	-170.5	-174.6	153.3	0	112.5	P101 D103 T104 D106 F108 R149	P101-K145 HydrophobicContact CB-CB 4.38Å; P101-K145 HydrophobicContact CG-CB 4.04Å; D103-K145 PolarHBondContact OD1-N 3.1Å; D103-K145 PolarHBondContact OD2-N 3.45Å; D103-K145 VanDerWaalsContact OD2-N 3.12Å; T104-K145 HydrophobicContact CG2-CB 4.43Å; T104-K145 HydrophobicContact CG2-CD 4.46Å; D106-K145 WeakPolarHBondContact OD1-CE 3.31Å; D106-K145 IonicContact OD1-NZ 2.76Å; D106-K145 PolarHBondContact OD1-NZ 3.41Å; D106-K145 WeakPolarHBondContact OD2-CD 3.21Å; D106-K145 WeakPolarHBondContact OD2-CE 3.37Å; D106-K145 IonicContact OD2-NZ 2.73Å; D106-K145 PolarHBondContact OD2-NZ 2.93Å; F108-K145 HydrophobicContact CE2-CG 4.41Å; F108-K145 HydrophobicContact CZ-CG 4.09Å; K145-R149 WeakPolarHBondContact O-CB 3.27Å; K145-R149 PolarHBondContact O-N 3.01Å
146	V	95.9	Very high	94.4	Very high	62 Å²	62	40.8 Å²	40.8	38%	0.376	21%	0.209	S	C	.	.	H	α-helix	trans	-66.5	-49.1	-177.4	178.2	0	0	0	0	110.1	S144 R149 K150 N166 D169	S144-V146 VanDerWaalsContact C-N 3.27Å; S144-V146 PolarHBondContact O-N 3.14Å; V146-R149 PolarHBondContact O-N 2.93Å; V146-K150 WeakPolarHBondContact O-CG 3.34Å; V146-K150 PolarHBondContact O-N 3.43Å; V146-K150 VanDerWaalsContact O-N 3.08Å; V146-N166 HydrophobicContact CG1-CB 4.15Å; V146-D169 HydrophobicContact CB-CB 4.06Å; V146-D169 HydrophobicContact CG1-CB 4.12Å
147	G	95.9	Very high	94.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-48.5	178.8	0	0	0	0	0	111.9	S144 R149 K150 I151 D169	S144-G147 PolarHBondContact O-N 3.3Å; S144-G147 PolarHBondContact OG-N 2.71Å; G147-R149 PolarHBondContact O-N 2.91Å; G147-K150 PolarHBondContact O-N 3.44Å; G147-I151 WeakPolarHBondContact O-CG1 3.12Å; G147-I151 PolarHBondContact O-N 2.95Å; G147-D169 WeakPolarHBondContact CA-O 3.42Å
148	L	96.8	Very high	94.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.4	-45.2	179.2	-176.6	58.1	0	0	0	111.9	L99 P101 F108 L140 V143 S144 K150 I151 I152 L177	L99-L148 HydrophobicContact CB-CD2 4.17Å; L99-L148 HydrophobicContact CD1-CD1 4.33Å; P101-L148 HydrophobicContact CB-CD2 4.01Å; F108-L148 HydrophobicContact CD2-CD2 3.93Å; F108-L148 HydrophobicContact CE2-CD2 4.29Å; L140-L148 HydrophobicContact CD1-CD1 3.8Å; L140-L148 HydrophobicContact CD1-CD2 4.32Å; V143-L148 HydrophobicContact CG1-CB 3.81Å; S144-L148 WeakPolarHBondContact O-CB 3.37Å; S144-L148 PolarHBondContact O-N 3.31Å; L148-K150 PolarHBondContact O-N 3.26Å; L148-I151 PolarHBondContact O-N 3.42Å; L148-I152 HydrophobicContact CD1-CD1 3.93Å; L148-I152 HydrophobicContact CD1-CG1 4.22Å; L148-I152 HydrophobicContact CG-CD1 3.84Å; L148-I152 WeakPolarHBondContact O-CG1 3.41Å; L148-I152 PolarHBondContact O-N 3.33Å; L148-L177 HydrophobicContact CD1-CD1 4.24Å
149	R	96.4	Very high	94.7	Very high	117 Å²	117	44.1 Å²	44.1	44%	0.442	23%	0.229	S	C	.	.	H	α-helix	trans	-58.6	-48	177	-178.3	176	-64.4	-170.6	-5.9	111.5	F108 K145 V146 G147 I151 I152 D153	F108-R149 HydrophobicContact CE1-CB 3.94Å; F108-R149 HydrophobicContact CE1-CG 4.22Å; F108-R149 HydrophobicContact CZ-CB 4.24Å; K145-R149 WeakPolarHBondContact O-CB 3.27Å; K145-R149 PolarHBondContact O-N 3.01Å; V146-R149 PolarHBondContact O-N 2.93Å; G147-R149 PolarHBondContact O-N 2.91Å; R149-I151 VanDerWaalsContact C-N 3.32Å; R149-I151 PolarHBondContact O-N 2.96Å; R149-I152 PolarHBondContact O-N 2.93Å; R149-D153 WeakPolarHBondContact CG-OD2 3.4Å; R149-D153 WeakPolarHBondContact O-CB 3.18Å; R149-D153 VanDerWaalsContact O-CG 3.22Å; R149-D153 PolarHBondContact O-N 3.27Å
150	K	97.1	Very high	94.8	Very high	45 Å²	45	42.7 Å²	42.7	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-39.9	179.3	-71.6	-73.6	-178	170	0	112.5	V146 G147 L148 F154 L160 S161 T170	V146-K150 WeakPolarHBondContact O-CG 3.34Å; V146-K150 PolarHBondContact O-N 3.43Å; V146-K150 VanDerWaalsContact O-N 3.08Å; G147-K150 PolarHBondContact O-N 3.44Å; L148-K150 PolarHBondContact O-N 3.26Å; K150-F154 VanDerWaalsContact O-CB 3.31Å; K150-F154 WeakPolarHBondContact O-CB 3.34Å; K150-F154 PolarHBondContact O-N 3.18Å; K150-L160 HydrophobicContact CB-CD1 4.26Å; K150-L160 HydrophobicContact CD-CD1 4.41Å; K150-S161 PolarHBondContact NZ-O 3.39Å; K150-T170 HydrophobicContact CB-CG2 4.24Å
151	I	97.2	Very high	94.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-46.5	176.4	-65.1	-54.8	0	0	0	111.3	G147 L148 R149 F154 I155 A173 A174 L177 I179 V182	G147-I151 WeakPolarHBondContact O-CG1 3.12Å; G147-I151 PolarHBondContact O-N 2.95Å; L148-I151 PolarHBondContact O-N 3.42Å; R149-I151 VanDerWaalsContact C-N 3.32Å; R149-I151 PolarHBondContact O-N 2.96Å; I151-F154 PolarHBondContact O-N 3.04Å; I151-I155 HydrophobicContact CG2-CD1 3.82Å; I151-I155 HydrophobicContact CG2-CG1 4.45Å; I151-I155 VanDerWaalsContact O-CG1 3.29Å; I151-I155 WeakPolarHBondContact O-CG1 3.43Å; I151-I155 PolarHBondContact O-N 2.85Å; I151-A173 HydrophobicContact CG1-CB 3.74Å; I151-A174 HydrophobicContact CD1-CB 3.87Å; I151-L177 HydrophobicContact CB-CD1 4.4Å; I151-L177 HydrophobicContact CG1-CD1 4.37Å; I151-L177 HydrophobicContact CG2-CD1 4Å; I151-I179 HydrophobicContact CD1-CB 4.44Å; I151-I179 HydrophobicContact CD1-CG1 4.27Å; I151-I179 HydrophobicContact CG2-CD1 4.26Å; I151-I179 HydrophobicContact CG2-CG1 3.81Å; I151-V182 HydrophobicContact CD1-CB 4.23Å; I151-V182 HydrophobicContact CD1-CG1 3.85Å; I151-V182 HydrophobicContact CD1-CG2 4.08Å
152	I	96.5	Very high	95.1	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-50.1	178	-67.6	169.6	0	0	0	110	L99 F108 V110 M115 L148 R149 F154 I155 Y156	L99-I152 HydrophobicContact CD1-CD1 4.44Å; F108-I152 HydrophobicContact CB-CD1 3.65Å; F108-I152 HydrophobicContact CD1-CD1 4.12Å; F108-I152 HydrophobicContact CG-CD1 4Å; V110-I152 HydrophobicContact CG1-CD1 3.86Å; V110-I152 HydrophobicContact CG1-CG1 4.18Å; V110-I152 HydrophobicContact CG1-CG2 3.87Å; M115-I152 HydrophobicContact CE-CG1 4.12Å; M115-I152 HydrophobicContact SD-CG1 4.44Å; L148-I152 HydrophobicContact CD1-CD1 3.93Å; L148-I152 HydrophobicContact CD1-CG1 4.22Å; L148-I152 HydrophobicContact CG-CD1 3.84Å; L148-I152 WeakPolarHBondContact O-CG1 3.41Å; L148-I152 PolarHBondContact O-N 3.33Å; R149-I152 PolarHBondContact O-N 2.93Å; I152-F154 PolarHBondContact O-N 3.39Å; I152-I155 PolarHBondContact O-N 3.36Å; I152-I155 VanDerWaalsContact O-N 3.08Å; I152-Y156 HydrophobicContact CG2-CD2 4.04Å; I152-Y156 HydrophobicContact CG2-CE2 4.21Å; I152-Y156 WeakPolarHBondContact O-CD2 3.44Å; I152-Y156 PolarHBondContact O-N 3.31Å; I152-Y156 VanDerWaalsContact O-N 3.14Å
153	D	95.8	Very high	95.5	Very high	57 Å²	57	42.3 Å²	42.3	31%	0.305	22%	0.223	S	C	.	.	H	α-helix	trans	-57.6	-40.6	178.6	-68.2	-20	0	0	0	110.8	R89 R149 Y156 T157	R89-D153 IonicContact NH1-OD1 3.72Å; R89-D153 IonicContact NH2-OD1 3.75Å; R149-D153 WeakPolarHBondContact CG-OD2 3.4Å; R149-D153 WeakPolarHBondContact O-CB 3.18Å; R149-D153 VanDerWaalsContact O-CG 3.22Å; R149-D153 PolarHBondContact O-N 3.27Å; D153-Y156 PolarHBondContact O-N 2.65Å; D153-T157 VanDerWaalsContact O-CB 3.27Å; D153-T157 WeakPolarHBondContact O-CB 3.29Å; D153-T157 VanDerWaalsContact O-CG2 3.3Å; D153-T157 WeakPolarHBondContact O-CG2 3.35Å; D153-T157 PolarHBondContact O-N 3.26Å; D153-T157 PolarHBondContact O-OG1 2.88Å
154	F	97	Very high	95	Very high	26 Å²	26	47 Å²	47	11%	0.114	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-45.7	174.8	172.7	-104	0	0	0	112.9	K150 I151 I152 Y156 T157 A158 K159 L160 I179 P181 V182 F185	K150-F154 VanDerWaalsContact O-CB 3.31Å; K150-F154 WeakPolarHBondContact O-CB 3.34Å; K150-F154 PolarHBondContact O-N 3.18Å; I151-F154 PolarHBondContact O-N 3.04Å; I152-F154 PolarHBondContact O-N 3.39Å; F154-Y156 PolarHBondContact O-N 3.43Å; F154-T157 PolarHBondContact O-N 2.86Å; F154-A158 VanDerWaalsContact O-CA 3.23Å; F154-A158 WeakPolarHBondContact O-CA 3.21Å; F154-A158 PolarHBondContact O-N 3.02Å; F154-K159 WeakPolarHBondContact CA-O 3.17Å; F154-L160 HydrophobicContact CD2-CB 4.24Å; F154-I179 HydrophobicContact CD1-CG2 4.08Å; F154-I179 HydrophobicContact CE1-CG2 3.97Å; F154-P181 HydrophobicContact CE1-CB 4.32Å; F154-P181 HydrophobicContact CZ-CB 4.02Å; F154-V182 HydrophobicContact CB-CG2 4.26Å; F154-V182 HydrophobicContact CD1-CG2 3.28Å; F154-V182 HydrophobicContact CD2-CG2 4.25Å; F154-V182 HydrophobicContact CE1-CG2 3.6Å; F154-V182 HydrophobicContact CG-CG2 3.63Å; F154-V182 HydrophobicContact CZ-CG2 4.22Å; F154-F185 HydrophobicContact CD2-CE2 4.44Å; F154-F185 HydrophobicContact CE2-CD2 4.39Å; F154-F185 AromaticContact CE2-CE2 3.61Å; F154-F185 HydrophobicContact CE2-CE2 3.61Å; F154-F185 HydrophobicContact CZ-CE2 4Å
155	I	96.6	Very high	94.7	Very high	11 Å²	11	53 Å²	53	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-35.9	-179.3	-71.4	169.3	0	0	0	111.4	L82 M114 M115 A118 I151 I152 I179	L82-I155 WeakPolarHBondContact CD2-O 3.29Å; M114-I155 HydrophobicContact CB-CG2 4.26Å; M114-I155 HydrophobicContact CE-CG2 4.3Å; M115-I155 HydrophobicContact CE-CD1 3.46Å; M115-I155 VanDerWaalsContact CE-CD1 3.46Å; M115-I155 HydrophobicContact SD-CD1 3.69Å; M115-I155 HydrophobicContact SD-CG2 4.35Å; A118-I155 HydrophobicContact CB-CB 4.43Å; A118-I155 HydrophobicContact CB-CD1 4.03Å; A118-I155 HydrophobicContact CB-CG1 3.73Å; A118-I155 HydrophobicContact CB-CG2 3.99Å; I151-I155 HydrophobicContact CG2-CD1 3.82Å; I151-I155 HydrophobicContact CG2-CG1 4.45Å; I151-I155 VanDerWaalsContact O-CG1 3.29Å; I151-I155 WeakPolarHBondContact O-CG1 3.43Å; I151-I155 PolarHBondContact O-N 2.85Å; I152-I155 PolarHBondContact O-N 3.36Å; I152-I155 VanDerWaalsContact O-N 3.08Å; I155-I179 HydrophobicContact CD1-CD1 4.2Å
156	Y	96.1	Very high	94.5	Very high	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.267	C	S	.	.	H	α-helix	trans	-91.3	-25.5	-177.4	-79	-93.8	0	0	0	114.3	L82 F85 D86 R89 V110 H111 M114 M115 I152 D153 F154	L82-Y156 VanDerWaalsContact CD2-O 3.29Å; L82-Y156 WeakPolarHBondContact CD2-O 3.4Å; F85-Y156 HydrophobicContact CB-CD1 4.03Å; F85-Y156 HydrophobicContact CB-CE1 4.01Å; F85-Y156 WeakPolarHBondContact O-CE1 3.27Å; D86-Y156 HydrophobicContact CB-CD1 4.27Å; D86-Y156 WeakPolarHBondContact OD1-CB 3.49Å; R89-Y156 HydrophobicContact CB-CD1 4.33Å; R89-Y156 HydrophobicContact CB-CE1 3.88Å; R89-Y156 HydrophobicContact CG-CE1 4.36Å; V110-Y156 HydrophobicContact CG1-CE2 4.44Å; H111-Y156 WeakPolarHBondContact CB-OH 3.47Å; H111-Y156 PolarHBondContact N-OH 3.01Å; H111-Y156 AromaticContact ND1-CE1 3.56Å; H111-Y156 AromaticContact ND1-CZ 3.67Å; H111-Y156 PolarHBondContact ND1-OH 3.02Å; M114-Y156 HydrophobicContact CB-CE1 4.41Å; M114-Y156 HydrophobicContact CB-CE2 4.25Å; M114-Y156 HydrophobicContact CG-CE1 4.05Å; M115-Y156 HydrophobicContact SD-CE2 4.45Å; I152-Y156 HydrophobicContact CG2-CD2 4.04Å; I152-Y156 HydrophobicContact CG2-CE2 4.21Å; I152-Y156 WeakPolarHBondContact O-CD2 3.44Å; I152-Y156 PolarHBondContact O-N 3.31Å; I152-Y156 VanDerWaalsContact O-N 3.14Å; D153-Y156 PolarHBondContact O-N 2.65Å; F154-Y156 PolarHBondContact O-N 3.43Å
157	T	94.7	Very high	94.3	Very high	50 Å²	50	47.9 Å²	47.9	31%	0.307	25%	0.25	S	C	.	.	H	α-helix	trans	-113.1	-12.9	-174	69.9	0	0	0	0	114.3	D153 F154 K159	D153-T157 VanDerWaalsContact O-CB 3.27Å; D153-T157 WeakPolarHBondContact O-CB 3.29Å; D153-T157 VanDerWaalsContact O-CG2 3.3Å; D153-T157 WeakPolarHBondContact O-CG2 3.35Å; D153-T157 PolarHBondContact O-N 3.26Å; D153-T157 PolarHBondContact O-OG1 2.88Å; F154-T157 PolarHBondContact O-N 2.86Å; T157-K159 PolarHBondContact O-N 3.01Å; T157-K159 VanDerWaalsContact O-N 3.15Å; T157-K159 PolarHBondContact OG1-N 3.23Å
158	A	93.9	Very high	94.1	Very high	61 Å²	61	53.4 Å²	53.4	50%	0.504	28%	0.276	S	S	.	.	S	Bend	trans	55.3	18	-167.2	0	0	0	0	0	114.2	F154	F154-A158 VanDerWaalsContact O-CA 3.23Å; F154-A158 WeakPolarHBondContact O-CA 3.21Å; F154-A158 PolarHBondContact O-N 3.02Å
159	K	94.1	Very high	94	Very high	162 Å²	162	55.6 Å²	55.6	70%	0.704	29%	0.287	S	S	*	.			trans	-116	142.1	-179.8	-66.4	176.3	-176.1	178.5	0	110.6	F154 T157	F154-K159 WeakPolarHBondContact CA-O 3.17Å; T157-K159 PolarHBondContact O-N 3.01Å; T157-K159 VanDerWaalsContact O-N 3.15Å; T157-K159 PolarHBondContact OG1-N 3.23Å
160	L	95.8	Very high	94	Very high	42 Å²	42	50 Å²	50	22%	0.22	27%	0.266	C	S	.	.			trans	-135	128.9	176.2	-174.3	68.8	0	0	0	109.9	K150 F154 L162 T170 V182 F185	K150-L160 HydrophobicContact CB-CD1 4.26Å; K150-L160 HydrophobicContact CD-CD1 4.41Å; F154-L160 HydrophobicContact CD2-CB 4.24Å; L160-L162 HydrophobicContact CD1-CD2 4.48Å; L160-L162 HydrophobicContact CD2-CD1 3.89Å; L160-L162 HydrophobicContact CD2-CD2 3.89Å; L160-L162 HydrophobicContact CD2-CG 3.81Å; L160-L162 HydrophobicContact CG-CD2 4.09Å; L160-L162 HydrophobicContact CG-CG 3.97Å; L160-T170 HydrophobicContact CD1-CG2 4.11Å; L160-T170 HydrophobicContact CD2-CG2 4.5Å; L160-V182 HydrophobicContact CD2-CB 4.44Å; L160-V182 HydrophobicContact CD2-CG1 3.77Å; L160-V182 HydrophobicContact CD2-CG2 4.37Å; L160-F185 HydrophobicContact CB-CD2 4.36Å; L160-F185 HydrophobicContact CD2-CB 4.05Å; L160-F185 HydrophobicContact CD2-CD2 4.04Å
161	S	93.9	Very high	93.8	Very high	76 Å²	76	47.9 Å²	47.9	53%	0.531	26%	0.257	S	S	.	.			trans	-108.9	116.1	173	166.4	0	0	0	0	108.8	K150 N166	K150-S161 PolarHBondContact NZ-O 3.39Å; S161-N166 PolarHBondContact O-ND2 3.08Å
162	L	93.9	Very high	93.7	Very high	32 Å²	32	51.7 Å²	51.7	17%	0.168	28%	0.275	C	S	.	.			trans	-111.8	142.1	-178.9	-68	175.6	0	0	0	111.2	L160 N166 L167 T170 F185 C186 F189	L160-L162 HydrophobicContact CD1-CD2 4.48Å; L160-L162 HydrophobicContact CD2-CD1 3.89Å; L160-L162 HydrophobicContact CD2-CD2 3.89Å; L160-L162 HydrophobicContact CD2-CG 3.81Å; L160-L162 HydrophobicContact CG-CD2 4.09Å; L160-L162 HydrophobicContact CG-CG 3.97Å; L162-N166 WeakPolarHBondContact CA-OD1 3.42Å; L162-L167 HydrophobicContact CD2-CD1 4.31Å; L162-T170 HydrophobicContact CD2-CG2 3.88Å; L162-F185 HydrophobicContact CD1-CB 4.42Å; L162-C186 HydrophobicContact CD1-CB 4.48Å; L162-F189 HydrophobicContact CB-CD2 4.08Å; L162-F189 HydrophobicContact CB-CE2 4.34Å; L162-F189 HydrophobicContact CB-CG 4.18Å; L162-F189 HydrophobicContact CD1-CB 3.93Å; L162-F189 HydrophobicContact CD1-CG 4.26Å
163	N	91.4	Very high	93.6	Very high	64 Å²	64	51.7 Å²	51.7	34%	0.342	28%	0.275	S	S	.	.			trans	-149.4	173.2	166.8	63.1	24.4	0	0	0	108.9	D165 N166 L167	N163-D165 PolarHBondContact O-N 3.43Å; N163-D165 WeakPolarHBondContact OD1-CB 3.44Å; N163-D165 PolarHBondContact OD1-N 3.23Å; N163-D165 VanDerWaalsContact OD1-N 3.14Å; N163-N166 PolarHBondContact N-OD1 2.97Å; N163-N166 PolarHBondContact O-N 3.29Å; N163-N166 PolarHBondContact O-OD1 2.96Å; N163-N166 PolarHBondContact OD1-N 3.19Å; N163-N166 PolarHBondContact OD1-ND2 3.11Å; N163-N166 PolarHBondContact OD1-OD1 2.8Å; N163-L167 VanDerWaalsContact O-CB 3.24Å; N163-L167 WeakPolarHBondContact O-CB 3.39Å; N163-L167 PolarHBondContact O-N 3.4Å
164	M	84.8	Confident	93.6	Very high	103 Å²	103	49 Å²	49	51%	0.507	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.5	-178.6	-66	-61.4	-78.4	0	0	113	L167 F189	M164-L167 HydrophobicContact SD-CD2 4.4Å; M164-F189 HydrophobicContact SD-CE1 4Å
165	D	88.6	Confident	93.5	Very high	142 Å²	142	50.3 Å²	50.3	76%	0.759	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-34.7	-179	-52.6	-40.7	0	0	0	112.7	N163	N163-D165 PolarHBondContact O-N 3.43Å; N163-D165 WeakPolarHBondContact OD1-CB 3.44Å; N163-D165 PolarHBondContact OD1-N 3.23Å; N163-D165 VanDerWaalsContact OD1-N 3.14Å
166	N	92.5	Very high	93.4	Very high	13 Å²	13	53 Å²	53	7%	0.07	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-6	-176.2	69.7	34.3	0	0	0	114.2	V146 S161 L162 N163 Q168 T170	V146-N166 HydrophobicContact CG1-CB 4.15Å; S161-N166 PolarHBondContact O-ND2 3.08Å; L162-N166 WeakPolarHBondContact CA-OD1 3.42Å; N163-N166 PolarHBondContact N-OD1 2.97Å; N163-N166 PolarHBondContact O-N 3.29Å; N163-N166 PolarHBondContact O-OD1 2.96Å; N163-N166 PolarHBondContact OD1-N 3.19Å; N163-N166 PolarHBondContact OD1-ND2 3.11Å; N163-N166 PolarHBondContact OD1-OD1 2.8Å; N166-Q168 PolarHBondContact O-N 3.27Å; N166-T170 VanDerWaalsContact O-CB 3.31Å; N166-T170 WeakPolarHBondContact O-CB 3.36Å; N166-T170 PolarHBondContact O-N 3.17Å; N166-T170 PolarHBondContact O-OG1 2.71Å
167	L	92.3	Very high	93.3	Very high	2 Å²	2	53 Å²	53	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-63.2	-45.3	-172.4	178.2	64.2	0	0	0	112.3	L162 N163 M164 T170 L171 C186 F189 L190	L162-L167 HydrophobicContact CD2-CD1 4.31Å; N163-L167 VanDerWaalsContact O-CB 3.24Å; N163-L167 WeakPolarHBondContact O-CB 3.39Å; N163-L167 PolarHBondContact O-N 3.4Å; M164-L167 HydrophobicContact SD-CD2 4.4Å; L167-T170 PolarHBondContact O-N 3.15Å; L167-L171 HydrophobicContact CD1-CD1 3.92Å; L167-L171 HydrophobicContact CD1-CG 4.14Å; L167-L171 HydrophobicContact CG-CD1 3.88Å; L167-L171 HydrophobicContact CG-CG 4.48Å; L167-L171 WeakPolarHBondContact O-CB 3.35Å; L167-L171 PolarHBondContact O-N 3.12Å; L167-C186 HydrophobicContact CD1-CB 4Å; L167-F189 HydrophobicContact CD1-CD1 4.07Å; L167-F189 HydrophobicContact CD2-CD1 3.99Å; L167-F189 HydrophobicContact CD2-CE1 4.06Å; L167-L190 HydrophobicContact CD2-CD2 3.41Å; L167-L190 VanDerWaalsContact CD2-CD2 3.41Å; L167-L190 HydrophobicContact CD2-CG 3.95Å
168	Q	91.3	Very high	93.3	Very high	117 Å²	117	54.9 Å²	54.9	55%	0.547	29%	0.29	S	S	.	.	H	α-helix	trans	-64.7	-48.8	-176.5	-175.6	171.6	-14.5	0	0	111.3	N166 T170 L171 E172	N166-Q168 PolarHBondContact O-N 3.27Å; Q168-T170 VanDerWaalsContact C-N 3.3Å; Q168-T170 PolarHBondContact O-N 2.62Å; Q168-L171 PolarHBondContact O-N 2.89Å; Q168-E172 WeakPolarHBondContact O-CB 3.31Å; Q168-E172 PolarHBondContact O-N 3.3Å
169	D	94	Very high	93.4	Very high	46 Å²	46	52 Å²	52	25%	0.246	27%	0.266	C	S	.	.	H	α-helix	trans	-57.5	-43.5	175.2	-73.4	-55.8	0	0	0	112.1	S144 V146 G147 A173	S144-D169 WeakPolarHBondContact CB-OD1 3.38Å; S144-D169 WeakPolarHBondContact OG-CB 3.19Å; S144-D169 VanDerWaalsContact OG-CG 3.25Å; S144-D169 PolarHBondContact OG-OD1 3.43Å; V146-D169 HydrophobicContact CB-CB 4.06Å; V146-D169 HydrophobicContact CG1-CB 4.12Å; G147-D169 WeakPolarHBondContact CA-O 3.42Å; D169-A173 VanDerWaalsContact O-CB 3.31Å; D169-A173 WeakPolarHBondContact O-CB 3.47Å; D169-A173 PolarHBondContact O-N 3.36Å
170	T	95.8	Very high	93.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-41.8	-179.3	-54.6	0	0	0	0	111.4	K150 L160 L162 N166 L167 Q168 A174 V182	K150-T170 HydrophobicContact CB-CG2 4.24Å; L160-T170 HydrophobicContact CD1-CG2 4.11Å; L160-T170 HydrophobicContact CD2-CG2 4.5Å; L162-T170 HydrophobicContact CD2-CG2 3.88Å; N166-T170 VanDerWaalsContact O-CB 3.31Å; N166-T170 WeakPolarHBondContact O-CB 3.36Å; N166-T170 PolarHBondContact O-N 3.17Å; N166-T170 PolarHBondContact O-OG1 2.71Å; L167-T170 PolarHBondContact O-N 3.15Å; Q168-T170 VanDerWaalsContact C-N 3.3Å; Q168-T170 PolarHBondContact O-N 2.62Å; T170-A174 WeakPolarHBondContact O-CB 3.23Å; T170-A174 PolarHBondContact O-N 3.49Å; T170-V182 HydrophobicContact CG2-CG1 3.82Å
171	L	94.6	Very high	93.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-45.2	176.2	-89.3	170.1	0	0	0	112	L167 Q168 A174 S175 L183 C186 L190 I205 Y209 L211	L167-L171 HydrophobicContact CD1-CD1 3.92Å; L167-L171 HydrophobicContact CD1-CG 4.14Å; L167-L171 HydrophobicContact CG-CD1 3.88Å; L167-L171 HydrophobicContact CG-CG 4.48Å; L167-L171 WeakPolarHBondContact O-CB 3.35Å; L167-L171 PolarHBondContact O-N 3.12Å; Q168-L171 PolarHBondContact O-N 2.89Å; L171-A174 PolarHBondContact O-N 3.21Å; L171-S175 WeakPolarHBondContact O-CB 3.48Å; L171-S175 PolarHBondContact O-N 3.17Å; L171-L183 HydrophobicContact CD2-CD2 3.95Å; L171-C186 HydrophobicContact CD1-CB 4.37Å; L171-C186 HydrophobicContact CD2-CB 3.34Å; L171-C186 HydrophobicContact CG-CB 3.75Å; L171-L190 HydrophobicContact CD1-CD1 4.2Å; L171-I205 HydrophobicContact CD1-CG2 3.64Å; L171-Y209 HydrophobicContact CB-CD2 4.41Å; L171-Y209 HydrophobicContact CB-CE2 4.25Å; L171-Y209 HydrophobicContact CD1-CD2 4.3Å; L171-Y209 HydrophobicContact CD1-CE2 4.45Å; L171-L211 HydrophobicContact CD2-CD1 4.1Å
172	E	93.8	Very high	93.4	Very high	80 Å²	80	47.1 Å²	47.1	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-48.4	178	-172.4	170.4	-168.4	0	0	110.5	Q168 S175 F176 Y209	Q168-E172 WeakPolarHBondContact O-CB 3.31Å; Q168-E172 PolarHBondContact O-N 3.3Å; E172-S175 PolarHBondContact O-N 3.19Å; E172-F176 VanDerWaalsContact O-CB 3.22Å; E172-F176 WeakPolarHBondContact O-CB 3.3Å; E172-F176 PolarHBondContact O-N 3.33Å; E172-Y209 HydrophobicContact CB-CE1 4.17Å
173	A	95.8	Very high	93.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-61.8	-47.2	176.8	0	0	0	0	0	112.5	V143 I151 D169 S175 F176 L177	V143-A173 HydrophobicContact CG1-CB 3.68Å; I151-A173 HydrophobicContact CG1-CB 3.74Å; D169-A173 VanDerWaalsContact O-CB 3.31Å; D169-A173 WeakPolarHBondContact O-CB 3.47Å; D169-A173 PolarHBondContact O-N 3.36Å; A173-S175 VanDerWaalsContact C-N 3.34Å; A173-S175 PolarHBondContact O-N 3.01Å; A173-F176 PolarHBondContact O-N 3.05Å; A173-L177 WeakPolarHBondContact O-CB 3.34Å; A173-L177 VanDerWaalsContact O-CG 3.27Å; A173-L177 WeakPolarHBondContact O-CG 3.38Å; A173-L177 PolarHBondContact O-N 3.23Å
174	A	95.8	Very high	93.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-40	179.8	0	0	0	0	0	112.2	I151 T170 L171 Q178 I179 V182 L183	I151-A174 HydrophobicContact CD1-CB 3.87Å; T170-A174 WeakPolarHBondContact O-CB 3.23Å; T170-A174 PolarHBondContact O-N 3.49Å; L171-A174 PolarHBondContact O-N 3.21Å; A174-Q178 CarbonylContact O-C 3.59Å; A174-Q178 WeakPolarHBondContact O-CA 3.28Å; A174-Q178 PolarHBondContact O-N 2.79Å; A174-I179 PolarHBondContact O-N 2.88Å; A174-V182 HydrophobicContact CB-CB 3.93Å; A174-V182 HydrophobicContact CB-CG1 3.54Å; A174-L183 HydrophobicContact CB-CD2 3.69Å; A174-L183 HydrophobicContact CB-CG 3.95Å
175	S	94	Very high	94	Very high	53 Å²	53	47 Å²	47	37%	0.371	24%	0.241	S	C	.	.	H	α-helix	trans	-67.5	-48.1	177.6	-175.4	0	0	0	0	111	L171 E172 A173 Q178	L171-S175 WeakPolarHBondContact O-CB 3.48Å; L171-S175 PolarHBondContact O-N 3.17Å; E172-S175 PolarHBondContact O-N 3.19Å; A173-S175 VanDerWaalsContact C-N 3.34Å; A173-S175 PolarHBondContact O-N 3.01Å; S175-Q178 PolarHBondContact O-N 3Å
176	F	93.8	Very high	94.4	Very high	69 Å²	69	40.2 Å²	40.2	30%	0.303	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-45.9	179.3	-175.4	-90.1	0	0	0	112	Y121 H141 V143 E172 A173 Q178	Y121-F176 HydrophobicContact CE1-CE1 4.16Å; Y121-F176 HydrophobicContact CE2-CE1 4.17Å; Y121-F176 HydrophobicContact CE2-CZ 4.45Å; Y121-F176 AromaticContact CZ-CE1 3.7Å; H141-F176 WeakPolarHBondContact O-CZ 3.27Å; V143-F176 HydrophobicContact CG2-CB 4.29Å; V143-F176 HydrophobicContact CG2-CD1 3.38Å; V143-F176 HydrophobicContact CG2-CE1 3.86Å; V143-F176 HydrophobicContact CG2-CG 3.93Å; E172-F176 VanDerWaalsContact O-CB 3.22Å; E172-F176 WeakPolarHBondContact O-CB 3.3Å; E172-F176 PolarHBondContact O-N 3.33Å; A173-F176 PolarHBondContact O-N 3.05Å; F176-Q178 VanDerWaalsContact C-N 3.31Å; F176-Q178 PolarHBondContact O-N 2.7Å
177	L	95.2	Very high	94.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	4	-178.4	-58.3	174.4	0	0	0	113.4	S119 Y121 F122 L140 V143 L148 I151 A173 I179	S119-L177 PolarHBondContact OG-O 2.92Å; Y121-L177 HydrophobicContact CD1-CD2 3.6Å; Y121-L177 HydrophobicContact CE1-CD2 3.68Å; Y121-L177 HydrophobicContact CG-CD2 4.46Å; F122-L177 HydrophobicContact CE1-CD2 4.23Å; F122-L177 HydrophobicContact CE2-CB 4.3Å; F122-L177 HydrophobicContact CE2-CD1 3.98Å; F122-L177 HydrophobicContact CE2-CD2 3.76Å; F122-L177 HydrophobicContact CE2-CG 4.23Å; F122-L177 HydrophobicContact CZ-CD1 4.06Å; F122-L177 HydrophobicContact CZ-CD2 3.52Å; F122-L177 HydrophobicContact CZ-CG 4.34Å; L140-L177 HydrophobicContact CD1-CD2 4.34Å; V143-L177 HydrophobicContact CG2-CD2 4.45Å; V143-L177 HydrophobicContact CG2-CG 4.37Å; L148-L177 HydrophobicContact CD1-CD1 4.24Å; I151-L177 HydrophobicContact CB-CD1 4.4Å; I151-L177 HydrophobicContact CG1-CD1 4.37Å; I151-L177 HydrophobicContact CG2-CD1 4Å; A173-L177 WeakPolarHBondContact O-CB 3.34Å; A173-L177 VanDerWaalsContact O-CG 3.27Å; A173-L177 WeakPolarHBondContact O-CG 3.38Å; A173-L177 PolarHBondContact O-N 3.23Å; L177-I179 VanDerWaalsContact C-N 3.34Å; L177-I179 HydrophobicContact CB-CG1 4.11Å; L177-I179 PolarHBondContact O-N 3.2Å
178	Q	94.2	Very high	94.6	Very high	90 Å²	90	46 Å²	46	42%	0.421	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	41.2	176.7	-55.4	-177.9	20.9	0	0	114.4	A174 S175 F176 L180	A174-Q178 CarbonylContact O-C 3.59Å; A174-Q178 WeakPolarHBondContact O-CA 3.28Å; A174-Q178 PolarHBondContact O-N 2.79Å; S175-Q178 PolarHBondContact O-N 3Å; F176-Q178 VanDerWaalsContact C-N 3.31Å; F176-Q178 PolarHBondContact O-N 2.7Å; Q178-L180 PolarHBondContact O-N 3.37Å
179	I	95.6	Very high	94.8	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.224	C	C	.	.			trans	-90.3	83.7	176.3	-48.2	-65.4	0	0	0	109.2	A118 I151 F154 I155 A174 L177 V182 L183	A118-I179 WeakPolarHBondContact O-CD1 3.32Å; I151-I179 HydrophobicContact CD1-CB 4.44Å; I151-I179 HydrophobicContact CD1-CG1 4.27Å; I151-I179 HydrophobicContact CG2-CD1 4.26Å; I151-I179 HydrophobicContact CG2-CG1 3.81Å; F154-I179 HydrophobicContact CD1-CG2 4.08Å; F154-I179 HydrophobicContact CE1-CG2 3.97Å; I155-I179 HydrophobicContact CD1-CD1 4.2Å; A174-I179 PolarHBondContact O-N 2.88Å; L177-I179 VanDerWaalsContact C-N 3.34Å; L177-I179 HydrophobicContact CB-CG1 4.11Å; L177-I179 PolarHBondContact O-N 3.2Å; I179-V182 HydrophobicContact CB-CB 4.31Å; I179-V182 HydrophobicContact CB-CG2 4.33Å; I179-V182 HydrophobicContact CG2-CB 3.93Å; I179-V182 HydrophobicContact CG2-CG2 3.52Å; I179-V182 PolarHBondContact O-N 3.48Å; I179-L183 PolarHBondContact O-N 2.94Å
180	L	92.4	Very high	94.9	Very high	113 Å²	113	41.3 Å²	41.3	59%	0.592	21%	0.213	S	C	*	.	H	α-helix	trans	-56.2	-42.9	-173.9	-57.4	-179	0	0	0	114.5	Q178 V182 L183 D184	Q178-L180 PolarHBondContact O-N 3.37Å; L180-V182 VanDerWaalsContact C-N 3.28Å; L180-V182 PolarHBondContact O-N 2.72Å; L180-L183 HydrophobicContact CD2-CD1 4.19Å; L180-L183 WeakPolarHBondContact O-CB 3.4Å; L180-L183 PolarHBondContact O-N 3.27Å; L180-L183 VanDerWaalsContact O-N 3.11Å; L180-D184 PolarHBondContact O-N 3.03Å
181	P	95.5	Very high	94.9	Very high	63 Å²	63	43.6 Å²	43.6	41%	0.409	23%	0.225	S	C	.	.	H	α-helix	trans	-60.8	-35.9	179.1	-25.3	35.7	0	0	0	113.5	F154 D184 F185	F154-P181 HydrophobicContact CE1-CB 4.32Å; F154-P181 HydrophobicContact CZ-CB 4.02Å; P181-D184 PolarHBondContact O-N 3.02Å; P181-F185 VanDerWaalsContact O-CD2 3.31Å; P181-F185 WeakPolarHBondContact O-CD2 3.31Å; P181-F185 VanDerWaalsContact O-CG 3.29Å; P181-F185 WeakPolarHBondContact O-CG 3.34Å; P181-F185 PolarHBondContact O-N 2.89Å
182	V	95.7	Very high	94.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-41.2	176.5	172.9	0	0	0	0	110.5	I151 F154 L160 T170 A174 I179 L180 D184 F185 C186	I151-V182 HydrophobicContact CD1-CB 4.23Å; I151-V182 HydrophobicContact CD1-CG1 3.85Å; I151-V182 HydrophobicContact CD1-CG2 4.08Å; F154-V182 HydrophobicContact CB-CG2 4.26Å; F154-V182 HydrophobicContact CD1-CG2 3.28Å; F154-V182 HydrophobicContact CD2-CG2 4.25Å; F154-V182 HydrophobicContact CE1-CG2 3.6Å; F154-V182 HydrophobicContact CG-CG2 3.63Å; F154-V182 HydrophobicContact CZ-CG2 4.22Å; L160-V182 HydrophobicContact CD2-CB 4.44Å; L160-V182 HydrophobicContact CD2-CG1 3.77Å; L160-V182 HydrophobicContact CD2-CG2 4.37Å; T170-V182 HydrophobicContact CG2-CG1 3.82Å; A174-V182 HydrophobicContact CB-CB 3.93Å; A174-V182 HydrophobicContact CB-CG1 3.54Å; I179-V182 HydrophobicContact CB-CB 4.31Å; I179-V182 HydrophobicContact CB-CG2 4.33Å; I179-V182 HydrophobicContact CG2-CB 3.93Å; I179-V182 HydrophobicContact CG2-CG2 3.52Å; I179-V182 PolarHBondContact O-N 3.48Å; L180-V182 VanDerWaalsContact C-N 3.28Å; L180-V182 PolarHBondContact O-N 2.72Å; V182-D184 VanDerWaalsContact C-N 3.27Å; V182-D184 PolarHBondContact O-N 3.22Å; V182-F185 PolarHBondContact O-N 3.32Å; V182-C186 PolarHBondContact O-N 3Å; V182-C186 PolarHBondContact O-SG 3.01Å
183	L	94	Very high	94.8	Very high	23 Å²	23	45.8 Å²	45.8	12%	0.12	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-42	173.3	-67.2	175.7	0	0	0	111.1	L171 A174 I179 L180 C186 K187	L171-L183 HydrophobicContact CD2-CD2 3.95Å; A174-L183 HydrophobicContact CB-CD2 3.69Å; A174-L183 HydrophobicContact CB-CG 3.95Å; I179-L183 PolarHBondContact O-N 2.94Å; L180-L183 HydrophobicContact CD2-CD1 4.19Å; L180-L183 WeakPolarHBondContact O-CB 3.4Å; L180-L183 PolarHBondContact O-N 3.27Å; L180-L183 VanDerWaalsContact O-N 3.11Å; L183-C186 PolarHBondContact O-N 3.27Å; L183-K187 WeakPolarHBondContact O-CG 3.41Å; L183-K187 PolarHBondContact O-N 2.71Å
184	D	94.8	Very high	94.7	Very high	75 Å²	75	46.5 Å²	46.5	40%	0.401	26%	0.258	S	S	.	.	H	α-helix	trans	-64.6	-41.5	177.9	-67.9	-25.6	0	0	0	112.1	L180 P181 V182 C186 K187 V188	L180-D184 PolarHBondContact O-N 3.03Å; P181-D184 PolarHBondContact O-N 3.02Å; V182-D184 VanDerWaalsContact C-N 3.27Å; V182-D184 PolarHBondContact O-N 3.22Å; D184-C186 VanDerWaalsContact C-N 3.34Å; D184-C186 PolarHBondContact O-N 2.99Å; D184-K187 WeakPolarHBondContact O-CB 3.31Å; D184-K187 PolarHBondContact O-N 3.46Å; D184-K187 IonicContact OD1-NZ 3.1Å; D184-K187 PolarHBondContact OD1-NZ 2.85Å; D184-V188 WeakPolarHBondContact O-CG2 3.43Å; D184-V188 PolarHBondContact O-N 3.44Å
185	F	95.7	Very high	94.7	Very high	98 Å²	98	49.3 Å²	49.3	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-62.2	-40.7	172.8	-60.7	-30.5	0	0	0	112.6	F154 L160 L162 P181 V182 K187 V188 F189	F154-F185 HydrophobicContact CD2-CE2 4.44Å; F154-F185 HydrophobicContact CE2-CD2 4.39Å; F154-F185 AromaticContact CE2-CE2 3.61Å; F154-F185 HydrophobicContact CE2-CE2 3.61Å; F154-F185 HydrophobicContact CZ-CE2 4Å; L160-F185 HydrophobicContact CB-CD2 4.36Å; L160-F185 HydrophobicContact CD2-CB 4.05Å; L160-F185 HydrophobicContact CD2-CD2 4.04Å; L162-F185 HydrophobicContact CD1-CB 4.42Å; P181-F185 VanDerWaalsContact O-CD2 3.31Å; P181-F185 WeakPolarHBondContact O-CD2 3.31Å; P181-F185 VanDerWaalsContact O-CG 3.29Å; P181-F185 WeakPolarHBondContact O-CG 3.34Å; P181-F185 PolarHBondContact O-N 2.89Å; V182-F185 PolarHBondContact O-N 3.32Å; F185-K187 VanDerWaalsContact C-N 3.33Å; F185-K187 PolarHBondContact O-N 3.3Å; F185-V188 PolarHBondContact O-N 3.34Å; F185-F189 WeakPolarHBondContact O-CB 3.39Å; F185-F189 PolarHBondContact O-N 3.37Å
186	C	95.1	Very high	94.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-37.7	174.9	-66.4	0	0	0	0	112.1	L162 L167 L171 V182 L183 D184 F189 L190	L162-C186 HydrophobicContact CD1-CB 4.48Å; L167-C186 HydrophobicContact CD1-CB 4Å; L171-C186 HydrophobicContact CD1-CB 4.37Å; L171-C186 HydrophobicContact CD2-CB 3.34Å; L171-C186 HydrophobicContact CG-CB 3.75Å; V182-C186 PolarHBondContact O-N 3Å; V182-C186 PolarHBondContact O-SG 3.01Å; L183-C186 PolarHBondContact O-N 3.27Å; D184-C186 VanDerWaalsContact C-N 3.34Å; D184-C186 PolarHBondContact O-N 2.99Å; C186-F189 PolarHBondContact O-N 3.26Å; C186-L190 WeakPolarHBondContact O-CB 3.29Å; C186-L190 VanDerWaalsContact O-CG 3.31Å; C186-L190 WeakPolarHBondContact O-CG 3.47Å; C186-L190 PolarHBondContact O-N 3.26Å
187	K	95.1	Very high	94.6	Very high	39 Å²	39	51.5 Å²	51.5	17%	0.17	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-47.6	173.9	-66.8	170.6	-164.3	164.7	0	111.4	L183 D184 F185 F189 L190 I191 L211 E213 V214	L183-K187 WeakPolarHBondContact O-CG 3.41Å; L183-K187 PolarHBondContact O-N 2.71Å; D184-K187 WeakPolarHBondContact O-CB 3.31Å; D184-K187 PolarHBondContact O-N 3.46Å; D184-K187 IonicContact OD1-NZ 3.1Å; D184-K187 PolarHBondContact OD1-NZ 2.85Å; F185-K187 VanDerWaalsContact C-N 3.33Å; F185-K187 PolarHBondContact O-N 3.3Å; K187-F189 VanDerWaalsContact C-N 3.34Å; K187-F189 PolarHBondContact O-N 3.4Å; K187-L190 PolarHBondContact O-N 2.94Å; K187-I191 WeakPolarHBondContact O-CB 3.29Å; K187-I191 WeakPolarHBondContact O-CG1 3.47Å; K187-I191 PolarHBondContact O-N 3.33Å; K187-L211 HydrophobicContact CG-CD2 4.24Å; K187-E213 IonicContact NZ-OE2 2.71Å; K187-V214 HydrophobicContact CB-CG2 3.81Å; K187-V214 HydrophobicContact CG-CG2 3.84Å
188	V	95.4	Very high	94.4	Very high	99 Å²	99	53 Å²	53	60%	0.6	29%	0.294	S	S	*	.	H	α-helix	trans	-59.6	-46.7	178.4	172.4	0	0	0	0	110.4	D184 F185 L190 I191 S192	D184-V188 WeakPolarHBondContact O-CG2 3.43Å; D184-V188 PolarHBondContact O-N 3.44Å; F185-V188 PolarHBondContact O-N 3.34Å; V188-L190 PolarHBondContact O-N 3.34Å; V188-I191 PolarHBondContact O-N 2.98Å; V188-S192 WeakPolarHBondContact O-CB 3.49Å; V188-S192 PolarHBondContact O-N 3.01Å; V188-S192 PolarHBondContact O-OG 3.23Å
189	F	95.1	Very high	94.4	Very high	60 Å²	60	48.8 Å²	48.8	26%	0.263	27%	0.274	S	S	.	.	H	α-helix	trans	-57.3	-50.7	176.3	-178.5	-97.9	0	0	0	111.4	L162 M164 L167 F185 C186 K187 I191 S192 G193	L162-F189 HydrophobicContact CB-CD2 4.08Å; L162-F189 HydrophobicContact CB-CE2 4.34Å; L162-F189 HydrophobicContact CB-CG 4.18Å; L162-F189 HydrophobicContact CD1-CB 3.93Å; L162-F189 HydrophobicContact CD1-CG 4.26Å; M164-F189 HydrophobicContact SD-CE1 4Å; L167-F189 HydrophobicContact CD1-CD1 4.07Å; L167-F189 HydrophobicContact CD2-CD1 3.99Å; L167-F189 HydrophobicContact CD2-CE1 4.06Å; F185-F189 WeakPolarHBondContact O-CB 3.39Å; F185-F189 PolarHBondContact O-N 3.37Å; C186-F189 PolarHBondContact O-N 3.26Å; K187-F189 VanDerWaalsContact C-N 3.34Å; K187-F189 PolarHBondContact O-N 3.4Å; F189-I191 PolarHBondContact O-N 2.65Å; F189-S192 PolarHBondContact O-N 3.33Å; F189-S192 PolarHBondContact O-OG 3.47Å; F189-G193 PolarHBondContact O-N 2.98Å
190	L	94.9	Very high	94.3	Very high	3 Å²	3	49 Å²	49	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-59.3	-48.1	178.9	-78.5	174.2	0	0	0	112.6	L167 L171 C186 K187 V188 S192 G193 V194 V202 I205 L211 V214	L167-L190 HydrophobicContact CD2-CD2 3.41Å; L167-L190 VanDerWaalsContact CD2-CD2 3.41Å; L167-L190 HydrophobicContact CD2-CG 3.95Å; L171-L190 HydrophobicContact CD1-CD1 4.2Å; C186-L190 WeakPolarHBondContact O-CB 3.29Å; C186-L190 VanDerWaalsContact O-CG 3.31Å; C186-L190 WeakPolarHBondContact O-CG 3.47Å; C186-L190 PolarHBondContact O-N 3.26Å; K187-L190 PolarHBondContact O-N 2.94Å; V188-L190 PolarHBondContact O-N 3.34Å; L190-S192 PolarHBondContact O-N 2.9Å; L190-G193 PolarHBondContact O-N 2.64Å; L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 3.02Å; L190-V202 HydrophobicContact CB-CG1 4.16Å; L190-V202 HydrophobicContact CD2-CB 4.43Å; L190-V202 HydrophobicContact CD2-CG1 3.87Å; L190-V202 HydrophobicContact CD2-CG2 4.05Å; L190-V202 HydrophobicContact CG-CG1 4.48Å; L190-I205 HydrophobicContact CD1-CG2 3.95Å; L190-L211 HydrophobicContact CD1-CD1 3.82Å; L190-V214 HydrophobicContact CB-CG1 3.96Å; L190-V214 HydrophobicContact CB-CG2 4.41Å; L190-V214 HydrophobicContact CD1-CG1 4.25Å; L190-V214 HydrophobicContact CD1-CG2 4.47Å
191	I	96.1	Very high	94.2	Very high	49 Å²	49	47.2 Å²	47.2	25%	0.251	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-44.7	-179.8	-71.5	168.1	0	0	0	110.6	K187 V188 F189 G193 V214 Y217	K187-I191 WeakPolarHBondContact O-CB 3.29Å; K187-I191 WeakPolarHBondContact O-CG1 3.47Å; K187-I191 PolarHBondContact O-N 3.33Å; V188-I191 PolarHBondContact O-N 2.98Å; F189-I191 PolarHBondContact O-N 2.65Å; I191-G193 VanDerWaalsContact C-N 3.26Å; I191-G193 PolarHBondContact O-N 3.37Å; I191-V214 HydrophobicContact CD1-CG2 4.25Å; I191-V214 HydrophobicContact CG1-CB 4.48Å; I191-V214 HydrophobicContact CG1-CG1 4.46Å; I191-V214 HydrophobicContact CG1-CG2 4.11Å; I191-Y217 HydrophobicContact CB-CD1 4.38Å; I191-Y217 HydrophobicContact CG1-CD1 4.28Å; I191-Y217 HydrophobicContact CG1-CG 4.28Å; I191-Y217 HydrophobicContact CG2-CD1 3.97Å; I191-Y217 HydrophobicContact CG2-CD2 3.99Å; I191-Y217 HydrophobicContact CG2-CE1 3.95Å; I191-Y217 HydrophobicContact CG2-CE2 3.99Å; I191-Y217 HydrophobicContact CG2-CG 3.98Å; I191-Y217 WeakPolarHBondContact O-CE1 3.38Å
192	S	94.5	Very high	94.2	Very high	95 Å²	95	44.3 Å²	44.3	66%	0.664	25%	0.246	S	C	*	.	H	α-helix	trans	-68.2	-24.6	179.8	71.1	0	0	0	0	113.6	V188 F189 L190	V188-S192 WeakPolarHBondContact O-CB 3.49Å; V188-S192 PolarHBondContact O-N 3.01Å; V188-S192 PolarHBondContact O-OG 3.23Å; F189-S192 PolarHBondContact O-N 3.33Å; F189-S192 PolarHBondContact O-OG 3.47Å; L190-S192 PolarHBondContact O-N 2.9Å
193	G	92	Very high	94.1	Very high	31 Å²	31	44.4 Å²	44.4	32%	0.32	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	3.7	-176.1	0	0	0	0	0	115.3	F189 L190 I191 T195 N198	F189-G193 PolarHBondContact O-N 2.98Å; L190-G193 PolarHBondContact O-N 2.64Å; I191-G193 VanDerWaalsContact C-N 3.26Å; I191-G193 PolarHBondContact O-N 3.37Å; G193-T195 PolarHBondContact O-N 2.96Å; G193-N198 PolarHBondContact O-ND2 3.03Å; G193-N198 PolarHBondContact O-OD1 3.44Å
194	V	94.7	Very high	94	Very high	15 Å²	15	49.3 Å²	49.3	9%	0.091	26%	0.263	C	S	.	.			trans	-68.1	124.1	-179.3	-177.3	0	0	0	0	110.9	L190 N198 C199 V202 Y217 V218 F221	L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 3.02Å; V194-N198 WeakPolarHBondContact CA-OD1 3.46Å; V194-C199 HydrophobicContact CG1-CB 3.77Å; V194-V202 HydrophobicContact CG2-CG1 4.02Å; V194-Y217 HydrophobicContact CB-CE1 3.93Å; V194-Y217 HydrophobicContact CG2-CD1 3.93Å; V194-Y217 HydrophobicContact CG2-CE1 3.72Å; V194-V218 HydrophobicContact CG2-CG2 4.23Å; V194-F221 HydrophobicContact CG1-CB 4.42Å; V194-F221 HydrophobicContact CG1-CD1 3.75Å; V194-F221 HydrophobicContact CG1-CD2 4.05Å; V194-F221 HydrophobicContact CG1-CE1 3.96Å; V194-F221 HydrophobicContact CG1-CE2 4.24Å; V194-F221 HydrophobicContact CG1-CG 3.81Å; V194-F221 HydrophobicContact CG1-CZ 4.21Å
195	T	94.6	Very high	93.9	Very high	60 Å²	60	46.5 Å²	46.5	37%	0.368	25%	0.249	S	C	.	.			trans	-127.8	172	174.6	69.8	0	0	0	0	110.7	G193 D197 N198 C199	G193-T195 PolarHBondContact O-N 2.96Å; T195-D197 PolarHBondContact O-N 3.48Å; T195-D197 PolarHBondContact OG1-N 2.9Å; T195-N198 PolarHBondContact N-OD1 3.5Å; T195-N198 PolarHBondContact O-N 3.45Å; T195-N198 PolarHBondContact O-OD1 2.94Å; T195-N198 VanDerWaalsContact OG1-CG 3.32Å; T195-N198 PolarHBondContact OG1-N 3.23Å; T195-N198 PolarHBondContact OG1-OD1 3.16Å; T195-C199 WeakPolarHBondContact O-CB 3.31Å; T195-C199 PolarHBondContact O-N 3.22Å
196	L	93.6	Very high	93.7	Very high	51 Å²	51	41.9 Å²	41.9	27%	0.267	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-37.2	174.6	-67.9	174.9	0	0	0	111.9	C199 F221 N225 A228 L229	L196-C199 PolarHBondContact O-SG 2.91Å; L196-F221 HydrophobicContact CD2-CE1 4.15Å; L196-F221 HydrophobicContact CD2-CZ 4.22Å; L196-N225 HydrophobicContact CD2-CB 3.7Å; L196-A228 HydrophobicContact CD1-CB 4Å; L196-A228 HydrophobicContact CD2-CB 4.09Å; L196-L229 HydrophobicContact CB-CD2 4.43Å; L196-L229 HydrophobicContact CD2-CD2 4.06Å; L196-L229 HydrophobicContact CD2-CG 4.19Å; L196-L229 WeakPolarHBondContact O-CD2 3.33Å
197	D	91.6	Very high	93.6	Very high	116 Å²	116	47 Å²	47	62%	0.62	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.4	-174.2	-50.5	-59.7	0	0	0	113.4	T195	T195-D197 PolarHBondContact O-N 3.48Å; T195-D197 PolarHBondContact OG1-N 2.9Å
198	N	92.1	Very high	93.4	Very high	33 Å²	33	49.4 Å²	49.4	18%	0.176	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-7.3	-174.7	75.7	15.6	0	0	0	114.5	G193 V194 T195 V200 E201 V202	G193-N198 PolarHBondContact O-ND2 3.03Å; G193-N198 PolarHBondContact O-OD1 3.44Å; V194-N198 WeakPolarHBondContact CA-OD1 3.46Å; T195-N198 PolarHBondContact N-OD1 3.5Å; T195-N198 PolarHBondContact O-N 3.45Å; T195-N198 PolarHBondContact O-OD1 2.94Å; T195-N198 VanDerWaalsContact OG1-CG 3.32Å; T195-N198 PolarHBondContact OG1-N 3.23Å; T195-N198 PolarHBondContact OG1-OD1 3.16Å; N198-V200 PolarHBondContact O-N 3.48Å; N198-V200 VanDerWaalsContact O-N 3.13Å; N198-E201 PolarHBondContact O-N 3.3Å; N198-V202 HydrophobicContact CB-CG2 4.48Å; N198-V202 WeakPolarHBondContact O-CG2 3.47Å; N198-V202 PolarHBondContact O-N 3.48Å
199	C	94.5	Very high	93.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.8	-33.8	-172.9	63.4	0	0	0	0	113.6	V194 T195 L196 G203 V218 F221	V194-C199 HydrophobicContact CG1-CB 3.77Å; T195-C199 WeakPolarHBondContact O-CB 3.31Å; T195-C199 PolarHBondContact O-N 3.22Å; L196-C199 PolarHBondContact O-SG 2.91Å; C199-G203 PolarHBondContact O-N 2.93Å; C199-V218 HydrophobicContact CB-CG1 4.34Å; C199-V218 VanDerWaalsContact O-CG1 3.29Å; C199-V218 WeakPolarHBondContact O-CG1 3.48Å; C199-F221 HydrophobicContact CB-CD1 3.89Å; C199-F221 HydrophobicContact CB-CE1 3.91Å
200	V	92.9	Very high	92.8	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.036	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-44.3	177.3	-176.3	0	0	0	0	110.8	N198 G203 R204 K237 L238	N198-V200 PolarHBondContact O-N 3.48Å; N198-V200 VanDerWaalsContact O-N 3.13Å; V200-G203 PolarHBondContact O-N 3.49Å; V200-R204 PolarHBondContact O-N 3.22Å; V200-K237 HydrophobicContact CG1-CB 3.88Å; V200-K237 WeakPolarHBondContact CG1-O 3.27Å; V200-L238 HydrophobicContact CG1-CD2 4.31Å; V200-L238 HydrophobicContact CG2-CD2 3.85Å; V200-L238 HydrophobicContact CG2-CG 4.24Å
201	E	91.3	Very high	92.8	Very high	75 Å²	75	49.6 Å²	49.6	35%	0.35	27%	0.271	S	S	.	.	H	α-helix	trans	-69.1	-46.1	179.7	-166.6	59	-133.1	0	0	111.4	N198 G203 R204 I205	N198-E201 PolarHBondContact O-N 3.3Å; E201-G203 PolarHBondContact O-N 3.21Å; E201-R204 WeakPolarHBondContact O-CA 3.24Å; E201-R204 WeakPolarHBondContact O-CB 3.47Å; E201-R204 PolarHBondContact O-N 3.14Å; E201-R204 IonicContact OE1-CZ 2.72Å; E201-R204 IonicContact OE1-NH1 3.34Å; E201-R204 PolarHBondContact OE1-NH1 3.05Å; E201-R204 IonicContact OE2-CZ 3.87Å; E201-R204 IonicContact OE2-NH1 3.69Å; E201-R204 PolarHBondContact OE2-NH1 3.34Å; E201-R204 IonicContact OE2-NH2 3.13Å; E201-R204 PolarHBondContact OE2-NH2 2.92Å; E201-I205 HydrophobicContact CG-CD1 4.42Å; E201-I205 WeakPolarHBondContact O-CG1 3.47Å; E201-I205 PolarHBondContact O-N 3.23Å
202	V	93.7	Very high	92.6	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-56.5	-38.4	173.5	174.6	0	0	0	0	110.6	L190 V194 N198 I205 A206 V214 V218	L190-V202 HydrophobicContact CB-CG1 4.16Å; L190-V202 HydrophobicContact CD2-CB 4.43Å; L190-V202 HydrophobicContact CD2-CG1 3.87Å; L190-V202 HydrophobicContact CD2-CG2 4.05Å; L190-V202 HydrophobicContact CG-CG1 4.48Å; V194-V202 HydrophobicContact CG2-CG1 4.02Å; N198-V202 HydrophobicContact CB-CG2 4.48Å; N198-V202 WeakPolarHBondContact O-CG2 3.47Å; N198-V202 PolarHBondContact O-N 3.48Å; V202-I205 PolarHBondContact O-N 3.03Å; V202-A206 WeakPolarHBondContact O-CB 3.35Å; V202-A206 PolarHBondContact O-N 3.38Å; V202-V214 HydrophobicContact CG1-CG1 3.82Å; V202-V218 HydrophobicContact CB-CG2 4.43Å; V202-V218 HydrophobicContact CG1-CG2 3.8Å
203	G	93.9	Very high	92.7	Very high	2 Å²	2	52.6 Å²	52.6	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-45.5	171.4	0	0	0	0	0	114.7	C199 V200 E201 A206 N207 R242	C199-G203 PolarHBondContact O-N 2.93Å; V200-G203 PolarHBondContact O-N 3.49Å; E201-G203 PolarHBondContact O-N 3.21Å; G203-A206 PolarHBondContact O-N 2.98Å; G203-N207 PolarHBondContact O-N 2.93Å; G203-R242 VanDerWaalsContact CA-NH2 3.26Å; G203-R242 PolarHBondContact O-NH2 3.48Å
204	R	92.5	Very high	92.9	Very high	126 Å²	126	51.1 Å²	51.1	48%	0.475	27%	0.265	S	S	.	.	H	α-helix	trans	-64.2	-43.6	177.3	-167.9	-171.7	-59.4	143.7	8.4	111.4	V200 E201 A206 N207 T208	V200-R204 PolarHBondContact O-N 3.22Å; E201-R204 WeakPolarHBondContact O-CA 3.24Å; E201-R204 WeakPolarHBondContact O-CB 3.47Å; E201-R204 PolarHBondContact O-N 3.14Å; E201-R204 IonicContact OE1-CZ 2.72Å; E201-R204 IonicContact OE1-NH1 3.34Å; E201-R204 PolarHBondContact OE1-NH1 3.05Å; E201-R204 IonicContact OE2-CZ 3.87Å; E201-R204 IonicContact OE2-NH1 3.69Å; E201-R204 PolarHBondContact OE2-NH1 3.34Å; E201-R204 IonicContact OE2-NH2 3.13Å; E201-R204 PolarHBondContact OE2-NH2 2.92Å; R204-A206 VanDerWaalsContact C-N 3.34Å; R204-N207 PolarHBondContact O-N 3.19Å; R204-T208 WeakPolarHBondContact O-CB 3.04Å; R204-T208 PolarHBondContact O-N 3.04Å; R204-T208 PolarHBondContact O-OG1 3.45Å
205	I	91.7	Very high	92.9	Very high	17 Å²	17	52.5 Å²	52.5	9%	0.087	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-49.4	173.8	-65.9	170.2	0	0	0	109.6	L171 L190 E201 V202 N207 T208 Y209	L171-I205 HydrophobicContact CD1-CG2 3.64Å; L190-I205 HydrophobicContact CD1-CG2 3.95Å; E201-I205 HydrophobicContact CG-CD1 4.42Å; E201-I205 WeakPolarHBondContact O-CG1 3.47Å; E201-I205 PolarHBondContact O-N 3.23Å; V202-I205 PolarHBondContact O-N 3.03Å; I205-N207 VanDerWaalsContact C-N 3.35Å; I205-N207 PolarHBondContact O-N 3.38Å; I205-T208 PolarHBondContact O-N 2.94Å; I205-Y209 HydrophobicContact CG2-CD2 3.83Å; I205-Y209 HydrophobicContact CG2-CE2 4.12Å; I205-Y209 VanDerWaalsContact O-CD2 3.28Å; I205-Y209 WeakPolarHBondContact O-CD2 3.42Å; I205-Y209 PolarHBondContact O-N 2.91Å
206	A	93.4	Very high	93	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-44.4	-179.7	0	0	0	0	0	112.5	V202 G203 R204 N210 L211 V214 D215	V202-A206 WeakPolarHBondContact O-CB 3.35Å; V202-A206 PolarHBondContact O-N 3.38Å; G203-A206 PolarHBondContact O-N 2.98Å; R204-A206 VanDerWaalsContact C-N 3.34Å; A206-N210 CarbonylContact O-C 3.51Å; A206-N210 WeakPolarHBondContact O-CA 3.2Å; A206-N210 PolarHBondContact O-N 2.95Å; A206-L211 HydrophobicContact CB-CB 4.24Å; A206-L211 PolarHBondContact O-N 3.11Å; A206-V214 HydrophobicContact CB-CB 3.92Å; A206-V214 HydrophobicContact CB-CG1 3.89Å; A206-D215 HydrophobicContact CB-CB 4.09Å
207	N	91.6	Very high	93.1	Very high	109 Å²	109	58.9 Å²	58.9	58%	0.583	29%	0.29	S	S	*	.	H	α-helix	trans	-66.6	-43.6	177.1	-169.2	25.2	0	0	0	112.1	G203 R204 I205 Y209 N210	G203-N207 PolarHBondContact O-N 2.93Å; R204-N207 PolarHBondContact O-N 3.19Å; I205-N207 VanDerWaalsContact C-N 3.35Å; I205-N207 PolarHBondContact O-N 3.38Å; N207-Y209 VanDerWaalsContact C-N 3.31Å; N207-Y209 PolarHBondContact O-N 2.84Å; N207-N210 PolarHBondContact O-N 3.12Å
208	T	90.8	Very high	93.4	Very high	89 Å²	89	53.3 Å²	53.3	55%	0.546	26%	0.261	S	S	.	.	H	α-helix	trans	-60.3	-40.9	-177.8	-57.4	0	0	0	0	111.7	R204 I205	R204-T208 WeakPolarHBondContact O-CB 3.04Å; R204-T208 PolarHBondContact O-N 3.04Å; R204-T208 PolarHBondContact O-OG1 3.45Å; I205-T208 PolarHBondContact O-N 2.94Å
209	Y	89	Confident	93.5	Very high	41 Å²	41	52.9 Å²	52.9	16%	0.161	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	9	-179.7	-60.9	-72	0	0	0	114	L171 E172 I205 N207 L211	L171-Y209 HydrophobicContact CB-CD2 4.41Å; L171-Y209 HydrophobicContact CB-CE2 4.25Å; L171-Y209 HydrophobicContact CD1-CD2 4.3Å; L171-Y209 HydrophobicContact CD1-CE2 4.45Å; E172-Y209 HydrophobicContact CB-CE1 4.17Å; I205-Y209 HydrophobicContact CG2-CD2 3.83Å; I205-Y209 HydrophobicContact CG2-CE2 4.12Å; I205-Y209 VanDerWaalsContact O-CD2 3.28Å; I205-Y209 WeakPolarHBondContact O-CD2 3.42Å; I205-Y209 PolarHBondContact O-N 2.91Å; N207-Y209 VanDerWaalsContact C-N 3.31Å; N207-Y209 PolarHBondContact O-N 2.84Å; Y209-L211 VanDerWaalsContact C-N 3.29Å; Y209-L211 PolarHBondContact O-N 3.23Å
210	N	90.1	Very high	93.6	Very high	115 Å²	115	56.5 Å²	56.5	62%	0.615	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	39.5	-176.7	-61.3	-75.8	0	0	0	114.2	A206 N207 T212	A206-N210 CarbonylContact O-C 3.51Å; A206-N210 WeakPolarHBondContact O-CA 3.2Å; A206-N210 PolarHBondContact O-N 2.95Å; N207-N210 PolarHBondContact O-N 3.12Å; N210-T212 VanDerWaalsContact C-N 3.34Å; N210-T212 PolarHBondContact O-N 2.89Å
211	L	93.6	Very high	93.8	Very high	9 Å²	9	57.9 Å²	57.9	5%	0.047	29%	0.289	C	S	.	.			trans	-80.3	78.5	176.6	-52.7	179.4	0	0	0	110.2	L171 K187 L190 A206 Y209 E213 V214 D215	L171-L211 HydrophobicContact CD2-CD1 4.1Å; K187-L211 HydrophobicContact CG-CD2 4.24Å; L190-L211 HydrophobicContact CD1-CD1 3.82Å; A206-L211 HydrophobicContact CB-CB 4.24Å; A206-L211 PolarHBondContact O-N 3.11Å; Y209-L211 VanDerWaalsContact C-N 3.29Å; Y209-L211 PolarHBondContact O-N 3.23Å; L211-E213 VanDerWaalsContact C-N 3.29Å; L211-E213 PolarHBondContact O-N 3.31Å; L211-V214 HydrophobicContact CB-CB 4.05Å; L211-V214 HydrophobicContact CB-CG2 3.9Å; L211-V214 HydrophobicContact CD1-CG2 4.29Å; L211-V214 PolarHBondContact O-N 3.07Å; L211-V214 VanDerWaalsContact O-N 3.16Å; L211-D215 PolarHBondContact O-N 3.33Å
212	T	93.6	Very high	94	Very high	94 Å²	94	54.3 Å²	54.3	58%	0.577	27%	0.273	S	S	*	.	H	α-helix	trans	-59.3	-34.1	-171.2	54.6	0	0	0	0	114.6	N210 K216	N210-T212 VanDerWaalsContact C-N 3.34Å; N210-T212 PolarHBondContact O-N 2.89Å; T212-K216 WeakPolarHBondContact O-CB 3.39Å; T212-K216 VanDerWaalsContact O-CG 3.29Å; T212-K216 WeakPolarHBondContact O-CG 3.28Å; T212-K216 PolarHBondContact O-N 2.84Å
213	E	95.5	Very high	94.1	Very high	113 Å²	113	54.8 Å²	54.8	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-69.7	-42.5	178.6	-68.8	171.4	168.7	0	0	111.5	K187 L211 K216 Y217	K187-E213 IonicContact NZ-OE2 2.71Å; L211-E213 VanDerWaalsContact C-N 3.29Å; L211-E213 PolarHBondContact O-N 3.31Å; E213-K216 PolarHBondContact O-N 3.12Å; E213-Y217 WeakPolarHBondContact O-CB 3.3Å; E213-Y217 PolarHBondContact O-N 3.15Å
214	V	96.2	Very high	94.1	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-45.2	175.3	-174.2	0	0	0	0	109.6	K187 L190 I191 V202 A206 L211 K216 Y217 V218	K187-V214 HydrophobicContact CB-CG2 3.81Å; K187-V214 HydrophobicContact CG-CG2 3.84Å; L190-V214 HydrophobicContact CB-CG1 3.96Å; L190-V214 HydrophobicContact CB-CG2 4.41Å; L190-V214 HydrophobicContact CD1-CG1 4.25Å; L190-V214 HydrophobicContact CD1-CG2 4.47Å; I191-V214 HydrophobicContact CD1-CG2 4.25Å; I191-V214 HydrophobicContact CG1-CB 4.48Å; I191-V214 HydrophobicContact CG1-CG1 4.46Å; I191-V214 HydrophobicContact CG1-CG2 4.11Å; V202-V214 HydrophobicContact CG1-CG1 3.82Å; A206-V214 HydrophobicContact CB-CB 3.92Å; A206-V214 HydrophobicContact CB-CG1 3.89Å; L211-V214 HydrophobicContact CB-CB 4.05Å; L211-V214 HydrophobicContact CB-CG2 3.9Å; L211-V214 HydrophobicContact CD1-CG2 4.29Å; L211-V214 PolarHBondContact O-N 3.07Å; L211-V214 VanDerWaalsContact O-N 3.16Å; V214-K216 PolarHBondContact O-N 2.94Å; V214-Y217 PolarHBondContact O-N 3.49Å; V214-V218 HydrophobicContact CG1-CG2 4.22Å; V214-V218 VanDerWaalsContact O-CG2 3.26Å; V214-V218 WeakPolarHBondContact O-CG2 3.2Å; V214-V218 PolarHBondContact O-N 3.3Å
215	D	94.9	Very high	94.1	Very high	44 Å²	44	58.1 Å²	58.1	24%	0.235	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-45.4	178.6	-173	72.1	0	0	0	112.1	A206 L211 Y217 V218 N219 R242	A206-D215 HydrophobicContact CB-CB 4.09Å; L211-D215 PolarHBondContact O-N 3.33Å; D215-Y217 PolarHBondContact O-N 2.87Å; D215-V218 PolarHBondContact O-N 3.3Å; D215-N219 WeakPolarHBondContact O-CB 3.3Å; D215-N219 PolarHBondContact O-N 3.01Å; D215-N219 PolarHBondContact O-ND2 2.98Å; D215-N219 PolarHBondContact OD2-ND2 2.87Å; D215-R242 IonicContact OD1-CZ 3.39Å; D215-R242 IonicContact OD1-NH2 2.82Å; D215-R242 PolarHBondContact OD1-NH2 3.19Å
216	K	95.8	Very high	94.3	Very high	147 Å²	147	57.3 Å²	57.3	64%	0.639	29%	0.29	S	S	*	.	H	α-helix	trans	-58	-47.9	173.7	-76.7	176.3	-179.2	-178.5	0	111.9	T212 E213 V214 V218 N219 S220	T212-K216 WeakPolarHBondContact O-CB 3.39Å; T212-K216 VanDerWaalsContact O-CG 3.29Å; T212-K216 WeakPolarHBondContact O-CG 3.28Å; T212-K216 PolarHBondContact O-N 2.84Å; E213-K216 PolarHBondContact O-N 3.12Å; V214-K216 PolarHBondContact O-N 2.94Å; K216-V218 PolarHBondContact O-N 3.34Å; K216-N219 PolarHBondContact O-N 3.13Å; K216-S220 PolarHBondContact O-N 2.93Å; K216-S220 PolarHBondContact O-OG 3.2Å
217	Y	97.3	Very high	94.3	Very high	98 Å²	98	59.2 Å²	59.2	38%	0.384	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-45.5	178.5	-179.8	-95.8	0	0	0	111.7	I191 V194 E213 V214 D215 N219 S220 F221	I191-Y217 HydrophobicContact CB-CD1 4.38Å; I191-Y217 HydrophobicContact CG1-CD1 4.28Å; I191-Y217 HydrophobicContact CG1-CG 4.28Å; I191-Y217 HydrophobicContact CG2-CD1 3.97Å; I191-Y217 HydrophobicContact CG2-CD2 3.99Å; I191-Y217 HydrophobicContact CG2-CE1 3.95Å; I191-Y217 HydrophobicContact CG2-CE2 3.99Å; I191-Y217 HydrophobicContact CG2-CG 3.98Å; I191-Y217 WeakPolarHBondContact O-CE1 3.38Å; V194-Y217 HydrophobicContact CB-CE1 3.93Å; V194-Y217 HydrophobicContact CG2-CD1 3.93Å; V194-Y217 HydrophobicContact CG2-CE1 3.72Å; E213-Y217 WeakPolarHBondContact O-CB 3.3Å; E213-Y217 PolarHBondContact O-N 3.15Å; V214-Y217 PolarHBondContact O-N 3.49Å; D215-Y217 PolarHBondContact O-N 2.87Å; Y217-N219 PolarHBondContact O-N 3.25Å; Y217-S220 PolarHBondContact O-N 3.48Å; Y217-F221 WeakPolarHBondContact O-CB 3.46Å; Y217-F221 PolarHBondContact O-N 3.32Å
218	V	96.7	Very high	94.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-40.9	177.9	-178.1	0	0	0	0	111.1	V194 C199 V202 V214 D215 K216 S220 F221 V222	V194-V218 HydrophobicContact CG2-CG2 4.23Å; C199-V218 HydrophobicContact CB-CG1 4.34Å; C199-V218 VanDerWaalsContact O-CG1 3.29Å; C199-V218 WeakPolarHBondContact O-CG1 3.48Å; V202-V218 HydrophobicContact CB-CG2 4.43Å; V202-V218 HydrophobicContact CG1-CG2 3.8Å; V214-V218 HydrophobicContact CG1-CG2 4.22Å; V214-V218 VanDerWaalsContact O-CG2 3.26Å; V214-V218 WeakPolarHBondContact O-CG2 3.2Å; V214-V218 PolarHBondContact O-N 3.3Å; D215-V218 PolarHBondContact O-N 3.3Å; K216-V218 PolarHBondContact O-N 3.34Å; V218-S220 VanDerWaalsContact C-N 3.34Å; V218-S220 PolarHBondContact O-N 2.95Å; V218-F221 WeakPolarHBondContact O-CB 3.35Å; V218-F221 PolarHBondContact O-N 2.91Å; V218-V222 HydrophobicContact CG1-CG2 4.11Å; V218-V222 WeakPolarHBondContact O-CB 3.41Å; V218-V222 VanDerWaalsContact O-CG2 3.28Å; V218-V222 WeakPolarHBondContact O-CG2 3.29Å; V218-V222 PolarHBondContact O-N 2.86Å
219	N	95.5	Very high	94.5	Very high	23 Å²	23	51.6 Å²	51.6	12%	0.123	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-44.8	175.6	-72.9	-26	0	0	0	111.3	D215 K216 Y217 V222 L223 R242 F245	D215-N219 WeakPolarHBondContact O-CB 3.3Å; D215-N219 PolarHBondContact O-N 3.01Å; D215-N219 PolarHBondContact O-ND2 2.98Å; D215-N219 PolarHBondContact OD2-ND2 2.87Å; K216-N219 PolarHBondContact O-N 3.13Å; Y217-N219 PolarHBondContact O-N 3.25Å; N219-V222 PolarHBondContact O-N 3.48Å; N219-L223 WeakPolarHBondContact O-CB 3.45Å; N219-L223 VanDerWaalsContact O-CG 3.28Å; N219-L223 WeakPolarHBondContact O-CG 3.26Å; N219-L223 PolarHBondContact O-N 3.2Å; N219-R242 PolarHBondContact OD1-NE 2.99Å; N219-R242 VanDerWaalsContact OD1-NE 3.15Å; N219-F245 HydrophobicContact CB-CD1 4.39Å; N219-F245 HydrophobicContact CB-CE1 3.73Å; N219-F245 HydrophobicContact CB-CZ 4.3Å
220	S	95.9	Very high	94.6	Very high	76 Å²	76	50.8 Å²	50.8	53%	0.531	26%	0.262	S	S	.	.	H	α-helix	trans	-62.9	-40.6	173.4	-62.8	0	0	0	0	112.6	K216 Y217 V218 L223 K224	K216-S220 PolarHBondContact O-N 2.93Å; K216-S220 PolarHBondContact O-OG 3.2Å; Y217-S220 PolarHBondContact O-N 3.48Å; V218-S220 VanDerWaalsContact C-N 3.34Å; V218-S220 PolarHBondContact O-N 2.95Å; S220-L223 PolarHBondContact O-N 3.02Å; S220-K224 WeakPolarHBondContact O-CB 3.37Å; S220-K224 PolarHBondContact O-N 3.48Å; S220-K224 VanDerWaalsContact O-N 3.07Å
221	F	96.2	Very high	94.6	Very high	36 Å²	36	50.6 Å²	50.6	16%	0.158	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-45.6	176.6	-178.7	-88	0	0	0	111.7	V194 L196 C199 Y217 V218 K224 N225	V194-F221 HydrophobicContact CG1-CB 4.42Å; V194-F221 HydrophobicContact CG1-CD1 3.75Å; V194-F221 HydrophobicContact CG1-CD2 4.05Å; V194-F221 HydrophobicContact CG1-CE1 3.96Å; V194-F221 HydrophobicContact CG1-CE2 4.24Å; V194-F221 HydrophobicContact CG1-CG 3.81Å; V194-F221 HydrophobicContact CG1-CZ 4.21Å; L196-F221 HydrophobicContact CD2-CE1 4.15Å; L196-F221 HydrophobicContact CD2-CZ 4.22Å; C199-F221 HydrophobicContact CB-CD1 3.89Å; C199-F221 HydrophobicContact CB-CE1 3.91Å; Y217-F221 WeakPolarHBondContact O-CB 3.46Å; Y217-F221 PolarHBondContact O-N 3.32Å; V218-F221 WeakPolarHBondContact O-CB 3.35Å; V218-F221 PolarHBondContact O-N 2.91Å; F221-K224 PolarHBondContact O-N 2.97Å; F221-N225 HydrophobicContact CE1-CB 4.44Å; F221-N225 WeakPolarHBondContact O-CB 3.16Å; F221-N225 PolarHBondContact O-N 3.37Å; F221-N225 PolarHBondContact O-ND2 3.29Å
222	V	95.8	Very high	94.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-44.8	178	172.4	0	0	0	0	110.5	V218 N219 K224 N225 F226 L229 V246	V218-V222 HydrophobicContact CG1-CG2 4.11Å; V218-V222 WeakPolarHBondContact O-CB 3.41Å; V218-V222 VanDerWaalsContact O-CG2 3.28Å; V218-V222 WeakPolarHBondContact O-CG2 3.29Å; V218-V222 PolarHBondContact O-N 2.86Å; N219-V222 PolarHBondContact O-N 3.48Å; V222-K224 VanDerWaalsContact C-N 3.32Å; V222-K224 PolarHBondContact O-N 3.36Å; V222-N225 CarbonylContact O-C 3.49Å; V222-N225 PolarHBondContact O-N 3.41Å; V222-F226 HydrophobicContact CG1-CD2 4Å; V222-F226 WeakPolarHBondContact O-CA 3.37Å; V222-F226 VanDerWaalsContact O-CB 3.32Å; V222-F226 WeakPolarHBondContact O-CB 3.45Å; V222-F226 PolarHBondContact O-N 3.25Å; V222-L229 HydrophobicContact CB-CD1 4.37Å; V222-L229 HydrophobicContact CG1-CD1 3.97Å; V222-L229 HydrophobicContact CG2-CD1 4.23Å; V222-V246 HydrophobicContact CG1-CG2 3.62Å
223	L	95.3	Very high	94.1	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-40.6	177.1	-74.2	169.3	0	0	0	112.7	N219 S220 F245 V246 L252	N219-L223 WeakPolarHBondContact O-CB 3.45Å; N219-L223 VanDerWaalsContact O-CG 3.28Å; N219-L223 WeakPolarHBondContact O-CG 3.26Å; N219-L223 PolarHBondContact O-N 3.2Å; S220-L223 PolarHBondContact O-N 3.02Å; L223-F245 HydrophobicContact CD1-CE1 3.68Å; L223-F245 HydrophobicContact CD1-CZ 3.94Å; L223-F245 HydrophobicContact CD2-CE1 4.41Å; L223-F245 HydrophobicContact CG-CE1 4.1Å; L223-V246 HydrophobicContact CD2-CB 4.41Å; L223-V246 HydrophobicContact CD2-CG1 4.29Å; L223-V246 HydrophobicContact CD2-CG2 4.28Å; L223-L252 HydrophobicContact CD2-CB 4.03Å; L223-L252 HydrophobicContact CD2-CD1 4.49Å
224	K	93.9	Very high	93.8	Very high	154 Å²	154	46.1 Å²	46.1	67%	0.67	25%	0.253	S	S	*	.	H	α-helix	trans	-71.8	-35.6	179.7	-176	179.1	176.3	-175.9	0	112.6	S220 F221 V222	S220-K224 WeakPolarHBondContact O-CB 3.37Å; S220-K224 PolarHBondContact O-N 3.48Å; S220-K224 VanDerWaalsContact O-N 3.07Å; F221-K224 PolarHBondContact O-N 2.97Å; V222-K224 VanDerWaalsContact C-N 3.32Å; V222-K224 PolarHBondContact O-N 3.36Å
225	N	94.4	Very high	93.6	Very high	44 Å²	44	46.2 Å²	46.2	24%	0.235	25%	0.253	C	S	.	.	H	α-helix	trans	-111.2	13	-171.3	-60.1	-76.6	0	0	0	113.8	L196 F221 V222 P227 A228 L229	L196-N225 HydrophobicContact CD2-CB 3.7Å; F221-N225 HydrophobicContact CE1-CB 4.44Å; F221-N225 WeakPolarHBondContact O-CB 3.16Å; F221-N225 PolarHBondContact O-N 3.37Å; F221-N225 PolarHBondContact O-ND2 3.29Å; V222-N225 CarbonylContact O-C 3.49Å; V222-N225 PolarHBondContact O-N 3.41Å; N225-P227 VanDerWaalsContact C-CD 3.42Å; N225-A228 WeakPolarHBondContact O-CB 3.39Å; N225-A228 PolarHBondContact O-N 3.48Å; N225-A228 VanDerWaalsContact O-N 3.08Å; N225-L229 PolarHBondContact O-N 3.15Å
226	F	95	Very high	93.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-55.1	-41.9	-178.4	-159	-112.8	0	0	0	113.8	V222 A228 L229 L230 F235 L238 L243 V246 L252 L260	V222-F226 HydrophobicContact CG1-CD2 4Å; V222-F226 WeakPolarHBondContact O-CA 3.37Å; V222-F226 VanDerWaalsContact O-CB 3.32Å; V222-F226 WeakPolarHBondContact O-CB 3.45Å; V222-F226 PolarHBondContact O-N 3.25Å; F226-A228 VanDerWaalsContact C-N 3.28Å; F226-A228 PolarHBondContact O-N 3.02Å; F226-L229 HydrophobicContact CD2-CD1 4.44Å; F226-L229 WeakPolarHBondContact O-CB 3.15Å; F226-L229 PolarHBondContact O-N 2.86Å; F226-L230 HydrophobicContact CD1-CD1 4.22Å; F226-L230 HydrophobicContact CD1-CD2 4.3Å; F226-L230 HydrophobicContact CD1-CG 4.12Å; F226-L230 HydrophobicContact CE1-CD1 4.21Å; F226-L230 HydrophobicContact CE1-CD2 3.73Å; F226-L230 HydrophobicContact CE1-CG 4.04Å; F226-L230 HydrophobicContact CZ-CD2 3.97Å; F226-L230 WeakPolarHBondContact O-CG 3.39Å; F226-L230 PolarHBondContact O-N 3.43Å; F226-F235 HydrophobicContact CE2-CB 4.3Å; F226-L238 HydrophobicContact CE2-CD1 4.13Å; F226-L243 HydrophobicContact CZ-CD1 4.12Å; F226-V246 HydrophobicContact CD1-CG1 4.22Å; F226-V246 HydrophobicContact CD2-CG1 3.77Å; F226-V246 HydrophobicContact CE1-CG1 4.22Å; F226-V246 HydrophobicContact CE2-CG1 3.79Å; F226-V246 HydrophobicContact CG-CG1 3.99Å; F226-V246 HydrophobicContact CZ-CG1 4.02Å; F226-L252 HydrophobicContact CB-CD1 3.5Å; F226-L252 VanDerWaalsContact CB-CD1 3.5Å; F226-L252 HydrophobicContact CD1-CD1 3.93Å; F226-L252 HydrophobicContact CG-CD1 3.9Å; F226-L260 HydrophobicContact CD1-CD2 4Å; F226-L260 HydrophobicContact CE1-CD2 3.68Å
227	P	93	Very high	93.5	Very high	40 Å²	40	44.7 Å²	44.7	26%	0.26	25%	0.246	S	C	.	.	H	α-helix	trans	-56.8	-41.2	175.7	-20.3	28.2	0	0	0	112.9	N225 L230 K253 H254	N225-P227 VanDerWaalsContact C-CD 3.42Å; P227-L230 WeakPolarHBondContact O-CB 3.33Å; P227-L230 PolarHBondContact O-N 2.89Å; P227-K253 WeakPolarHBondContact CG-O 3.48Å; P227-H254 HydrophobicContact CG-CB 3.97Å; P227-H254 WeakPolarHBondContact CG-O 3.48Å
228	A	93.5	Very high	93.4	Very high	38 Å²	38	40.1 Å²	40.1	31%	0.314	23%	0.228	S	C	.	.	H	α-helix	trans	-67.6	-39.1	176.2	0	0	0	0	0	111.7	L196 N225 F226 L230 S231 T232	L196-A228 HydrophobicContact CD1-CB 4Å; L196-A228 HydrophobicContact CD2-CB 4.09Å; N225-A228 WeakPolarHBondContact O-CB 3.39Å; N225-A228 PolarHBondContact O-N 3.48Å; N225-A228 VanDerWaalsContact O-N 3.08Å; F226-A228 VanDerWaalsContact C-N 3.28Å; F226-A228 PolarHBondContact O-N 3.02Å; A228-L230 VanDerWaalsContact C-N 3.29Å; A228-L230 PolarHBondContact O-N 2.95Å; A228-S231 WeakPolarHBondContact O-CB 3.45Å; A228-S231 PolarHBondContact O-N 3.19Å; A228-S231 VanDerWaalsContact O-N 3.13Å; A228-T232 PolarHBondContact O-N 3.07Å; A228-T232 VanDerWaalsContact O-N 3.15Å
229	L	93.1	Very high	93.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-32.3	175.2	-69.2	171.8	0	0	0	112.8	L196 V222 N225 F226 S231 T232 G233 E234 F235	L196-L229 HydrophobicContact CB-CD2 4.43Å; L196-L229 HydrophobicContact CD2-CD2 4.06Å; L196-L229 HydrophobicContact CD2-CG 4.19Å; L196-L229 WeakPolarHBondContact O-CD2 3.33Å; V222-L229 HydrophobicContact CB-CD1 4.37Å; V222-L229 HydrophobicContact CG1-CD1 3.97Å; V222-L229 HydrophobicContact CG2-CD1 4.23Å; N225-L229 PolarHBondContact O-N 3.15Å; F226-L229 HydrophobicContact CD2-CD1 4.44Å; F226-L229 WeakPolarHBondContact O-CB 3.15Å; F226-L229 PolarHBondContact O-N 2.86Å; L229-S231 PolarHBondContact O-N 3.07Å; L229-T232 PolarHBondContact O-N 3.07Å; L229-T232 PolarHBondContact O-OG1 3.31Å; L229-G233 PolarHBondContact O-N 2.79Å; L229-E234 HydrophobicContact CD2-CB 4.14Å; L229-F235 HydrophobicContact CB-CB 4.42Å; L229-F235 WeakPolarHBondContact O-CD1 3.29Å
230	L	91.9	Very high	93.3	Very high	23 Å²	23	43.7 Å²	43.7	12%	0.12	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-30.5	174.6	-68.5	-177.5	0	0	0	112.6	F226 P227 A228 F235 A263 R266	F226-L230 HydrophobicContact CD1-CD1 4.22Å; F226-L230 HydrophobicContact CD1-CD2 4.3Å; F226-L230 HydrophobicContact CD1-CG 4.12Å; F226-L230 HydrophobicContact CE1-CD1 4.21Å; F226-L230 HydrophobicContact CE1-CD2 3.73Å; F226-L230 HydrophobicContact CE1-CG 4.04Å; F226-L230 HydrophobicContact CZ-CD2 3.97Å; F226-L230 WeakPolarHBondContact O-CG 3.39Å; F226-L230 PolarHBondContact O-N 3.43Å; P227-L230 WeakPolarHBondContact O-CB 3.33Å; P227-L230 PolarHBondContact O-N 2.89Å; A228-L230 VanDerWaalsContact C-N 3.29Å; A228-L230 PolarHBondContact O-N 2.95Å; L230-F235 HydrophobicContact CD2-CD1 4.01Å; L230-F235 HydrophobicContact CD2-CD2 4.24Å; L230-F235 HydrophobicContact CD2-CE1 4.22Å; L230-F235 HydrophobicContact CD2-CE2 4.44Å; L230-F235 HydrophobicContact CD2-CG 4.03Å; L230-F235 HydrophobicContact CD2-CZ 4.44Å; L230-A263 HydrophobicContact CD2-CB 3.4Å; L230-A263 VanDerWaalsContact CD2-CB 3.4Å; L230-R266 PolarHBondContact O-NH2 2.8Å
231	S	89.6	Confident	93.2	Very high	111 Å²	111	46.2 Å²	46.2	78%	0.776	25%	0.252	S	S	*	.	H	α-helix	trans	-80.9	-37.7	178.7	-60.8	0	0	0	0	112.8	A228 L229	A228-S231 WeakPolarHBondContact O-CB 3.45Å; A228-S231 PolarHBondContact O-N 3.19Å; A228-S231 VanDerWaalsContact O-N 3.13Å; L229-S231 PolarHBondContact O-N 3.07Å
232	T	89.6	Confident	93.2	Very high	66 Å²	66	45.2 Å²	45.2	41%	0.405	25%	0.247	S	C	.	.	H	α-helix	trans	-77.1	-25.2	177.8	63.6	0	0	0	0	113	A228 L229 E234	A228-T232 PolarHBondContact O-N 3.07Å; A228-T232 VanDerWaalsContact O-N 3.15Å; L229-T232 PolarHBondContact O-N 3.07Å; L229-T232 PolarHBondContact O-OG1 3.31Å; T232-E234 VanDerWaalsContact C-N 3.28Å; T232-E234 PolarHBondContact O-N 2.86Å; T232-E234 PolarHBondContact OG1-N 3.26Å
233	G	86.3	Confident	93.2	Very high	23 Å²	23	45.2 Å²	45.2	24%	0.237	25%	0.248	C	C	.	.	S	Bend	trans	84.6	-4	-177.2	0	0	0	0	0	114.2	L229 F235 L236	L229-G233 PolarHBondContact O-N 2.79Å; G233-F235 PolarHBondContact O-N 3.19Å; G233-F235 VanDerWaalsContact O-N 3.11Å; G233-L236 WeakPolarHBondContact O-CB 3.48Å; G233-L236 WeakPolarHBondContact O-CG 3.4Å; G233-L236 PolarHBondContact O-N 2.8Å
234	E	89.2	Confident	93.3	Very high	34 Å²	34	45.4 Å²	45.4	16%	0.159	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-59	-25.8	178	-73.1	-59.6	129.8	0	0	112.6	L229 T232 L236 K237	L229-E234 HydrophobicContact CD2-CB 4.14Å; T232-E234 VanDerWaalsContact C-N 3.28Å; T232-E234 PolarHBondContact O-N 2.86Å; T232-E234 PolarHBondContact OG1-N 3.26Å; E234-L236 PolarHBondContact O-N 2.9Å; E234-L236 VanDerWaalsContact O-N 3.08Å; E234-K237 WeakPolarHBondContact O-CB 3.32Å; E234-K237 PolarHBondContact O-N 3.25Å; E234-K237 IonicContact OE1-NZ 3.05Å; E234-K237 PolarHBondContact OE1-NZ 3.11Å; E234-K237 WeakPolarHBondContact OE2-CD 3.48Å; E234-K237 WeakPolarHBondContact OE2-CE 3.33Å; E234-K237 IonicContact OE2-NZ 3.28Å; E234-K237 PolarHBondContact OE2-NZ 3.22Å
235	F	92.8	Very high	93.5	Very high	2 Å²	2	42 Å²	42	1%	0.009	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-57.1	-24.9	175.2	83.6	-84.6	0	0	0	113.5	F226 L229 L230 G233 K237 L238 A263 R266 W267	F226-F235 HydrophobicContact CE2-CB 4.3Å; L229-F235 HydrophobicContact CB-CB 4.42Å; L229-F235 WeakPolarHBondContact O-CD1 3.29Å; L230-F235 HydrophobicContact CD2-CD1 4.01Å; L230-F235 HydrophobicContact CD2-CD2 4.24Å; L230-F235 HydrophobicContact CD2-CE1 4.22Å; L230-F235 HydrophobicContact CD2-CE2 4.44Å; L230-F235 HydrophobicContact CD2-CG 4.03Å; L230-F235 HydrophobicContact CD2-CZ 4.44Å; G233-F235 PolarHBondContact O-N 3.19Å; G233-F235 VanDerWaalsContact O-N 3.11Å; F235-K237 PolarHBondContact O-N 2.61Å; F235-L238 HydrophobicContact CB-CD1 4.02Å; F235-L238 VanDerWaalsContact O-CB 3.29Å; F235-L238 WeakPolarHBondContact O-CB 3.26Å; F235-L238 WeakPolarHBondContact O-CG 3.43Å; F235-L238 PolarHBondContact O-N 3.48Å; F235-L238 VanDerWaalsContact O-N 3.12Å; F235-A263 HydrophobicContact CE2-CB 4.09Å; F235-A263 WeakPolarHBondContact CE2-O 3.39Å; F235-A263 HydrophobicContact CZ-CB 4.43Å; F235-R266 HydrophobicContact CZ-CB 4.14Å; F235-W267 HydrophobicContact CE2-CB 4.31Å
236	L	94.9	Very high	93.6	Very high	45 Å²	45	40 Å²	40	24%	0.236	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-63.7	-24	177.9	-69	174.6	0	0	0	112.8	G233 E234 R266 W267 L270 R274	G233-L236 WeakPolarHBondContact O-CB 3.48Å; G233-L236 WeakPolarHBondContact O-CG 3.4Å; G233-L236 PolarHBondContact O-N 2.8Å; E234-L236 PolarHBondContact O-N 2.9Å; E234-L236 VanDerWaalsContact O-N 3.08Å; L236-R266 HydrophobicContact CD2-CB 4.17Å; L236-W267 HydrophobicContact CD2-CB 4.36Å; L236-L270 HydrophobicContact CB-CD2 4.15Å; L236-R274 PolarHBondContact O-NH1 3.48Å
237	K	93.9	Very high	93.7	Very high	113 Å²	113	40 Å²	40	49%	0.491	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-86.1	-5.9	178.5	-57.7	178.1	-166.3	160.2	0	113	V200 E234 F235	V200-K237 HydrophobicContact CG1-CB 3.88Å; V200-K237 WeakPolarHBondContact CG1-O 3.27Å; E234-K237 WeakPolarHBondContact O-CB 3.32Å; E234-K237 PolarHBondContact O-N 3.25Å; E234-K237 IonicContact OE1-NZ 3.05Å; E234-K237 PolarHBondContact OE1-NZ 3.11Å; E234-K237 WeakPolarHBondContact OE2-CD 3.48Å; E234-K237 WeakPolarHBondContact OE2-CE 3.33Å; E234-K237 IonicContact OE2-NZ 3.28Å; E234-K237 PolarHBondContact OE2-NZ 3.22Å; F235-K237 PolarHBondContact O-N 2.61Å
238	L	94.6	Very high	93.8	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	23%	0.233	C	C	.	.			trans	-64.5	139.3	179.9	-71.8	169.8	0	0	0	111.1	V200 F226 F235 R242 W267	V200-L238 HydrophobicContact CG1-CD2 4.31Å; V200-L238 HydrophobicContact CG2-CD2 3.85Å; V200-L238 HydrophobicContact CG2-CG 4.24Å; F226-L238 HydrophobicContact CE2-CD1 4.13Å; F235-L238 HydrophobicContact CB-CD1 4.02Å; F235-L238 VanDerWaalsContact O-CB 3.29Å; F235-L238 WeakPolarHBondContact O-CB 3.26Å; F235-L238 WeakPolarHBondContact O-CG 3.43Å; F235-L238 PolarHBondContact O-N 3.48Å; F235-L238 VanDerWaalsContact O-N 3.12Å; L238-R242 HydrophobicContact CD2-CG 4.19Å; L238-W267 PolarHBondContact O-NE1 3.35Å
239	P	94.3	Very high	93.9	Very high	57 Å²	57	39.9 Å²	39.9	37%	0.37	22%	0.223	S	C	.	.			trans	-68.4	156.6	170.4	30.3	-34.3	0	0	0	110.9	E241 R242 L243	P239-E241 VanDerWaalsContact C-N 3.28Å; P239-E241 PolarHBondContact O-N 3.49Å; P239-R242 HydrophobicContact CG-CB 3.89Å; P239-R242 PolarHBondContact O-N 3.37Å; P239-L243 PolarHBondContact O-N 3.26Å; P239-L243 VanDerWaalsContact O-N 3.07Å
240	F	95.4	Very high	94	Very high	42 Å²	42	42 Å²	42	18%	0.184	24%	0.235	C	C	.	.	H	α-helix	trans	-51.4	-47	-179.1	163.5	-100.8	0	0	0	112	R242 L243 A244 W267 F277 K280 L281	F240-R242 VanDerWaalsContact C-N 3.29Å; F240-R242 PolarHBondContact O-N 3.45Å; F240-L243 PolarHBondContact O-N 3.04Å; F240-A244 HydrophobicContact CE2-CB 4.37Å; F240-A244 HydrophobicContact CZ-CB 4.28Å; F240-A244 VanDerWaalsContact O-CB 3.28Å; F240-A244 WeakPolarHBondContact O-CB 3.29Å; F240-A244 PolarHBondContact O-N 2.93Å; F240-W267 HydrophobicContact CB-CH2 4.06Å; F240-W267 HydrophobicContact CB-CZ2 4.39Å; F240-F277 HydrophobicContact CD1-CD1 4.28Å; F240-F277 HydrophobicContact CD1-CE1 4.33Å; F240-F277 HydrophobicContact CD2-CB 3.68Å; F240-F277 AromaticContact CD2-CD1 3.61Å; F240-F277 HydrophobicContact CD2-CD1 3.61Å; F240-F277 HydrophobicContact CD2-CD2 4.29Å; F240-F277 HydrophobicContact CD2-CE1 4.34Å; F240-F277 AromaticContact CD2-CG 3.59Å; F240-F277 HydrophobicContact CD2-CG 3.59Å; F240-F277 HydrophobicContact CE1-CD1 4.39Å; F240-F277 HydrophobicContact CE2-CB 3.78Å; F240-F277 AromaticContact CE2-CD1 3.72Å; F240-F277 HydrophobicContact CE2-CD1 3.72Å; F240-F277 AromaticContact CE2-CG 3.95Å; F240-F277 HydrophobicContact CE2-CG 3.95Å; F240-F277 AromaticContact CG-CD1 3.91Å; F240-F277 HydrophobicContact CG-CD1 3.91Å; F240-F277 HydrophobicContact CG-CE1 4.18Å; F240-F277 HydrophobicContact CG-CG 4.15Å; F240-F277 HydrophobicContact CZ-CD1 4.12Å; F240-K280 HydrophobicContact CE2-CB 4.03Å; F240-K280 HydrophobicContact CZ-CB 3.98Å; F240-K280 HydrophobicContact CZ-CD 4.03Å; F240-L281 HydrophobicContact CD2-CD1 4.42Å; F240-L281 HydrophobicContact CD2-CD2 3.83Å; F240-L281 HydrophobicContact CD2-CG 4.1Å; F240-L281 HydrophobicContact CE2-CD2 3.65Å; F240-L281 HydrophobicContact CE2-CG 3.87Å
241	E	95.1	Very high	94.1	Very high	129 Å²	129	44.1 Å²	44.1	60%	0.603	25%	0.251	S	S	*	.	H	α-helix	trans	-60.8	-41	-174.9	-63.2	74.2	-164.1	0	0	111.4	P239 F245	P239-E241 VanDerWaalsContact C-N 3.28Å; P239-E241 PolarHBondContact O-N 3.49Å; E241-F245 WeakPolarHBondContact O-CB 3.44Å; E241-F245 PolarHBondContact O-N 2.95Å
242	R	95.3	Very high	94.2	Very high	14 Å²	14	39.1 Å²	39.1	5%	0.053	22%	0.216	C	C	.	.	H	α-helix	trans	-76	-39.6	-178.9	-170.3	170.3	-69.6	-170.4	-0.5	111.8	G203 D215 N219 L238 P239 F240 F245 V246	G203-R242 VanDerWaalsContact CA-NH2 3.26Å; G203-R242 PolarHBondContact O-NH2 3.48Å; D215-R242 IonicContact OD1-CZ 3.39Å; D215-R242 IonicContact OD1-NH2 2.82Å; D215-R242 PolarHBondContact OD1-NH2 3.19Å; N219-R242 PolarHBondContact OD1-NE 2.99Å; N219-R242 VanDerWaalsContact OD1-NE 3.15Å; L238-R242 HydrophobicContact CD2-CG 4.19Å; P239-R242 HydrophobicContact CG-CB 3.89Å; P239-R242 PolarHBondContact O-N 3.37Å; F240-R242 VanDerWaalsContact C-N 3.29Å; F240-R242 PolarHBondContact O-N 3.45Å; R242-F245 WeakPolarHBondContact O-CB 3.34Å; R242-F245 PolarHBondContact O-N 3.27Å; R242-V246 VanDerWaalsContact O-CG2 3.3Å; R242-V246 WeakPolarHBondContact O-CG2 3.39Å; R242-V246 PolarHBondContact O-N 3.14Å
243	L	96.8	Very high	93.9	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-45.2	173.8	-179.2	60.9	0	0	0	110.7	F226 P239 F240 F245 V246 L247 W267 L281	F226-L243 HydrophobicContact CZ-CD1 4.12Å; P239-L243 PolarHBondContact O-N 3.26Å; P239-L243 VanDerWaalsContact O-N 3.07Å; F240-L243 PolarHBondContact O-N 3.04Å; L243-F245 VanDerWaalsContact C-N 3.32Å; L243-F245 PolarHBondContact O-N 2.94Å; L243-V246 PolarHBondContact O-N 3.22Å; L243-L247 HydrophobicContact CD1-CD1 4.19Å; L243-L247 HydrophobicContact CD1-CD2 4.5Å; L243-L247 HydrophobicContact CD1-CG 4.08Å; L243-L247 HydrophobicContact CG-CD1 4.01Å; L243-L247 HydrophobicContact CG-CG 4.31Å; L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 VanDerWaalsContact O-CG 3.27Å; L243-L247 WeakPolarHBondContact O-CG 3.36Å; L243-L247 PolarHBondContact O-N 3.15Å; L243-W267 HydrophobicContact CD2-CB 3.95Å; L243-W267 HydrophobicContact CD2-CD2 3.54Å; L243-W267 HydrophobicContact CD2-CE3 4.04Å; L243-W267 HydrophobicContact CD2-CG 3.48Å; L243-W267 VanDerWaalsContact CD2-CG 3.48Å; L243-L281 HydrophobicContact CD2-CD1 3.95Å; L243-L281 HydrophobicContact CD2-CD2 4.42Å; L243-L281 HydrophobicContact CG-CD2 4.31Å
244	A	97.6	Very high	93.9	Very high	15 Å²	15	45.7 Å²	45.7	12%	0.124	23%	0.234	C	C	.	.	H	α-helix	trans	-58.2	-44	175.1	0	0	0	0	0	111.6	F240 L247 S248 L281	F240-A244 HydrophobicContact CE2-CB 4.37Å; F240-A244 HydrophobicContact CZ-CB 4.28Å; F240-A244 VanDerWaalsContact O-CB 3.28Å; F240-A244 WeakPolarHBondContact O-CB 3.29Å; F240-A244 PolarHBondContact O-N 2.93Å; A244-L247 PolarHBondContact O-N 3.16Å; A244-S248 WeakPolarHBondContact O-CB 3.4Å; A244-S248 PolarHBondContact O-N 3.45Å; A244-S248 PolarHBondContact O-OG 3.42Å; A244-L281 HydrophobicContact CB-CD2 3.87Å
245	F	96.5	Very high	94.1	Very high	84 Å²	84	45.2 Å²	45.2	37%	0.368	23%	0.234	S	C	.	.	H	α-helix	trans	-57.6	-51	174.1	169.4	-98.3	0	0	0	111.9	N219 L223 E241 R242 L243 L247 S248 S249	N219-F245 HydrophobicContact CB-CD1 4.39Å; N219-F245 HydrophobicContact CB-CE1 3.73Å; N219-F245 HydrophobicContact CB-CZ 4.3Å; L223-F245 HydrophobicContact CD1-CE1 3.68Å; L223-F245 HydrophobicContact CD1-CZ 3.94Å; L223-F245 HydrophobicContact CD2-CE1 4.41Å; L223-F245 HydrophobicContact CG-CE1 4.1Å; E241-F245 WeakPolarHBondContact O-CB 3.44Å; E241-F245 PolarHBondContact O-N 2.95Å; R242-F245 WeakPolarHBondContact O-CB 3.34Å; R242-F245 PolarHBondContact O-N 3.27Å; L243-F245 VanDerWaalsContact C-N 3.32Å; L243-F245 PolarHBondContact O-N 2.94Å; F245-L247 PolarHBondContact O-N 2.66Å; F245-S248 PolarHBondContact O-N 3.22Å; F245-S248 VanDerWaalsContact O-N 3.15Å; F245-S248 PolarHBondContact O-OG 3.41Å; F245-S249 PolarHBondContact O-N 3.25Å; F245-S249 VanDerWaalsContact O-N 3.13Å
246	V	96.4	Very high	94.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.7	-50.2	178.7	170.4	0	0	0	0	111.1	V222 L223 F226 R242 L243 S248 S249 L252	V222-V246 HydrophobicContact CG1-CG2 3.62Å; L223-V246 HydrophobicContact CD2-CB 4.41Å; L223-V246 HydrophobicContact CD2-CG1 4.29Å; L223-V246 HydrophobicContact CD2-CG2 4.28Å; F226-V246 HydrophobicContact CD1-CG1 4.22Å; F226-V246 HydrophobicContact CD2-CG1 3.77Å; F226-V246 HydrophobicContact CE1-CG1 4.22Å; F226-V246 HydrophobicContact CE2-CG1 3.79Å; F226-V246 HydrophobicContact CG-CG1 3.99Å; F226-V246 HydrophobicContact CZ-CG1 4.02Å; R242-V246 VanDerWaalsContact O-CG2 3.3Å; R242-V246 WeakPolarHBondContact O-CG2 3.39Å; R242-V246 PolarHBondContact O-N 3.14Å; L243-V246 PolarHBondContact O-N 3.22Å; V246-S248 PolarHBondContact O-N 3.23Å; V246-S249 PolarHBondContact O-N 3.03Å; V246-L252 HydrophobicContact CG1-CD1 4.01Å; V246-L252 HydrophobicContact CG1-CD2 4.01Å
247	L	96.9	Very high	94.1	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-23.6	180	-65.3	177.8	0	0	0	112.9	L243 A244 F245 L260 T264 L281 N284 I285 R339	L243-L247 HydrophobicContact CD1-CD1 4.19Å; L243-L247 HydrophobicContact CD1-CD2 4.5Å; L243-L247 HydrophobicContact CD1-CG 4.08Å; L243-L247 HydrophobicContact CG-CD1 4.01Å; L243-L247 HydrophobicContact CG-CG 4.31Å; L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 VanDerWaalsContact O-CG 3.27Å; L243-L247 WeakPolarHBondContact O-CG 3.36Å; L243-L247 PolarHBondContact O-N 3.15Å; A244-L247 PolarHBondContact O-N 3.16Å; F245-L247 PolarHBondContact O-N 2.66Å; L247-L260 HydrophobicContact CD2-CB 3.97Å; L247-L260 HydrophobicContact CD2-CD1 4.42Å; L247-L260 HydrophobicContact CD2-CD2 4.14Å; L247-L260 HydrophobicContact CD2-CG 4.39Å; L247-T264 HydrophobicContact CD1-CG2 4.31Å; L247-T264 WeakPolarHBondContact CD1-OG1 3.36Å; L247-L281 HydrophobicContact CD1-CB 4.32Å; L247-L281 HydrophobicContact CD1-CD2 4.16Å; L247-N284 HydrophobicContact CB-CB 3.67Å; L247-I285 HydrophobicContact CD1-CD1 4.23Å; L247-I285 HydrophobicContact CD2-CD1 3.79Å; L247-I285 HydrophobicContact CG-CD1 4.44Å; L247-R339 VanDerWaalsContact O-CZ 3.26Å; L247-R339 PolarHBondContact O-NH1 3.43Å; L247-R339 PolarHBondContact O-NH2 2.9Å; L247-R339 VanDerWaalsContact O-NH2 3.16Å
248	S	96.3	Very high	94.3	Very high	59 Å²	59	42.5 Å²	42.5	41%	0.413	23%	0.227	S	C	.	.	H	α-helix	trans	-86.1	-18.8	178.2	70.3	0	0	0	0	113.3	A244 F245 V246	A244-S248 WeakPolarHBondContact O-CB 3.4Å; A244-S248 PolarHBondContact O-N 3.45Å; A244-S248 PolarHBondContact O-OG 3.42Å; F245-S248 PolarHBondContact O-N 3.22Å; F245-S248 VanDerWaalsContact O-N 3.15Å; F245-S248 PolarHBondContact O-OG 3.41Å; V246-S248 PolarHBondContact O-N 3.23Å
249	S	96	Very high	94.3	Very high	17 Å²	17	46.6 Å²	46.6	12%	0.119	25%	0.246	C	C	.	.			trans	-78.4	137.8	-169.1	-175.3	0	0	0	0	113.8	F245 V246 S251 R339	F245-S249 PolarHBondContact O-N 3.25Å; F245-S249 VanDerWaalsContact O-N 3.13Å; V246-S249 PolarHBondContact O-N 3.03Å; S249-S251 VanDerWaalsContact C-N 3.28Å; S249-S251 WeakPolarHBondContact OG-CB 3.47Å; S249-S251 PolarHBondContact OG-N 3.04Å; S249-R339 WeakPolarHBondContact O-CD 3.43Å; S249-R339 VanDerWaalsContact O-CG 3.25Å; S249-R339 WeakPolarHBondContact O-CG 3.47Å; S249-R339 PolarHBondContact O-NH1 2.96Å
250	N	94.6	Very high	94.5	Very high	45 Å²	45	43.9 Å²	43.9	24%	0.241	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.8	166.9	-82	-18.6	0	0	0	113.3	L252 R286 D341	N250-L252 VanDerWaalsContact C-N 3.34Å; N250-R286 VanDerWaalsContact OD1-CZ 3.31Å; N250-R286 PolarHBondContact OD1-NH1 3.46Å; N250-R286 PolarHBondContact OD1-NH2 3.4Å; N250-D341 VanDerWaalsContact CB-CG 3.49Å; N250-D341 WeakPolarHBondContact CB-OD1 3.28Å; N250-D341 WeakPolarHBondContact CB-OD2 3.5Å; N250-D341 PolarHBondContact ND2-OD1 3.08Å
251	S	93.5	Very high	94.6	Very high	67 Å²	67	42.1 Å²	42.1	47%	0.469	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-3	176.9	-63.8	0	0	0	0	113.5	S249 K253	S249-S251 VanDerWaalsContact C-N 3.28Å; S249-S251 WeakPolarHBondContact OG-CB 3.47Å; S249-S251 PolarHBondContact OG-N 3.04Å; S251-K253 WeakPolarHBondContact O-CG 3.28Å; S251-K253 PolarHBondContact O-N 3.21Å
252	L	93	Very high	94.7	Very high	6 Å²	6	40 Å²	40	3%	0.031	21%	0.21	C	C	.	.			trans	-71.9	123.2	175.7	177.4	60.8	0	0	0	109.6	L223 F226 V246 N250 L260	L223-L252 HydrophobicContact CD2-CB 4.03Å; L223-L252 HydrophobicContact CD2-CD1 4.49Å; F226-L252 HydrophobicContact CB-CD1 3.5Å; F226-L252 VanDerWaalsContact CB-CD1 3.5Å; F226-L252 HydrophobicContact CD1-CD1 3.93Å; F226-L252 HydrophobicContact CG-CD1 3.9Å; V246-L252 HydrophobicContact CG1-CD1 4.01Å; V246-L252 HydrophobicContact CG1-CD2 4.01Å; N250-L252 VanDerWaalsContact C-N 3.34Å; L252-L260 HydrophobicContact CD2-CD1 3.71Å; L252-L260 HydrophobicContact CD2-CD2 3.72Å; L252-L260 HydrophobicContact CD2-CG 4.36Å
253	K	83.4	Confident	94.8	Very high	100 Å²	100	39.4 Å²	39.4	44%	0.435	21%	0.208	S	C	.	.			trans	-111.5	153.8	-173.2	-57.9	-170.4	177.1	-173.2	0	112.4	P227 S251 C255	P227-K253 WeakPolarHBondContact CG-O 3.48Å; S251-K253 WeakPolarHBondContact O-CG 3.28Å; S251-K253 PolarHBondContact O-N 3.21Å; K253-C255 VanDerWaalsContact C-N 3.29Å; K253-C255 PolarHBondContact O-N 3.13Å
254	H	85.9	Confident	94.8	Very high	127 Å²	127	39.4 Å²	39.4	59%	0.588	21%	0.208	S	C	*	.	S	Bend	trans	54.1	40.1	170.8	-50.4	-75.9	0	0	0	114.1	P227 E643	P227-H254 HydrophobicContact CG-CB 3.97Å; P227-H254 WeakPolarHBondContact CG-O 3.48Å; H254-E643 IonicContact CE1-OE1 2.85Å; H254-E643 IonicContact ND1-OE1 3.66Å; H254-E643 PolarHBondContact ND1-OE1 3.45Å; H254-E643 VanDerWaalsContact ND1-OE1 3.11Å
255	C	91.7	Very high	94.8	Very high	23 Å²	23	39.1 Å²	39.1	16%	0.155	21%	0.205	C	C	.	.			trans	-135.5	125.7	172.4	-73.3	0	0	0	0	109.4	K253 L260	K253-C255 VanDerWaalsContact C-N 3.29Å; K253-C255 PolarHBondContact O-N 3.13Å; C255-L260 HydrophobicContact CB-CD2 3.7Å; C255-L260 HydrophobicContact CB-CG 4.06Å
256	T	93.4	Very high	94.8	Very high	72 Å²	72	41.1 Å²	41.1	44%	0.442	21%	0.21	S	C	.	.			trans	-73.5	153.6	169.9	63.8	0	0	0	0	110.3	L258 E259 L260	T256-L258 PolarHBondContact O-N 3.48Å; T256-E259 WeakPolarHBondContact CB-OE2 3.21Å; T256-E259 PolarHBondContact N-OE2 2.81Å; T256-E259 PolarHBondContact O-N 2.72Å; T256-E259 VanDerWaalsContact O-N 3.11Å; T256-E259 VanDerWaalsContact OG1-CD 3.26Å; T256-E259 VanDerWaalsContact OG1-CG 3.23Å; T256-E259 WeakPolarHBondContact OG1-CG 3.47Å; T256-E259 PolarHBondContact OG1-N 3.43Å; T256-E259 PolarHBondContact OG1-OE2 3.06Å; T256-L260 WeakPolarHBondContact O-CG 3.41Å; T256-L260 PolarHBondContact O-N 2.72Å; T256-L260 VanDerWaalsContact O-N 3.11Å
257	E	95.9	Very high	94.8	Very high	15 Å²	15	41.4 Å²	41.4	7%	0.07	21%	0.211	C	C	.	.	H	α-helix	trans	-60.2	-31.4	176.6	-65.8	-62.8	149.2	0	0	112	L260 F261 R286 L289 M290 R339	E257-L260 PolarHBondContact O-N 2.99Å; E257-F261 WeakPolarHBondContact O-CB 3.46Å; E257-F261 PolarHBondContact O-N 2.81Å; E257-R286 HydrophobicContact CG-CB 3.91Å; E257-R286 PolarHBondContact OE2-N 2.89Å; E257-L289 HydrophobicContact CG-CB 4.11Å; E257-L289 HydrophobicContact CG-CD1 4.14Å; E257-M290 VanDerWaalsContact C-CE 3.47Å; E257-M290 HydrophobicContact CB-CE 3.78Å; E257-M290 HydrophobicContact CB-CG 4.04Å; E257-M290 VanDerWaalsContact O-CE 3.29Å; E257-M290 WeakPolarHBondContact O-CE 3.14Å; E257-R339 IonicContact OE1-CZ 3.47Å; E257-R339 VanDerWaalsContact OE1-CZ 3.25Å; E257-R339 IonicContact OE1-NE 2.72Å; E257-R339 PolarHBondContact OE1-NE 2.9Å; E257-R339 IonicContact OE1-NH2 2.8Å; E257-R339 PolarHBondContact OE1-NH2 3.21Å; E257-R339 IonicContact OE2-NH2 2.61Å; E257-R339 PolarHBondContact OE2-NH2 3.37Å; E257-R339 VanDerWaalsContact OE2-NH2 3.1Å
258	L	96.7	Very high	94.9	Very high	16 Å²	16	41.4 Å²	41.4	8%	0.084	21%	0.211	C	C	.	.	H	α-helix	trans	-64.5	-42.1	176.2	-179.4	64.6	0	0	0	111.9	T256 F261 K262 E294 Y298	T256-L258 PolarHBondContact O-N 3.48Å; L258-F261 PolarHBondContact O-N 3.19Å; L258-K262 HydrophobicContact CD1-CD 4.47Å; L258-K262 HydrophobicContact CG-CD 4.22Å; L258-K262 WeakPolarHBondContact O-CB 3.44Å; L258-K262 WeakPolarHBondContact O-CG 3.39Å; L258-K262 PolarHBondContact O-N 3.44Å; L258-E294 HydrophobicContact CD1-CB 4.43Å; L258-E294 HydrophobicContact CD2-CB 4.44Å; L258-E294 HydrophobicContact CD2-CG 3.91Å; L258-E294 WeakPolarHBondContact CD2-OE1 3.25Å; L258-Y298 HydrophobicContact CD1-CD2 3.92Å; L258-Y298 HydrophobicContact CD1-CG 4.02Å; L258-Y298 HydrophobicContact CD2-CD2 3.88Å; L258-Y298 HydrophobicContact CD2-CE2 4.1Å
259	E	96.1	Very high	94.8	Very high	89 Å²	89	46.2 Å²	46.2	42%	0.416	22%	0.22	S	C	.	.	H	α-helix	trans	-64.2	-42.3	175.6	-72.2	163.7	138.1	0	0	111.2	T256 F261 K262 A263	T256-E259 WeakPolarHBondContact CB-OE2 3.21Å; T256-E259 PolarHBondContact N-OE2 2.81Å; T256-E259 PolarHBondContact O-N 2.72Å; T256-E259 VanDerWaalsContact O-N 3.11Å; T256-E259 VanDerWaalsContact OG1-CD 3.26Å; T256-E259 VanDerWaalsContact OG1-CG 3.23Å; T256-E259 WeakPolarHBondContact OG1-CG 3.47Å; T256-E259 PolarHBondContact OG1-N 3.43Å; T256-E259 PolarHBondContact OG1-OE2 3.06Å; E259-F261 PolarHBondContact O-N 3.46Å; E259-K262 PolarHBondContact O-N 3.01Å; E259-A263 VanDerWaalsContact O-CB 3.26Å; E259-A263 WeakPolarHBondContact O-CB 3.35Å; E259-A263 PolarHBondContact O-N 3.4Å
260	L	97.2	Very high	94.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-41.6	175.9	-61.1	-178	0	0	0	111.9	F226 L247 L252 C255 T256 E257 A263 T264 I285	F226-L260 HydrophobicContact CD1-CD2 4Å; F226-L260 HydrophobicContact CE1-CD2 3.68Å; L247-L260 HydrophobicContact CD2-CB 3.97Å; L247-L260 HydrophobicContact CD2-CD1 4.42Å; L247-L260 HydrophobicContact CD2-CD2 4.14Å; L247-L260 HydrophobicContact CD2-CG 4.39Å; L252-L260 HydrophobicContact CD2-CD1 3.71Å; L252-L260 HydrophobicContact CD2-CD2 3.72Å; L252-L260 HydrophobicContact CD2-CG 4.36Å; C255-L260 HydrophobicContact CB-CD2 3.7Å; C255-L260 HydrophobicContact CB-CG 4.06Å; T256-L260 WeakPolarHBondContact O-CG 3.41Å; T256-L260 PolarHBondContact O-N 2.72Å; T256-L260 VanDerWaalsContact O-N 3.11Å; E257-L260 PolarHBondContact O-N 2.99Å; L260-A263 PolarHBondContact O-N 3.43Å; L260-T264 WeakPolarHBondContact O-CB 3.28Å; L260-T264 PolarHBondContact O-N 3.31Å; L260-T264 PolarHBondContact O-OG1 3.27Å; L260-I285 HydrophobicContact CB-CD1 3.65Å
261	F	98.2	Very high	94.6	Very high	4 Å²	4	52 Å²	52	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-49.6	174.1	172.5	-106	0	0	0	111.9	E257 L258 E259 A263 T264 C265 M282 I285 F287 M290 V299 V302 M305	E257-F261 WeakPolarHBondContact O-CB 3.46Å; E257-F261 PolarHBondContact O-N 2.81Å; L258-F261 PolarHBondContact O-N 3.19Å; E259-F261 PolarHBondContact O-N 3.46Å; F261-A263 VanDerWaalsContact C-N 3.35Å; F261-A263 PolarHBondContact O-N 3.43Å; F261-T264 PolarHBondContact O-N 3.39Å; F261-C265 VanDerWaalsContact CZ-SG 3.59Å; F261-C265 PolarHBondContact O-N 3.22Å; F261-C265 PolarHBondContact O-SG 3.38Å; F261-M282 HydrophobicContact CD2-CE 3.79Å; F261-M282 HydrophobicContact CD2-SD 3.69Å; F261-M282 HydrophobicContact CE2-CE 3.63Å; F261-M282 HydrophobicContact CE2-SD 3.86Å; F261-I285 HydrophobicContact CB-CG2 4.24Å; F261-F287 AromaticContact CD2-CE1 3.54Å; F261-F287 HydrophobicContact CD2-CE1 3.54Å; F261-F287 AromaticContact CD2-CZ 3.79Å; F261-F287 HydrophobicContact CD2-CZ 3.79Å; F261-F287 AromaticContact CE2-CE1 3.93Å; F261-F287 HydrophobicContact CE2-CE1 3.93Å; F261-F287 HydrophobicContact CE2-CZ 4.12Å; F261-F287 HydrophobicContact CG-CE1 4.17Å; F261-M290 HydrophobicContact CB-CE 3.81Å; F261-M290 HydrophobicContact CG-CE 4.43Å; F261-V299 HydrophobicContact CD1-CG2 3.95Å; F261-V299 HydrophobicContact CE1-CB 4.21Å; F261-V299 HydrophobicContact CE1-CG1 4.44Å; F261-V299 HydrophobicContact CE1-CG2 3.9Å; F261-V299 HydrophobicContact CE2-CG1 4.06Å; F261-V299 HydrophobicContact CG-CG2 4.33Å; F261-V299 HydrophobicContact CZ-CB 4.17Å; F261-V299 HydrophobicContact CZ-CG1 3.93Å; F261-V299 HydrophobicContact CZ-CG2 4.21Å; F261-V302 HydrophobicContact CE1-CG2 4.07Å; F261-V302 HydrophobicContact CZ-CB 4.21Å; F261-V302 HydrophobicContact CZ-CG2 3.73Å; F261-M305 HydrophobicContact CE2-CG 4.04Å; F261-M305 HydrophobicContact CE2-SD 3.98Å; F261-M305 HydrophobicContact CZ-CG 4.12Å
262	K	97.1	Very high	94.4	Very high	85 Å²	85	56.5 Å²	56.5	37%	0.37	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-44.2	178	-74.8	173.1	178	171.9	0	111.2	L258 E259 C265 R266	L258-K262 HydrophobicContact CD1-CD 4.47Å; L258-K262 HydrophobicContact CG-CD 4.22Å; L258-K262 WeakPolarHBondContact O-CB 3.44Å; L258-K262 WeakPolarHBondContact O-CG 3.39Å; L258-K262 PolarHBondContact O-N 3.44Å; E259-K262 PolarHBondContact O-N 3.01Å; K262-C265 PolarHBondContact O-N 2.84Å; K262-R266 WeakPolarHBondContact O-CG 3.45Å; K262-R266 PolarHBondContact O-N 2.8Å
263	A	96.9	Very high	94.5	Very high	2 Å²	2	60.4 Å²	60.4	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-46	176.2	0	0	0	0	0	111.7	L230 F235 E259 L260 F261 C265 R266 W267	L230-A263 HydrophobicContact CD2-CB 3.4Å; L230-A263 VanDerWaalsContact CD2-CB 3.4Å; F235-A263 HydrophobicContact CE2-CB 4.09Å; F235-A263 WeakPolarHBondContact CE2-O 3.39Å; F235-A263 HydrophobicContact CZ-CB 4.43Å; E259-A263 VanDerWaalsContact O-CB 3.26Å; E259-A263 WeakPolarHBondContact O-CB 3.35Å; E259-A263 PolarHBondContact O-N 3.4Å; L260-A263 PolarHBondContact O-N 3.43Å; F261-A263 VanDerWaalsContact C-N 3.35Å; F261-A263 PolarHBondContact O-N 3.43Å; A263-C265 VanDerWaalsContact C-N 3.34Å; A263-C265 PolarHBondContact O-N 3.29Å; A263-R266 WeakPolarHBondContact O-CB 3.49Å; A263-R266 PolarHBondContact O-N 3.48Å; A263-R266 VanDerWaalsContact O-N 3.13Å; A263-W267 PolarHBondContact O-N 3.35Å
264	T	97.8	Very high	95.1	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-43.7	177.1	-57	0	0	0	0	111.1	L247 L260 F261 R266 W267 L268 L281 M282	L247-T264 HydrophobicContact CD1-CG2 4.31Å; L247-T264 WeakPolarHBondContact CD1-OG1 3.36Å; L260-T264 WeakPolarHBondContact O-CB 3.28Å; L260-T264 PolarHBondContact O-N 3.31Å; L260-T264 PolarHBondContact O-OG1 3.27Å; F261-T264 PolarHBondContact O-N 3.39Å; T264-R266 VanDerWaalsContact C-N 3.34Å; T264-R266 PolarHBondContact O-N 3.25Å; T264-W267 PolarHBondContact O-N 2.72Å; T264-L268 HydrophobicContact CG2-CD1 4.05Å; T264-L268 HydrophobicContact CG2-CG 4.44Å; T264-L268 VanDerWaalsContact O-CG 3.29Å; T264-L268 WeakPolarHBondContact O-CG 3.46Å; T264-L268 PolarHBondContact O-N 2.88Å; T264-L281 HydrophobicContact CG2-CB 3.68Å; T264-L281 HydrophobicContact CG2-CD1 3.95Å; T264-L281 HydrophobicContact CG2-CG 4.44Å; T264-M282 HydrophobicContact CG2-CE 3.83Å; T264-M282 HydrophobicContact CG2-SD 4.25Å
265	C	97.1	Very high	95.5	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.061	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-41	174.5	-68.5	0	0	0	0	112.4	F261 K262 A263 L268 R269	F261-C265 VanDerWaalsContact CZ-SG 3.59Å; F261-C265 PolarHBondContact O-N 3.22Å; F261-C265 PolarHBondContact O-SG 3.38Å; K262-C265 PolarHBondContact O-N 2.84Å; A263-C265 VanDerWaalsContact C-N 3.34Å; A263-C265 PolarHBondContact O-N 3.29Å; C265-L268 PolarHBondContact O-N 3.4Å; C265-R269 WeakPolarHBondContact O-CB 3.43Å; C265-R269 VanDerWaalsContact O-CG 3.28Å; C265-R269 WeakPolarHBondContact O-CG 3.33Å; C265-R269 PolarHBondContact O-N 3.17Å; C265-R269 VanDerWaalsContact O-N 3.11Å
266	R	96.6	Very high	95.7	Very high	127 Å²	127	59.2 Å²	59.2	48%	0.479	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-41.6	175.2	-69.1	-169.9	-59.7	-173.1	8.4	111.8	L230 F235 L236 K262 A263 T264 R269 L270	L230-R266 PolarHBondContact O-NH2 2.8Å; F235-R266 HydrophobicContact CZ-CB 4.14Å; L236-R266 HydrophobicContact CD2-CB 4.17Å; K262-R266 WeakPolarHBondContact O-CG 3.45Å; K262-R266 PolarHBondContact O-N 2.8Å; A263-R266 WeakPolarHBondContact O-CB 3.49Å; A263-R266 PolarHBondContact O-N 3.48Å; A263-R266 VanDerWaalsContact O-N 3.13Å; T264-R266 VanDerWaalsContact C-N 3.34Å; T264-R266 PolarHBondContact O-N 3.25Å; R266-R269 PolarHBondContact O-N 2.99Å; R266-L270 PolarHBondContact O-N 3.48Å
267	W	97.4	Very high	95.8	Very high	6 Å²	6	58.8 Å²	58.8	2%	0.023	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-41.2	177.9	-175.3	97.2	0	0	0	112.4	F235 L236 L238 F240 L243 A263 T264 L270 R274 F277 L281	F235-W267 HydrophobicContact CE2-CB 4.31Å; L236-W267 HydrophobicContact CD2-CB 4.36Å; L238-W267 PolarHBondContact O-NE1 3.35Å; F240-W267 HydrophobicContact CB-CH2 4.06Å; F240-W267 HydrophobicContact CB-CZ2 4.39Å; L243-W267 HydrophobicContact CD2-CB 3.95Å; L243-W267 HydrophobicContact CD2-CD2 3.54Å; L243-W267 HydrophobicContact CD2-CE3 4.04Å; L243-W267 HydrophobicContact CD2-CG 3.48Å; L243-W267 VanDerWaalsContact CD2-CG 3.48Å; A263-W267 PolarHBondContact O-N 3.35Å; T264-W267 PolarHBondContact O-N 2.72Å; W267-L270 PolarHBondContact O-N 3.48Å; W267-R274 VanDerWaalsContact CE2-NH1 3.3Å; W267-R274 HydrophobicContact CE3-CB 4.25Å; W267-R274 HydrophobicContact CE3-CG 4.47Å; W267-R274 HydrophobicContact CH2-CB 4.18Å; W267-R274 HydrophobicContact CH2-CG 3.86Å; W267-R274 HydrophobicContact CZ2-CG 4.43Å; W267-R274 HydrophobicContact CZ3-CB 3.72Å; W267-R274 HydrophobicContact CZ3-CG 3.89Å; W267-R274 VanDerWaalsContact NE1-NH1 3.16Å; W267-R274 WeakPolarHBondContact O-CD 3.31Å; W267-R274 PolarHBondContact O-NH1 3.06Å; W267-F277 HydrophobicContact CH2-CD2 4.12Å; W267-F277 HydrophobicContact CZ3-CB 4.43Å; W267-F277 HydrophobicContact CZ3-CD2 4.29Å; W267-L281 HydrophobicContact CE3-CD1 3.69Å; W267-L281 HydrophobicContact CZ3-CD1 3.67Å
268	L	97.1	Very high	95.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-38.2	178.2	-72.5	168.2	0	0	0	112.5	T264 C265 L270 R274 M275 F277 A278 L281 M282 F304	T264-L268 HydrophobicContact CG2-CD1 4.05Å; T264-L268 HydrophobicContact CG2-CG 4.44Å; T264-L268 VanDerWaalsContact O-CG 3.29Å; T264-L268 WeakPolarHBondContact O-CG 3.46Å; T264-L268 PolarHBondContact O-N 2.88Å; C265-L268 PolarHBondContact O-N 3.4Å; L268-L270 VanDerWaalsContact C-N 3.25Å; L268-L270 PolarHBondContact O-N 2.69Å; L268-R274 HydrophobicContact CD2-CB 4.46Å; L268-R274 WeakPolarHBondContact CD2-O 3.48Å; L268-M275 HydrophobicContact CB-CE 4.34Å; L268-M275 HydrophobicContact CB-SD 4.01Å; L268-F277 HydrophobicContact CD2-CB 4.49Å; L268-A278 HydrophobicContact CD1-CB 3.88Å; L268-A278 HydrophobicContact CD2-CB 4.16Å; L268-L281 HydrophobicContact CD2-CD1 4.08Å; L268-L281 HydrophobicContact CG-CD1 4.44Å; L268-M282 HydrophobicContact CD1-CE 3.96Å; L268-F304 HydrophobicContact CD1-CE1 4.31Å; L268-F304 HydrophobicContact CD1-CZ 3.87Å
269	R	95.4	Very high	95.9	Very high	161 Å²	161	58.5 Å²	58.5	61%	0.608	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-4.8	-178.4	-70.1	175.2	-172.2	-177.9	2.6	114.3	C265 R266 M275	C265-R269 WeakPolarHBondContact O-CB 3.43Å; C265-R269 VanDerWaalsContact O-CG 3.28Å; C265-R269 WeakPolarHBondContact O-CG 3.33Å; C265-R269 PolarHBondContact O-N 3.17Å; C265-R269 VanDerWaalsContact O-N 3.11Å; R266-R269 PolarHBondContact O-N 2.99Å; R269-M275 HydrophobicContact CB-CE 4.41Å; R269-M275 HydrophobicContact CG-CE 3.69Å
270	L	93.8	Very high	96	Very high	87 Å²	87	60 Å²	60	46%	0.455	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-39.9	-178.6	-169.6	70	0	0	0	111.9	L236 R266 W267 L268	L236-L270 HydrophobicContact CB-CD2 4.15Å; R266-L270 PolarHBondContact O-N 3.48Å; W267-L270 PolarHBondContact O-N 3.48Å; L268-L270 VanDerWaalsContact C-N 3.25Å; L268-L270 PolarHBondContact O-N 2.69Å
271	E	91.6	Very high	96.1	Very high	97 Å²	97	60 Å²	60	45%	0.453	28%	0.283	S	S	.	.	S	Bend	trans	-142.5	130.4	-176	-66.1	163.4	-165.8	0	0	108.8	P273 R274	E271-P273 VanDerWaalsContact C-CD 3.4Å; E271-R274 HydrophobicContact CB-CG 4.08Å; E271-R274 VanDerWaalsContact CD-NE 3.32Å; E271-R274 VanDerWaalsContact O-CB 3.3Å; E271-R274 WeakPolarHBondContact O-CB 3.41Å; E271-R274 PolarHBondContact O-N 3.04Å; E271-R274 IonicContact OE1-CZ 2.65Å; E271-R274 IonicContact OE1-NE 3.02Å; E271-R274 IonicContact OE1-NH2 3.79Å; E271-R274 PolarHBondContact OE1-NH2 3.4Å; E271-R274 IonicContact OE2-CZ 3.78Å; E271-R274 IonicContact OE2-NE 2.64Å; E271-R274 PolarHBondContact OE2-NE 3.24Å; E271-R274 IonicContact OE2-NH2 2.84Å; E271-R274 PolarHBondContact OE2-NH2 2.91Å
272	E	89.2	Confident	96	Very high	161 Å²	161	59.8 Å²	59.8	75%	0.752	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-48.8	-44.3	-178.6	-70.7	-65.8	154.7	0	0	114.5	R274 M275	E272-R274 PolarHBondContact O-N 3.42Å; E272-M275 WeakPolarHBondContact O-CB 3.3Å; E272-M275 PolarHBondContact O-N 3.35Å; E272-M275 VanDerWaalsContact O-N 3.12Å
273	P	94.9	Very high	96	Very high	88 Å²	88	60.8 Å²	60.8	57%	0.571	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-62	-18.2	179.6	-22.9	34.8	0	0	0	114.2	E271 M275 D276	E271-P273 VanDerWaalsContact C-CD 3.4Å; P273-M275 PolarHBondContact O-N 2.91Å; P273-D276 PolarHBondContact O-N 3.2Å
274	R	96.1	Very high	96.1	Very high	27 Å²	27	62.7 Å²	62.7	10%	0.102	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-71	-21.3	179.9	-66.2	179.5	-173.5	-159.9	2.8	112.3	L236 W267 L268 E271 E272 D276 F277	L236-R274 PolarHBondContact O-NH1 3.48Å; W267-R274 VanDerWaalsContact CE2-NH1 3.3Å; W267-R274 HydrophobicContact CE3-CB 4.25Å; W267-R274 HydrophobicContact CE3-CG 4.47Å; W267-R274 HydrophobicContact CH2-CB 4.18Å; W267-R274 HydrophobicContact CH2-CG 3.86Å; W267-R274 HydrophobicContact CZ2-CG 4.43Å; W267-R274 HydrophobicContact CZ3-CB 3.72Å; W267-R274 HydrophobicContact CZ3-CG 3.89Å; W267-R274 VanDerWaalsContact NE1-NH1 3.16Å; W267-R274 WeakPolarHBondContact O-CD 3.31Å; W267-R274 PolarHBondContact O-NH1 3.06Å; L268-R274 HydrophobicContact CD2-CB 4.46Å; L268-R274 WeakPolarHBondContact CD2-O 3.48Å; E271-R274 HydrophobicContact CB-CG 4.08Å; E271-R274 VanDerWaalsContact CD-NE 3.32Å; E271-R274 VanDerWaalsContact O-CB 3.3Å; E271-R274 WeakPolarHBondContact O-CB 3.41Å; E271-R274 PolarHBondContact O-N 3.04Å; E271-R274 IonicContact OE1-CZ 2.65Å; E271-R274 IonicContact OE1-NE 3.02Å; E271-R274 IonicContact OE1-NH2 3.79Å; E271-R274 PolarHBondContact OE1-NH2 3.4Å; E271-R274 IonicContact OE2-CZ 3.78Å; E271-R274 IonicContact OE2-NE 2.64Å; E271-R274 PolarHBondContact OE2-NE 3.24Å; E271-R274 IonicContact OE2-NH2 2.84Å; E271-R274 PolarHBondContact OE2-NH2 2.91Å; E272-R274 PolarHBondContact O-N 3.42Å; R274-D276 PolarHBondContact O-N 3.12Å; R274-F277 WeakPolarHBondContact O-CB 3.28Å; R274-F277 PolarHBondContact O-N 3.27Å
275	M	95.4	Very high	96.1	Very high	63 Å²	63	62.7 Å²	62.7	31%	0.31	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-59.6	-27.4	178.1	-70.3	-62.3	-178.5	0	0	112.8	L268 R269 E272 P273 F277 A278 F304	L268-M275 HydrophobicContact CB-CE 4.34Å; L268-M275 HydrophobicContact CB-SD 4.01Å; R269-M275 HydrophobicContact CB-CE 4.41Å; R269-M275 HydrophobicContact CG-CE 3.69Å; E272-M275 WeakPolarHBondContact O-CB 3.3Å; E272-M275 PolarHBondContact O-N 3.35Å; E272-M275 VanDerWaalsContact O-N 3.12Å; P273-M275 PolarHBondContact O-N 2.91Å; M275-F277 PolarHBondContact O-N 3.48Å; M275-F277 VanDerWaalsContact O-N 3.11Å; M275-A278 WeakPolarHBondContact O-CB 3.35Å; M275-A278 PolarHBondContact O-N 2.73Å; M275-F304 HydrophobicContact SD-CD1 4.46Å
276	D	95.3	Very high	96.1	Very high	134 Å²	134	63.1 Å²	63.1	72%	0.717	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-61.3	-20	173.8	-67.4	-16.6	0	0	0	113	P273 R274	P273-D276 PolarHBondContact O-N 3.2Å; R274-D276 PolarHBondContact O-N 3.12Å
277	F	96.9	Very high	96.2	Very high	64 Å²	64	57.1 Å²	57.1	28%	0.281	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-92.7	-4.2	176.7	-56.5	-64.9	0	0	0	113.8	F240 W267 L268 R274 M275 A279 K280 L281	F240-F277 HydrophobicContact CD1-CD1 4.28Å; F240-F277 HydrophobicContact CD1-CE1 4.33Å; F240-F277 HydrophobicContact CD2-CB 3.68Å; F240-F277 AromaticContact CD2-CD1 3.61Å; F240-F277 HydrophobicContact CD2-CD1 3.61Å; F240-F277 HydrophobicContact CD2-CD2 4.29Å; F240-F277 HydrophobicContact CD2-CE1 4.34Å; F240-F277 AromaticContact CD2-CG 3.59Å; F240-F277 HydrophobicContact CD2-CG 3.59Å; F240-F277 HydrophobicContact CE1-CD1 4.39Å; F240-F277 HydrophobicContact CE2-CB 3.78Å; F240-F277 AromaticContact CE2-CD1 3.72Å; F240-F277 HydrophobicContact CE2-CD1 3.72Å; F240-F277 AromaticContact CE2-CG 3.95Å; F240-F277 HydrophobicContact CE2-CG 3.95Å; F240-F277 AromaticContact CG-CD1 3.91Å; F240-F277 HydrophobicContact CG-CD1 3.91Å; F240-F277 HydrophobicContact CG-CE1 4.18Å; F240-F277 HydrophobicContact CG-CG 4.15Å; F240-F277 HydrophobicContact CZ-CD1 4.12Å; W267-F277 HydrophobicContact CH2-CD2 4.12Å; W267-F277 HydrophobicContact CZ3-CB 4.43Å; W267-F277 HydrophobicContact CZ3-CD2 4.29Å; L268-F277 HydrophobicContact CD2-CB 4.49Å; R274-F277 WeakPolarHBondContact O-CB 3.28Å; R274-F277 PolarHBondContact O-N 3.27Å; M275-F277 PolarHBondContact O-N 3.48Å; M275-F277 VanDerWaalsContact O-N 3.11Å; F277-A279 PolarHBondContact O-N 2.95Å; F277-K280 HydrophobicContact CD1-CD 4.35Å; F277-K280 PolarHBondContact O-N 2.81Å; F277-L281 HydrophobicContact CB-CD1 4.44Å; F277-L281 PolarHBondContact O-N 2.63Å
278	A	97	Very high	96.2	Very high	7 Å²	7	56.8 Å²	56.8	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-53.9	-55.7	-172.7	0	0	0	0	0	112.1	L268 M275 K280 L281 M282 F304	L268-A278 HydrophobicContact CD1-CB 3.88Å; L268-A278 HydrophobicContact CD2-CB 4.16Å; M275-A278 WeakPolarHBondContact O-CB 3.35Å; M275-A278 PolarHBondContact O-N 2.73Å; A278-K280 VanDerWaalsContact C-N 3.25Å; A278-K280 PolarHBondContact O-N 3.18Å; A278-L281 PolarHBondContact O-N 3.32Å; A278-M282 WeakPolarHBondContact O-CB 3.48Å; A278-M282 VanDerWaalsContact O-CG 3.26Å; A278-M282 WeakPolarHBondContact O-CG 3.41Å; A278-M282 PolarHBondContact O-N 2.86Å; A278-F304 HydrophobicContact CB-CD2 4.11Å; A278-F304 HydrophobicContact CB-CE2 4.21Å; A278-F304 HydrophobicContact CB-CG 4.45Å
279	A	97.3	Very high	96.1	Very high	18 Å²	18	58 Å²	58	15%	0.149	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-34.7	178.7	0	0	0	0	0	113.1	F277 K283 T310	F277-A279 PolarHBondContact O-N 2.95Å; A279-K283 WeakPolarHBondContact O-CG 3.33Å; A279-K283 PolarHBondContact O-N 3.01Å; A279-T310 HydrophobicContact CB-CG2 4.22Å
280	K	97.8	Very high	96.1	Very high	119 Å²	119	50.5 Å²	50.5	52%	0.517	25%	0.251	S	S	.	.	H	α-helix	trans	-72	-41	-179.8	-66.4	176.1	-177.2	168	0	111.9	F240 F277 A278	F240-K280 HydrophobicContact CE2-CB 4.03Å; F240-K280 HydrophobicContact CZ-CB 3.98Å; F240-K280 HydrophobicContact CZ-CD 4.03Å; F277-K280 HydrophobicContact CD1-CD 4.35Å; F277-K280 PolarHBondContact O-N 2.81Å; A278-K280 VanDerWaalsContact C-N 3.25Å; A278-K280 PolarHBondContact O-N 3.18Å
281	L	98.1	Very high	96.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-73.5	-40.8	177.4	-66.8	176.5	0	0	0	111.7	F240 L243 A244 L247 T264 W267 L268 F277 A278 K283 N284	F240-L281 HydrophobicContact CD2-CD1 4.42Å; F240-L281 HydrophobicContact CD2-CD2 3.83Å; F240-L281 HydrophobicContact CD2-CG 4.1Å; F240-L281 HydrophobicContact CE2-CD2 3.65Å; F240-L281 HydrophobicContact CE2-CG 3.87Å; L243-L281 HydrophobicContact CD2-CD1 3.95Å; L243-L281 HydrophobicContact CD2-CD2 4.42Å; L243-L281 HydrophobicContact CG-CD2 4.31Å; A244-L281 HydrophobicContact CB-CD2 3.87Å; L247-L281 HydrophobicContact CD1-CB 4.32Å; L247-L281 HydrophobicContact CD1-CD2 4.16Å; T264-L281 HydrophobicContact CG2-CB 3.68Å; T264-L281 HydrophobicContact CG2-CD1 3.95Å; T264-L281 HydrophobicContact CG2-CG 4.44Å; W267-L281 HydrophobicContact CE3-CD1 3.69Å; W267-L281 HydrophobicContact CZ3-CD1 3.67Å; L268-L281 HydrophobicContact CD2-CD1 4.08Å; L268-L281 HydrophobicContact CG-CD1 4.44Å; F277-L281 HydrophobicContact CB-CD1 4.44Å; F277-L281 PolarHBondContact O-N 2.63Å; A278-L281 PolarHBondContact O-N 3.32Å; L281-K283 PolarHBondContact O-N 3.44Å; L281-N284 WeakPolarHBondContact O-CB 3.43Å; L281-N284 PolarHBondContact O-N 3.33Å
282	M	97.9	Very high	96.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-29.2	-178.7	-69.2	-50.8	172.4	0	0	113	F261 T264 L268 A278 N284 I285 F287 F304 M305 L314	F261-M282 HydrophobicContact CD2-CE 3.79Å; F261-M282 HydrophobicContact CD2-SD 3.69Å; F261-M282 HydrophobicContact CE2-CE 3.63Å; F261-M282 HydrophobicContact CE2-SD 3.86Å; T264-M282 HydrophobicContact CG2-CE 3.83Å; T264-M282 HydrophobicContact CG2-SD 4.25Å; L268-M282 HydrophobicContact CD1-CE 3.96Å; A278-M282 WeakPolarHBondContact O-CB 3.48Å; A278-M282 VanDerWaalsContact O-CG 3.26Å; A278-M282 WeakPolarHBondContact O-CG 3.41Å; A278-M282 PolarHBondContact O-N 2.86Å; M282-N284 PolarHBondContact O-N 2.71Å; M282-N284 VanDerWaalsContact O-N 3.14Å; M282-I285 PolarHBondContact O-N 2.92Å; M282-I285 HydrophobicContact SD-CG1 4.19Å; M282-F287 HydrophobicContact CB-CE2 4.24Å; M282-F287 HydrophobicContact CB-CZ 4.37Å; M282-F287 WeakPolarHBondContact O-CE2 3.26Å; M282-F287 HydrophobicContact SD-CZ 3.88Å; M282-F304 HydrophobicContact CE-CE2 3.49Å; M282-F304 VanDerWaalsContact CE-CE2 3.49Å; M282-F304 HydrophobicContact CE-CZ 3.44Å; M282-F304 VanDerWaalsContact CE-CZ 3.44Å; M282-F304 HydrophobicContact CG-CE2 4.03Å; M282-M305 HydrophobicContact CG-SD 4Å; M282-M305 HydrophobicContact SD-SD 4.33Å; M282-L314 HydrophobicContact CB-CD1 3.82Å
283	K	97.3	Very high	96.6	Very high	106 Å²	106	46.3 Å²	46.3	46%	0.461	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.8	172.5	-77.7	178	-172.8	-170.1	0	113.9	A279 L281 T310 L314	A279-K283 WeakPolarHBondContact O-CG 3.33Å; A279-K283 PolarHBondContact O-N 3.01Å; L281-K283 PolarHBondContact O-N 3.44Å; K283-T310 HydrophobicContact CD-CG2 4.29Å; K283-T310 HydrophobicContact CG-CG2 4.05Å; K283-L314 HydrophobicContact CG-CD1 4.35Å
284	N	97.9	Very high	96.8	Very high	43 Å²	43	44.4 Å²	44.4	23%	0.23	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-8.9	-179.9	-60.6	-36.3	0	0	0	112.9	L247 L281 M282 R339	L247-N284 HydrophobicContact CB-CB 3.67Å; L281-N284 WeakPolarHBondContact O-CB 3.43Å; L281-N284 PolarHBondContact O-N 3.33Å; M282-N284 PolarHBondContact O-N 2.71Å; M282-N284 VanDerWaalsContact O-N 3.14Å; N284-R339 PolarHBondContact O-NH2 2.93Å
285	I	97.8	Very high	96.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-86.7	132.3	173.9	-54.9	-60.1	0	0	0	109.4	L247 L260 F261 M282 F287 M290	L247-I285 HydrophobicContact CD1-CD1 4.23Å; L247-I285 HydrophobicContact CD2-CD1 3.79Å; L247-I285 HydrophobicContact CG-CD1 4.44Å; L260-I285 HydrophobicContact CB-CD1 3.65Å; F261-I285 HydrophobicContact CB-CG2 4.24Å; M282-I285 PolarHBondContact O-N 2.92Å; M282-I285 HydrophobicContact SD-CG1 4.19Å; I285-F287 VanDerWaalsContact C-N 3.34Å; I285-F287 HydrophobicContact CB-CD2 4.26Å; I285-F287 HydrophobicContact CB-CE1 4.42Å; I285-F287 HydrophobicContact CB-CE2 3.79Å; I285-F287 HydrophobicContact CB-CZ 3.88Å; I285-F287 HydrophobicContact CG2-CD1 4.05Å; I285-F287 HydrophobicContact CG2-CD2 4.22Å; I285-F287 HydrophobicContact CG2-CE1 3.82Å; I285-F287 HydrophobicContact CG2-CE2 4.01Å; I285-F287 HydrophobicContact CG2-CG 4.25Å; I285-F287 HydrophobicContact CG2-CZ 3.81Å; I285-F287 WeakPolarHBondContact O-CD2 3.43Å; I285-F287 PolarHBondContact O-N 3.27Å; I285-M290 HydrophobicContact CG2-CE 3.65Å
286	R	97.4	Very high	96.9	Very high	18 Å²	18	44.9 Å²	44.9	7%	0.068	23%	0.226	C	C	.	.			trans	-92.8	66.5	-177.1	-58.3	-173.6	-175.1	179	4.7	110.7	N250 E257 P288 L289 D334 R335 A337 I338 R339	N250-R286 VanDerWaalsContact OD1-CZ 3.31Å; N250-R286 PolarHBondContact OD1-NH1 3.46Å; N250-R286 PolarHBondContact OD1-NH2 3.4Å; E257-R286 HydrophobicContact CG-CB 3.91Å; E257-R286 PolarHBondContact OE2-N 2.89Å; R286-P288 VanDerWaalsContact C-N 3.25Å; R286-P288 VanDerWaalsContact O-N 3.15Å; R286-L289 HydrophobicContact CB-CB 4.48Å; R286-L289 HydrophobicContact CB-CD1 3.66Å; R286-L289 HydrophobicContact CB-CG 3.85Å; R286-L289 HydrophobicContact CG-CD1 4.38Å; R286-L289 WeakPolarHBondContact O-CB 3.45Å; R286-L289 PolarHBondContact O-N 2.87Å; R286-D334 PolarHBondContact NE-O 2.75Å; R286-R335 VanDerWaalsContact CB-O 3.3Å; R286-R335 WeakPolarHBondContact CB-O 3.4Å; R286-A337 WeakPolarHBondContact CD-O 3.33Å; R286-A337 PolarHBondContact NH1-O 3.46Å; R286-I338 PolarHBondContact NH1-O 2.82Å; R286-R339 VanDerWaalsContact NH1-N 3.19Å
287	F	97.9	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-49.3	-36.5	178.7	-62.7	-76.1	0	0	0	114.7	F261 M282 I285 L289 M290 L295 V299 M305 L314 A318	F261-F287 AromaticContact CD2-CE1 3.54Å; F261-F287 HydrophobicContact CD2-CE1 3.54Å; F261-F287 AromaticContact CD2-CZ 3.79Å; F261-F287 HydrophobicContact CD2-CZ 3.79Å; F261-F287 AromaticContact CE2-CE1 3.93Å; F261-F287 HydrophobicContact CE2-CE1 3.93Å; F261-F287 HydrophobicContact CE2-CZ 4.12Å; F261-F287 HydrophobicContact CG-CE1 4.17Å; M282-F287 HydrophobicContact CB-CE2 4.24Å; M282-F287 HydrophobicContact CB-CZ 4.37Å; M282-F287 WeakPolarHBondContact O-CE2 3.26Å; M282-F287 HydrophobicContact SD-CZ 3.88Å; I285-F287 VanDerWaalsContact C-N 3.34Å; I285-F287 HydrophobicContact CB-CD2 4.26Å; I285-F287 HydrophobicContact CB-CE1 4.42Å; I285-F287 HydrophobicContact CB-CE2 3.79Å; I285-F287 HydrophobicContact CB-CZ 3.88Å; I285-F287 HydrophobicContact CG2-CD1 4.05Å; I285-F287 HydrophobicContact CG2-CD2 4.22Å; I285-F287 HydrophobicContact CG2-CE1 3.82Å; I285-F287 HydrophobicContact CG2-CE2 4.01Å; I285-F287 HydrophobicContact CG2-CG 4.25Å; I285-F287 HydrophobicContact CG2-CZ 3.81Å; I285-F287 WeakPolarHBondContact O-CD2 3.43Å; I285-F287 PolarHBondContact O-N 3.27Å; F287-L289 PolarHBondContact O-N 3.13Å; F287-M290 HydrophobicContact CD1-CE 3.56Å; F287-M290 HydrophobicContact CD1-SD 3.85Å; F287-M290 HydrophobicContact CE1-CE 3.9Å; F287-M290 HydrophobicContact CG-CE 4.45Å; F287-M290 WeakPolarHBondContact O-CB 3.37Å; F287-M290 PolarHBondContact O-N 3.49Å; F287-L295 HydrophobicContact CB-CD2 4.18Å; F287-L295 HydrophobicContact CD1-CD2 4.32Å; F287-V299 HydrophobicContact CD1-CG1 3.9Å; F287-V299 HydrophobicContact CD1-CG2 4.15Å; F287-V299 HydrophobicContact CE1-CG1 3.58Å; F287-V299 HydrophobicContact CE1-CG2 4.09Å; F287-V299 HydrophobicContact CZ-CG1 4.47Å; F287-M305 HydrophobicContact CE1-CE 4.02Å; F287-M305 HydrophobicContact CE2-CE 4.08Å; F287-M305 HydrophobicContact CZ-CE 3.63Å; F287-M305 HydrophobicContact CZ-SD 4.28Å; F287-L314 HydrophobicContact CD2-CB 3.97Å; F287-L314 HydrophobicContact CD2-CD1 4.48Å; F287-L314 HydrophobicContact CE2-CB 4.15Å; F287-L314 HydrophobicContact CE2-CD1 4.01Å; F287-A318 HydrophobicContact CB-CB 3.56Å
288	P	97.3	Very high	97	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59.9	-15.3	174.8	-26	35.9	0	0	0	115.3	R286 E317 A318 Y321 Q322 T336	R286-P288 VanDerWaalsContact C-N 3.25Å; R286-P288 VanDerWaalsContact O-N 3.15Å; P288-E317 HydrophobicContact CG-CG 4.27Å; P288-A318 HydrophobicContact CG-CB 4.27Å; P288-Y321 HydrophobicContact CB-CD1 3.96Å; P288-Y321 HydrophobicContact CB-CG 3.94Å; P288-Q322 PolarHBondContact O-NE2 3.15Å; P288-T336 HydrophobicContact CB-CG2 3.79Å; P288-T336 HydrophobicContact CG-CG2 4.02Å
289	L	95.3	Very high	97	Very high	25 Å²	25	44.9 Å²	44.9	13%	0.131	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-87.8	-9.7	174.7	-55.9	-176.8	0	0	0	113.4	E257 R286 F287 T336 A337 R420 Y421	E257-L289 HydrophobicContact CG-CB 4.11Å; E257-L289 HydrophobicContact CG-CD1 4.14Å; R286-L289 HydrophobicContact CB-CB 4.48Å; R286-L289 HydrophobicContact CB-CD1 3.66Å; R286-L289 HydrophobicContact CB-CG 3.85Å; R286-L289 HydrophobicContact CG-CD1 4.38Å; R286-L289 WeakPolarHBondContact O-CB 3.45Å; R286-L289 PolarHBondContact O-N 2.87Å; F287-L289 PolarHBondContact O-N 3.13Å; L289-T336 VanDerWaalsContact CD2-O 3.26Å; L289-T336 WeakPolarHBondContact CD2-O 3.29Å; L289-A337 WeakPolarHBondContact CD1-O 3.34Å; L289-R420 VanDerWaalsContact CD2-CD 3.45Å; L289-R420 HydrophobicContact CD2-CG 4.22Å; L289-Y421 WeakPolarHBondContact O-CE1 3.23Å; L289-Y421 PolarHBondContact O-OH 2.67Å
290	M	95.9	Very high	97	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.015	23%	0.233	C	C	.	.	S	Bend	trans	-79.1	149.7	174.1	-60.9	180	-169.8	0	0	110.7	E257 F261 I285 F287 E294 L295 V299 Q322	E257-M290 VanDerWaalsContact C-CE 3.47Å; E257-M290 HydrophobicContact CB-CE 3.78Å; E257-M290 HydrophobicContact CB-CG 4.04Å; E257-M290 VanDerWaalsContact O-CE 3.29Å; E257-M290 WeakPolarHBondContact O-CE 3.14Å; F261-M290 HydrophobicContact CB-CE 3.81Å; F261-M290 HydrophobicContact CG-CE 4.43Å; I285-M290 HydrophobicContact CG2-CE 3.65Å; F287-M290 HydrophobicContact CD1-CE 3.56Å; F287-M290 HydrophobicContact CD1-SD 3.85Å; F287-M290 HydrophobicContact CE1-CE 3.9Å; F287-M290 HydrophobicContact CG-CE 4.45Å; F287-M290 WeakPolarHBondContact O-CB 3.37Å; F287-M290 PolarHBondContact O-N 3.49Å; M290-E294 HydrophobicContact CB-CB 4.19Å; M290-L295 HydrophobicContact CB-CD2 3.94Å; M290-L295 HydrophobicContact CB-CG 4.02Å; M290-L295 HydrophobicContact CG-CD2 4.48Å; M290-L295 HydrophobicContact SD-CD2 3.91Å; M290-V299 HydrophobicContact CE-CG2 4.31Å; M290-V299 HydrophobicContact SD-CG2 3.58Å; M290-V299 VanDerWaalsContact SD-CG2 3.58Å; M290-Q322 PolarHBondContact O-NE2 3.23Å
291	T	94.5	Very high	96.9	Very high	47 Å²	47	46.6 Å²	46.6	29%	0.288	23%	0.234	S	C	.	.			trans	-68.8	156.8	172.6	65.4	0	0	0	0	111.1	Q293 E294 L295 Y421	T291-Q293 PolarHBondContact O-N 2.78Å; T291-E294 WeakPolarHBondContact CB-OE2 3.32Å; T291-E294 PolarHBondContact N-OE2 3Å; T291-E294 PolarHBondContact O-N 3.38Å; T291-E294 VanDerWaalsContact OG1-CD 3.3Å; T291-E294 WeakPolarHBondContact OG1-CG 3.41Å; T291-E294 PolarHBondContact OG1-N 2.82Å; T291-E294 PolarHBondContact OG1-OE2 3.18Å; T291-L295 PolarHBondContact O-N 3.16Å; T291-L295 VanDerWaalsContact O-N 3.12Å; T291-Y421 HydrophobicContact CG2-CE1 4.49Å
292	P	95.6	Very high	96.9	Very high	65 Å²	65	47.1 Å²	47.1	42%	0.422	24%	0.237	S	C	.	.	H	α-helix	trans	-54.9	-37.5	176.1	-27	34.5	0	0	0	113.6	L295 I296 Q322	P292-L295 PolarHBondContact O-N 3.35Å; P292-I296 WeakPolarHBondContact O-CG1 3.43Å; P292-I296 PolarHBondContact O-N 2.64Å; P292-I296 VanDerWaalsContact O-N 3.1Å; P292-Q322 HydrophobicContact CG-CB 4.21Å
293	Q	95.8	Very high	96.8	Very high	145 Å²	145	52 Å²	52	68%	0.678	26%	0.263	S	S	*	.	H	α-helix	trans	-65.6	-39.4	178.7	-68.3	175.4	-5.1	0	0	111.6	T291 N297	T291-Q293 PolarHBondContact O-N 2.78Å; Q293-N297 WeakPolarHBondContact O-CB 3.41Å; Q293-N297 VanDerWaalsContact O-CG 3.26Å; Q293-N297 PolarHBondContact O-N 3.1Å; Q293-N297 PolarHBondContact O-ND2 2.94Å
294	E	97.3	Very high	96.7	Very high	48 Å²	48	48.4 Å²	48.4	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-68.1	-41.3	178.4	-69.3	168.4	130.5	0	0	112	L258 M290 T291 Y298 V299	L258-E294 HydrophobicContact CD1-CB 4.43Å; L258-E294 HydrophobicContact CD2-CB 4.44Å; L258-E294 HydrophobicContact CD2-CG 3.91Å; L258-E294 WeakPolarHBondContact CD2-OE1 3.25Å; M290-E294 HydrophobicContact CB-CB 4.19Å; T291-E294 WeakPolarHBondContact CB-OE2 3.32Å; T291-E294 PolarHBondContact N-OE2 3Å; T291-E294 PolarHBondContact O-N 3.38Å; T291-E294 VanDerWaalsContact OG1-CD 3.3Å; T291-E294 WeakPolarHBondContact OG1-CG 3.41Å; T291-E294 PolarHBondContact OG1-N 2.82Å; T291-E294 PolarHBondContact OG1-OE2 3.18Å; E294-Y298 HydrophobicContact CB-CD2 4.39Å; E294-Y298 HydrophobicContact CG-CD2 4.49Å; E294-Y298 WeakPolarHBondContact O-CB 3.47Å; E294-Y298 PolarHBondContact O-N 2.93Å; E294-V299 PolarHBondContact O-N 3.06Å
295	L	97.6	Very high	96.7	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.026	24%	0.236	C	C	.	.	I	π-helix	trans	-60.1	-47.4	176.6	-67.6	173.2	0	0	0	111.3	F287 M290 T291 P292 V299 Q300 L315 A318 Q322	F287-L295 HydrophobicContact CB-CD2 4.18Å; F287-L295 HydrophobicContact CD1-CD2 4.32Å; M290-L295 HydrophobicContact CB-CD2 3.94Å; M290-L295 HydrophobicContact CB-CG 4.02Å; M290-L295 HydrophobicContact CG-CD2 4.48Å; M290-L295 HydrophobicContact SD-CD2 3.91Å; T291-L295 PolarHBondContact O-N 3.16Å; T291-L295 VanDerWaalsContact O-N 3.12Å; P292-L295 PolarHBondContact O-N 3.35Å; L295-V299 HydrophobicContact CD2-CB 4.48Å; L295-V299 HydrophobicContact CD2-CG2 4.21Å; L295-V299 WeakPolarHBondContact O-CB 3.37Å; L295-V299 PolarHBondContact O-N 2.96Å; L295-Q300 WeakPolarHBondContact O-CB 3.5Å; L295-Q300 PolarHBondContact O-N 3.44Å; L295-L315 HydrophobicContact CB-CD1 4.46Å; L295-L315 HydrophobicContact CD2-CD1 4.19Å; L295-A318 HydrophobicContact CD1-CB 3.91Å; L295-A318 HydrophobicContact CD2-CB 4.06Å; L295-Q322 HydrophobicContact CD1-CG 4.2Å
296	I	96.8	Very high	96.6	Very high	96 Å²	96	52.7 Å²	52.7	49%	0.492	26%	0.26	S	S	.	.	I	π-helix	trans	-71.8	-49	-177.6	-65.4	167.2	0	0	0	111.3	P292	P292-I296 WeakPolarHBondContact O-CG1 3.43Å; P292-I296 PolarHBondContact O-N 2.64Å; P292-I296 VanDerWaalsContact O-N 3.1Å
297	N	97.4	Very high	96.5	Very high	94 Å²	94	57.4 Å²	57.4	50%	0.503	29%	0.291	S	S	.	.	I	π-helix	trans	-81.9	-24.3	-168.9	-63.7	-20.8	0	0	0	113.4	Q293 T301	Q293-N297 WeakPolarHBondContact O-CB 3.41Å; Q293-N297 VanDerWaalsContact O-CG 3.26Å; Q293-N297 PolarHBondContact O-N 3.1Å; Q293-N297 PolarHBondContact O-ND2 2.94Å; N297-T301 VanDerWaalsContact O-CG2 3.29Å; N297-T301 WeakPolarHBondContact O-CG2 3.48Å
298	Y	97.6	Very high	96.5	Very high	110 Å²	110	60.1 Å²	60.1	43%	0.431	31%	0.305	S	S	.	.	I	π-helix	trans	-121.7	-41.9	-175.7	-57.6	-69.2	0	0	0	114.2	L258 E294 T301	L258-Y298 HydrophobicContact CD1-CD2 3.92Å; L258-Y298 HydrophobicContact CD1-CG 4.02Å; L258-Y298 HydrophobicContact CD2-CD2 3.88Å; L258-Y298 HydrophobicContact CD2-CE2 4.1Å; E294-Y298 HydrophobicContact CB-CD2 4.39Å; E294-Y298 HydrophobicContact CG-CD2 4.49Å; E294-Y298 WeakPolarHBondContact O-CB 3.47Å; E294-Y298 PolarHBondContact O-N 2.93Å; Y298-T301 PolarHBondContact O-OG1 3.2Å
299	V	97.6	Very high	96.5	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.336	C	S	.	.	I	π-helix	trans	-81.3	-49.9	-173.9	-177.9	0	0	0	0	111.3	F261 F287 M290 E294 L295 T301 V302 M305 L315	F261-V299 HydrophobicContact CD1-CG2 3.95Å; F261-V299 HydrophobicContact CE1-CB 4.21Å; F261-V299 HydrophobicContact CE1-CG1 4.44Å; F261-V299 HydrophobicContact CE1-CG2 3.9Å; F261-V299 HydrophobicContact CE2-CG1 4.06Å; F261-V299 HydrophobicContact CG-CG2 4.33Å; F261-V299 HydrophobicContact CZ-CB 4.17Å; F261-V299 HydrophobicContact CZ-CG1 3.93Å; F261-V299 HydrophobicContact CZ-CG2 4.21Å; F287-V299 HydrophobicContact CD1-CG1 3.9Å; F287-V299 HydrophobicContact CD1-CG2 4.15Å; F287-V299 HydrophobicContact CE1-CG1 3.58Å; F287-V299 HydrophobicContact CE1-CG2 4.09Å; F287-V299 HydrophobicContact CZ-CG1 4.47Å; M290-V299 HydrophobicContact CE-CG2 4.31Å; M290-V299 HydrophobicContact SD-CG2 3.58Å; M290-V299 VanDerWaalsContact SD-CG2 3.58Å; E294-V299 PolarHBondContact O-N 3.06Å; L295-V299 HydrophobicContact CD2-CB 4.48Å; L295-V299 HydrophobicContact CD2-CG2 4.21Å; L295-V299 WeakPolarHBondContact O-CB 3.37Å; L295-V299 PolarHBondContact O-N 2.96Å; V299-T301 PolarHBondContact O-N 2.75Å; V299-V302 PolarHBondContact O-N 3.11Å; V299-M305 HydrophobicContact CG1-CE 3.7Å; V299-M305 HydrophobicContact CG1-CG 4.15Å; V299-L315 HydrophobicContact CG1-CD1 4.09Å
300	Q	96.1	Very high	96.6	Very high	89 Å²	89	66.6 Å²	66.6	42%	0.416	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-21.6	-178	-170.6	175.6	3.9	0	0	112.9	L295 V302 R306 L315	L295-Q300 WeakPolarHBondContact O-CB 3.5Å; L295-Q300 PolarHBondContact O-N 3.44Å; Q300-V302 PolarHBondContact O-N 3.23Å; Q300-R306 WeakPolarHBondContact O-CD 3.41Å; Q300-R306 PolarHBondContact O-NE 3.07Å; Q300-R306 VanDerWaalsContact O-NE 3.16Å; Q300-L315 HydrophobicContact CB-CD2 4.17Å; Q300-L315 HydrophobicContact CG-CD2 4.15Å
301	T	96.8	Very high	96.7	Very high	85 Å²	85	66.4 Å²	66.4	52%	0.521	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-12.8	178.4	62.6	0	0	0	0	113.4	N297 Y298 V299	N297-T301 VanDerWaalsContact O-CG2 3.29Å; N297-T301 WeakPolarHBondContact O-CG2 3.48Å; Y298-T301 PolarHBondContact O-OG1 3.2Å; V299-T301 PolarHBondContact O-N 2.75Å
302	V	97.1	Very high	96.9	Very high	10 Å²	10	66.2 Å²	66.2	6%	0.061	34%	0.339	C	S	.	.	S	Bend	trans	-87	126	178.9	179.5	0	0	0	0	110.9	F261 V299 Q300 F304 M305	F261-V302 HydrophobicContact CE1-CG2 4.07Å; F261-V302 HydrophobicContact CZ-CB 4.21Å; F261-V302 HydrophobicContact CZ-CG2 3.73Å; V299-V302 PolarHBondContact O-N 3.11Å; Q300-V302 PolarHBondContact O-N 3.23Å; V302-F304 HydrophobicContact CG1-CD1 3.65Å; V302-F304 HydrophobicContact CG1-CD2 4.45Å; V302-F304 HydrophobicContact CG1-CE1 3.29Å; V302-F304 HydrophobicContact CG1-CE2 4.15Å; V302-F304 HydrophobicContact CG1-CG 4.22Å; V302-F304 HydrophobicContact CG1-CZ 3.57Å; V302-F304 PolarHBondContact O-N 3.34Å; V302-M305 HydrophobicContact CB-CB 4.45Å; V302-M305 HydrophobicContact CB-CG 3.98Å; V302-M305 HydrophobicContact CG1-CG 4.22Å; V302-M305 WeakPolarHBondContact O-CB 3.42Å; V302-M305 PolarHBondContact O-N 3.4Å
303	D	95.6	Very high	97	Very high	104 Å²	104	67 Å²	67	56%	0.556	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-49.2	-170.4	-66.2	-23.5	0	0	0	114.4	M305 R306 T307	D303-M305 PolarHBondContact O-N 2.72Å; D303-R306 WeakPolarHBondContact O-CA 3.48Å; D303-R306 WeakPolarHBondContact O-CB 3.48Å; D303-R306 PolarHBondContact O-N 3.39Å; D303-R306 IonicContact OD1-CZ 3.11Å; D303-R306 IonicContact OD1-NH2 3.91Å; D303-R306 PolarHBondContact OD1-NH2 2.92Å; D303-T307 PolarHBondContact O-N 3.29Å; D303-T307 PolarHBondContact O-OG1 3.3Å
304	F	95.8	Very high	97.1	Very high	29 Å²	29	60.3 Å²	60.3	13%	0.127	31%	0.309	C	S	.	.	H	α-helix	trans	-66.7	-18.4	-179.8	66.7	-103.3	0	0	0	113.3	L268 M275 A278 M282 V302 R306 T307 D308 C311	L268-F304 HydrophobicContact CD1-CE1 4.31Å; L268-F304 HydrophobicContact CD1-CZ 3.87Å; M275-F304 HydrophobicContact SD-CD1 4.46Å; A278-F304 HydrophobicContact CB-CD2 4.11Å; A278-F304 HydrophobicContact CB-CE2 4.21Å; A278-F304 HydrophobicContact CB-CG 4.45Å; M282-F304 HydrophobicContact CE-CE2 3.49Å; M282-F304 VanDerWaalsContact CE-CE2 3.49Å; M282-F304 HydrophobicContact CE-CZ 3.44Å; M282-F304 VanDerWaalsContact CE-CZ 3.44Å; M282-F304 HydrophobicContact CG-CE2 4.03Å; V302-F304 HydrophobicContact CG1-CD1 3.65Å; V302-F304 HydrophobicContact CG1-CD2 4.45Å; V302-F304 HydrophobicContact CG1-CE1 3.29Å; V302-F304 HydrophobicContact CG1-CE2 4.15Å; V302-F304 HydrophobicContact CG1-CG 4.22Å; V302-F304 HydrophobicContact CG1-CZ 3.57Å; V302-F304 PolarHBondContact O-N 3.34Å; F304-R306 PolarHBondContact O-N 3.48Å; F304-T307 WeakPolarHBondContact CA-OG1 3.33Å; F304-D308 WeakPolarHBondContact O-CB 3.26Å; F304-D308 PolarHBondContact O-N 3.06Å; F304-D308 VanDerWaalsContact O-N 3.07Å; F304-C311 WeakPolarHBondContact O-CB 3.46Å
305	M	97.5	Very high	97.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-69.9	-17	170.8	-64.9	-59.6	-58.9	0	0	112.4	F261 M282 F287 V299 V302 D303 C311 V312	F261-M305 HydrophobicContact CE2-CG 4.04Å; F261-M305 HydrophobicContact CE2-SD 3.98Å; F261-M305 HydrophobicContact CZ-CG 4.12Å; M282-M305 HydrophobicContact CG-SD 4Å; M282-M305 HydrophobicContact SD-SD 4.33Å; F287-M305 HydrophobicContact CE1-CE 4.02Å; F287-M305 HydrophobicContact CE2-CE 4.08Å; F287-M305 HydrophobicContact CZ-CE 3.63Å; F287-M305 HydrophobicContact CZ-SD 4.28Å; V299-M305 HydrophobicContact CG1-CE 3.7Å; V299-M305 HydrophobicContact CG1-CG 4.15Å; V302-M305 HydrophobicContact CB-CB 4.45Å; V302-M305 HydrophobicContact CB-CG 3.98Å; V302-M305 HydrophobicContact CG1-CG 4.22Å; V302-M305 WeakPolarHBondContact O-CB 3.42Å; V302-M305 PolarHBondContact O-N 3.4Å; D303-M305 PolarHBondContact O-N 2.72Å; M305-C311 HydrophobicContact CE-CB 4.04Å; M305-C311 HydrophobicContact SD-CB 3.74Å; M305-V312 WeakPolarHBondContact O-CG2 3.5Å
306	R	96.1	Very high	97.1	Very high	134 Å²	134	62.9 Å²	62.9	51%	0.506	32%	0.324	S	S	.	.	H	α-helix	trans	-107.9	-18.6	179.2	-63	-176.5	-71.5	131.7	-1.1	113.7	Q300 D303 F304 V312	Q300-R306 WeakPolarHBondContact O-CD 3.41Å; Q300-R306 PolarHBondContact O-NE 3.07Å; Q300-R306 VanDerWaalsContact O-NE 3.16Å; D303-R306 WeakPolarHBondContact O-CA 3.48Å; D303-R306 WeakPolarHBondContact O-CB 3.48Å; D303-R306 PolarHBondContact O-N 3.39Å; D303-R306 IonicContact OD1-CZ 3.11Å; D303-R306 IonicContact OD1-NH2 3.91Å; D303-R306 PolarHBondContact OD1-NH2 2.92Å; F304-R306 PolarHBondContact O-N 3.48Å; R306-V312 VanDerWaalsContact C-CG2 3.47Å; R306-V312 WeakPolarHBondContact O-CG2 3.34Å
307	T	95.8	Very high	97.2	Very high	116 Å²	116	60.7 Å²	60.7	71%	0.712	31%	0.311	S	S	*	.	H	α-helix	trans	-108.7	-32.5	-176.6	61.2	0	0	0	0	113.9	D303 F304	D303-T307 PolarHBondContact O-N 3.29Å; D303-T307 PolarHBondContact O-OG1 3.3Å; F304-T307 WeakPolarHBondContact CA-OG1 3.33Å
308	D	97.3	Very high	97.2	Very high	57 Å²	57	56.2 Å²	56.2	31%	0.305	29%	0.287	S	S	.	.	S	Bend	trans	-79.6	127.4	176.1	177.8	-92.4	0	0	0	110.9	F304 T310 C311 V312	F304-D308 WeakPolarHBondContact O-CB 3.26Å; F304-D308 PolarHBondContact O-N 3.06Å; F304-D308 VanDerWaalsContact O-N 3.07Å; D308-T310 VanDerWaalsContact C-N 3.28Å; D308-T310 PolarHBondContact O-N 3.49Å; D308-T310 WeakPolarHBondContact OD1-CA 3.1Å; D308-T310 WeakPolarHBondContact OD1-CB 3.49Å; D308-T310 PolarHBondContact OD1-N 2.82Å; D308-C311 HydrophobicContact CB-CB 4.12Å; D308-C311 PolarHBondContact O-N 2.85Å; D308-C311 PolarHBondContact OD1-N 3.32Å; D308-V312 VanDerWaalsContact O-CG2 3.28Å; D308-V312 WeakPolarHBondContact O-CG2 3.25Å; D308-V312 PolarHBondContact O-N 3Å
309	N	97.4	Very high	97.1	Very high	119 Å²	119	53 Å²	53	64%	0.636	28%	0.282	S	S	*	.	H	α-helix	trans	-60.9	-35	-176	-176.6	65.8	0	0	0	113	N313	N309-N313 PolarHBondContact O-N 3.45Å; N309-N313 PolarHBondContact O-ND2 3.04Å
310	T	97.9	Very high	97.1	Very high	42 Å²	42	57 Å²	57	26%	0.258	30%	0.303	S	S	.	.	H	α-helix	trans	-67.5	-50.2	176.9	-56.2	0	0	0	0	109.8	A279 K283 D308 V312 N313 L314	A279-T310 HydrophobicContact CB-CG2 4.22Å; K283-T310 HydrophobicContact CD-CG2 4.29Å; K283-T310 HydrophobicContact CG-CG2 4.05Å; D308-T310 VanDerWaalsContact C-N 3.28Å; D308-T310 PolarHBondContact O-N 3.49Å; D308-T310 WeakPolarHBondContact OD1-CA 3.1Å; D308-T310 WeakPolarHBondContact OD1-CB 3.49Å; D308-T310 PolarHBondContact OD1-N 2.82Å; T310-V312 VanDerWaalsContact C-N 3.34Å; T310-V312 PolarHBondContact O-N 3.39Å; T310-N313 PolarHBondContact O-N 3.38Å; T310-L314 HydrophobicContact CG2-CD1 4.49Å; T310-L314 WeakPolarHBondContact O-CG 3.36Å; T310-L314 PolarHBondContact O-N 3.48Å
311	C	97.9	Very high	97.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-38.4	-177.9	-63	0	0	0	0	112.6	F304 M305 D308 N313 L314 L315	F304-C311 WeakPolarHBondContact O-CB 3.46Å; M305-C311 HydrophobicContact CE-CB 4.04Å; M305-C311 HydrophobicContact SD-CB 3.74Å; D308-C311 HydrophobicContact CB-CB 4.12Å; D308-C311 PolarHBondContact O-N 2.85Å; D308-C311 PolarHBondContact OD1-N 3.32Å; C311-N313 VanDerWaalsContact C-N 3.34Å; C311-N313 PolarHBondContact O-N 3.37Å; C311-L314 WeakPolarHBondContact O-CB 3.42Å; C311-L314 PolarHBondContact O-N 3.08Å; C311-L315 PolarHBondContact O-N 2.94Å
312	V	98.1	Very high	97.1	Very high	42 Å²	42	50.5 Å²	50.5	26%	0.255	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-45.1	173.9	170.4	0	0	0	0	110.8	M305 R306 D308 T310 L314 L315 L316	M305-V312 WeakPolarHBondContact O-CG2 3.5Å; R306-V312 VanDerWaalsContact C-CG2 3.47Å; R306-V312 WeakPolarHBondContact O-CG2 3.34Å; D308-V312 VanDerWaalsContact O-CG2 3.28Å; D308-V312 WeakPolarHBondContact O-CG2 3.25Å; D308-V312 PolarHBondContact O-N 3Å; T310-V312 VanDerWaalsContact C-N 3.34Å; T310-V312 PolarHBondContact O-N 3.39Å; V312-L314 VanDerWaalsContact C-N 3.32Å; V312-L314 PolarHBondContact O-N 2.81Å; V312-L315 PolarHBondContact O-N 3.05Å; V312-L316 HydrophobicContact CG1-CD1 4.01Å; V312-L316 HydrophobicContact CG1-CG 4.34Å; V312-L316 WeakPolarHBondContact O-CG 3.42Å; V312-L316 PolarHBondContact O-N 3.17Å
313	N	98.2	Very high	97	Very high	82 Å²	82	57 Å²	57	44%	0.439	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-35.6	177.7	-74.5	-45.9	0	0	0	112.7	N309 T310 C311 L316 E317	N309-N313 PolarHBondContact O-N 3.45Å; N309-N313 PolarHBondContact O-ND2 3.04Å; T310-N313 PolarHBondContact O-N 3.38Å; C311-N313 VanDerWaalsContact C-N 3.34Å; C311-N313 PolarHBondContact O-N 3.37Å; N313-L316 PolarHBondContact O-N 3.07Å; N313-E317 WeakPolarHBondContact O-CB 3.45Å; N313-E317 PolarHBondContact O-N 2.86Å
314	L	98.4	Very high	97	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-63.3	-41.9	173.3	-64.1	174.1	0	0	0	111.9	M282 K283 F287 T310 C311 V312 A318	M282-L314 HydrophobicContact CB-CD1 3.82Å; K283-L314 HydrophobicContact CG-CD1 4.35Å; F287-L314 HydrophobicContact CD2-CB 3.97Å; F287-L314 HydrophobicContact CD2-CD1 4.48Å; F287-L314 HydrophobicContact CE2-CB 4.15Å; F287-L314 HydrophobicContact CE2-CD1 4.01Å; T310-L314 HydrophobicContact CG2-CD1 4.49Å; T310-L314 WeakPolarHBondContact O-CG 3.36Å; T310-L314 PolarHBondContact O-N 3.48Å; C311-L314 WeakPolarHBondContact O-CB 3.42Å; C311-L314 PolarHBondContact O-N 3.08Å; V312-L314 VanDerWaalsContact C-N 3.32Å; V312-L314 PolarHBondContact O-N 2.81Å; L314-A318 PolarHBondContact O-N 2.89Å; L314-A318 VanDerWaalsContact O-N 3.12Å
315	L	97.3	Very high	97	Very high	17 Å²	17	56.9 Å²	56.9	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-43.3	177.8	-175	60.3	0	0	0	111.3	L295 V299 Q300 C311 V312 E317 A318 S319	L295-L315 HydrophobicContact CB-CD1 4.46Å; L295-L315 HydrophobicContact CD2-CD1 4.19Å; V299-L315 HydrophobicContact CG1-CD1 4.09Å; Q300-L315 HydrophobicContact CB-CD2 4.17Å; Q300-L315 HydrophobicContact CG-CD2 4.15Å; C311-L315 PolarHBondContact O-N 2.94Å; V312-L315 PolarHBondContact O-N 3.05Å; L315-E317 PolarHBondContact O-N 2.83Å; L315-A318 PolarHBondContact O-N 3Å; L315-S319 PolarHBondContact O-N 2.88Å; L315-S319 PolarHBondContact O-OG 2.66Å
316	L	97.1	Very high	97	Very high	89 Å²	89	61.1 Å²	61.1	47%	0.466	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-43.3	176.7	-72.1	174.4	0	0	0	112.2	V312 N313 S319 N320	V312-L316 HydrophobicContact CG1-CD1 4.01Å; V312-L316 HydrophobicContact CG1-CG 4.34Å; V312-L316 WeakPolarHBondContact O-CG 3.42Å; V312-L316 PolarHBondContact O-N 3.17Å; N313-L316 PolarHBondContact O-N 3.07Å; L316-S319 PolarHBondContact O-N 3.43Å; L316-N320 WeakPolarHBondContact O-CB 3.44Å; L316-N320 PolarHBondContact O-N 3.24Å; L316-N320 PolarHBondContact O-ND2 3.25Å
317	E	97.7	Very high	97	Very high	50 Å²	50	56.4 Å²	56.4	23%	0.234	30%	0.3	C	S	.	.	H	α-helix	trans	-56.7	-50.8	173	174.6	-164.7	-139.6	0	0	111.1	P288 N313 L315 S319 N320 Y321 R335	P288-E317 HydrophobicContact CG-CG 4.27Å; N313-E317 WeakPolarHBondContact O-CB 3.45Å; N313-E317 PolarHBondContact O-N 2.86Å; L315-E317 PolarHBondContact O-N 2.83Å; E317-S319 PolarHBondContact O-N 2.86Å; E317-N320 PolarHBondContact O-N 3.36Å; E317-Y321 VanDerWaalsContact O-CB 3.29Å; E317-Y321 WeakPolarHBondContact O-CB 3.15Å; E317-Y321 PolarHBondContact O-N 2.93Å; E317-R335 IonicContact OE1-CZ 3.67Å; E317-R335 IonicContact OE1-NE 2.74Å; E317-R335 PolarHBondContact OE1-NE 3.22Å; E317-R335 IonicContact OE1-NH2 2.89Å; E317-R335 PolarHBondContact OE1-NH2 3.1Å; E317-R335 IonicContact OE2-CZ 3.46Å; E317-R335 IonicContact OE2-NE 2.94Å; E317-R335 PolarHBondContact OE2-NE 3.17Å; E317-R335 IonicContact OE2-NH2 3.23Å; E317-R335 PolarHBondContact OE2-NH2 3.07Å
318	A	97.8	Very high	97.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-44.2	-178.9	0	0	0	0	0	112.2	F287 P288 L295 L314 L315 Y321 Q322	F287-A318 HydrophobicContact CB-CB 3.56Å; P288-A318 HydrophobicContact CG-CB 4.27Å; L295-A318 HydrophobicContact CD1-CB 3.91Å; L295-A318 HydrophobicContact CD2-CB 4.06Å; L314-A318 PolarHBondContact O-N 2.89Å; L314-A318 VanDerWaalsContact O-N 3.12Å; L315-A318 PolarHBondContact O-N 3Å; A318-Y321 PolarHBondContact O-N 3.34Å; A318-Q322 WeakPolarHBondContact O-CB 3.41Å; A318-Q322 WeakPolarHBondContact O-CG 3.37Å; A318-Q322 PolarHBondContact O-N 3.26Å
319	S	96.3	Very high	97.1	Very high	44 Å²	44	48.7 Å²	48.7	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-60.3	-48.9	175.4	-64.8	0	0	0	0	111.7	L315 L316 E317 Y321 Q322 M323	L315-S319 PolarHBondContact O-N 2.88Å; L315-S319 PolarHBondContact O-OG 2.66Å; L316-S319 PolarHBondContact O-N 3.43Å; E317-S319 PolarHBondContact O-N 2.86Å; S319-Y321 VanDerWaalsContact C-N 3.33Å; S319-Y321 PolarHBondContact O-N 3.31Å; S319-Q322 PolarHBondContact O-N 3.11Å; S319-M323 WeakPolarHBondContact O-CB 3.38Å; S319-M323 VanDerWaalsContact O-CG 3.26Å; S319-M323 WeakPolarHBondContact O-CG 3.36Å; S319-M323 PolarHBondContact O-N 2.87Å
320	N	96.8	Very high	97.1	Very high	83 Å²	83	44.9 Å²	44.9	44%	0.444	24%	0.235	S	C	.	.	H	α-helix	trans	-61.2	-42.7	178.2	-72.8	-23.1	0	0	0	111.8	L316 E317 Q322 M323 M324	L316-N320 WeakPolarHBondContact O-CB 3.44Å; L316-N320 PolarHBondContact O-N 3.24Å; L316-N320 PolarHBondContact O-ND2 3.25Å; E317-N320 PolarHBondContact O-N 3.36Å; N320-Q322 PolarHBondContact O-N 2.88Å; N320-M323 PolarHBondContact O-N 3.16Å; N320-M324 PolarHBondContact O-N 3.37Å
321	Y	97.3	Very high	97	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-42	178.6	-172.2	-82.8	0	0	0	112.1	P288 E317 A318 S319 Q328 M331 Q332 T336 R420	P288-Y321 HydrophobicContact CB-CD1 3.96Å; P288-Y321 HydrophobicContact CB-CG 3.94Å; E317-Y321 VanDerWaalsContact O-CB 3.29Å; E317-Y321 WeakPolarHBondContact O-CB 3.15Å; E317-Y321 PolarHBondContact O-N 2.93Å; A318-Y321 PolarHBondContact O-N 3.34Å; S319-Y321 VanDerWaalsContact C-N 3.33Å; S319-Y321 PolarHBondContact O-N 3.31Å; Y321-Q328 HydrophobicContact CD1-CG 3.94Å; Y321-Q328 HydrophobicContact CE1-CB 3.91Å; Y321-Q328 VanDerWaalsContact CE1-CD 3.47Å; Y321-Q328 HydrophobicContact CE1-CG 3.4Å; Y321-Q328 HydrophobicContact CE2-CB 4.2Å; Y321-Q328 HydrophobicContact CE2-CG 4.19Å; Y321-Q328 HydrophobicContact CG-CG 4.48Å; Y321-Q328 WeakPolarHBondContact O-CG 3.35Å; Y321-Q328 PolarHBondContact O-NE2 3.47Å; Y321-Q328 WeakPolarHBondContact OH-CB 3.43Å; Y321-Q328 PolarHBondContact OH-O 3.32Å; Y321-M331 HydrophobicContact CD2-CB 4.03Å; Y321-M331 HydrophobicContact CD2-CE 4.29Å; Y321-M331 HydrophobicContact CE2-CB 3.89Å; Y321-M331 WeakPolarHBondContact CE2-O 3.41Å; Y321-Q332 PolarHBondContact OH-NE2 3.49Å; Y321-T336 HydrophobicContact CD2-CG2 3.54Å; Y321-T336 HydrophobicContact CE2-CG2 3.35Å; Y321-T336 HydrophobicContact CG-CG2 4.27Å; Y321-R420 PolarHBondContact OH-NH1 2.88Å
322	Q	95.6	Very high	96.9	Very high	33 Å²	33	49 Å²	49	15%	0.154	25%	0.252	C	S	.	.	H	α-helix	trans	-73.6	-28.9	178.1	-71.3	-65.9	-33.7	0	0	112.9	P288 M290 P292 L295 A318 S319 N320 M324 Y421	P288-Q322 PolarHBondContact O-NE2 3.15Å; M290-Q322 PolarHBondContact O-NE2 3.23Å; P292-Q322 HydrophobicContact CG-CB 4.21Å; L295-Q322 HydrophobicContact CD1-CG 4.2Å; A318-Q322 WeakPolarHBondContact O-CB 3.41Å; A318-Q322 WeakPolarHBondContact O-CG 3.37Å; A318-Q322 PolarHBondContact O-N 3.26Å; S319-Q322 PolarHBondContact O-N 3.11Å; N320-Q322 PolarHBondContact O-N 2.88Å; Q322-M324 VanDerWaalsContact C-N 3.31Å; Q322-M324 PolarHBondContact O-N 3.19Å; Q322-Y421 PolarHBondContact NE2-OH 3.26Å
323	M	95.8	Very high	96.7	Very high	147 Å²	147	49.3 Å²	49.3	72%	0.724	26%	0.256	S	S	*	.	H	α-helix	trans	-73.6	-18.1	176.2	-75.9	178.9	65.8	0	0	114.1	S319 N320 P325	S319-M323 WeakPolarHBondContact O-CB 3.38Å; S319-M323 VanDerWaalsContact O-CG 3.26Å; S319-M323 WeakPolarHBondContact O-CG 3.36Å; S319-M323 PolarHBondContact O-N 2.87Å; N320-M323 PolarHBondContact O-N 3.16Å; M323-P325 WeakPolarHBondContact O-CD 3.29Å
324	M	96.1	Very high	96.5	Very high	86 Å²	86	52.2 Å²	52.2	42%	0.424	27%	0.272	S	S	.	.			trans	-116.5	64.1	-176.6	-59.1	-165.4	-176.5	0	0	112.2	N320 Q322 Y326 M327 Q328 M331	N320-M324 PolarHBondContact O-N 3.37Å; Q322-M324 VanDerWaalsContact C-N 3.31Å; Q322-M324 PolarHBondContact O-N 3.19Å; M324-Y326 VanDerWaalsContact C-N 3.29Å; M324-Y326 PolarHBondContact O-N 3.21Å; M324-Y326 VanDerWaalsContact O-N 3.17Å; M324-M327 HydrophobicContact CB-CB 3.97Å; M324-M327 HydrophobicContact CB-CG 4.37Å; M324-M327 HydrophobicContact CB-SD 4.44Å; M324-M327 PolarHBondContact O-N 3.39Å; M324-M327 HydrophobicContact SD-CE 4.22Å; M324-M327 HydrophobicContact SD-SD 3.59Å; M324-Q328 WeakPolarHBondContact O-CG 3.46Å; M324-Q328 PolarHBondContact O-N 3Å; M324-M331 HydrophobicContact CB-SD 4.37Å
325	P	95.2	Very high	96.4	Very high	44 Å²	44	55.5 Å²	55.5	29%	0.286	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-41.6	-170.9	21.8	-33.6	0	0	0	112.7	M323 M327 Q328 R416 M425	M323-P325 WeakPolarHBondContact O-CD 3.29Å; P325-M327 VanDerWaalsContact C-N 3.33Å; P325-M327 PolarHBondContact O-N 2.88Å; P325-Q328 WeakPolarHBondContact O-CB 3.44Å; P325-Q328 WeakPolarHBondContact O-CG 3.38Å; P325-Q328 PolarHBondContact O-N 2.99Å; P325-R416 VanDerWaalsContact O-CZ 3.29Å; P325-R416 PolarHBondContact O-NH1 2.77Å; P325-R416 PolarHBondContact O-NH2 3.24Å; P325-M425 HydrophobicContact CB-CE 4.3Å
326	Y	96.8	Very high	96.3	Very high	89 Å²	89	54.8 Å²	54.8	35%	0.349	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.8	-179.9	-49.7	-60.5	0	0	0	113.6	M324 P329 M425 V427 P466 N469	M324-Y326 VanDerWaalsContact C-N 3.29Å; M324-Y326 PolarHBondContact O-N 3.21Å; M324-Y326 VanDerWaalsContact O-N 3.17Å; Y326-P329 WeakPolarHBondContact O-CD 3.14Å; Y326-M425 HydrophobicContact CD1-CE 3.8Å; Y326-M425 HydrophobicContact CE1-CE 3.42Å; Y326-M425 VanDerWaalsContact CE1-CE 3.42Å; Y326-V427 HydrophobicContact CD1-CG1 4.01Å; Y326-V427 HydrophobicContact CE1-CG1 4.27Å; Y326-P466 CarbonylContact C-O 3.52Å; Y326-P466 VanDerWaalsContact C-O 3.24Å; Y326-P466 WeakPolarHBondContact CB-O 3.32Å; Y326-P466 WeakPolarHBondContact O-CB 3.43Å; Y326-N469 HydrophobicContact CD1-CB 4.23Å; Y326-N469 HydrophobicContact CD2-CB 3.9Å; Y326-N469 HydrophobicContact CE2-CB 4.39Å; Y326-N469 HydrophobicContact CG-CB 3.82Å
327	M	97	Very high	96.1	Very high	35 Å²	35	52.4 Å²	52.4	17%	0.172	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-18	-178	-69.9	-172.4	54.9	0	0	114.2	M324 P325 P329 V330 M331 R467	M324-M327 HydrophobicContact CB-CB 3.97Å; M324-M327 HydrophobicContact CB-CG 4.37Å; M324-M327 HydrophobicContact CB-SD 4.44Å; M324-M327 PolarHBondContact O-N 3.39Å; M324-M327 HydrophobicContact SD-CE 4.22Å; M324-M327 HydrophobicContact SD-SD 3.59Å; P325-M327 VanDerWaalsContact C-N 3.33Å; P325-M327 PolarHBondContact O-N 2.88Å; M327-P329 WeakPolarHBondContact O-CD 3.38Å; M327-V330 HydrophobicContact CB-CG2 4.48Å; M327-V330 WeakPolarHBondContact O-CG2 3.49Å; M327-V330 PolarHBondContact O-N 2.94Å; M327-M331 HydrophobicContact CB-CG 4.18Å; M327-M331 HydrophobicContact CB-SD 3.51Å; M327-M331 VanDerWaalsContact CB-SD 3.51Å; M327-M331 HydrophobicContact CE-SD 4.14Å; M327-M331 WeakPolarHBondContact O-CG 3.33Å; M327-M331 PolarHBondContact O-N 2.93Å; M327-R467 HydrophobicContact CE-CB 4.48Å; M327-R467 HydrophobicContact CE-CG 4.1Å; M327-R467 VanDerWaalsContact CE-NH1 3.35Å; M327-R467 HydrophobicContact CG-CB 4.39Å; M327-R467 HydrophobicContact CG-CG 4.47Å; M327-R467 HydrophobicContact SD-CB 4.31Å
328	Q	97.3	Very high	95.9	Very high	7 Å²	7	50.3 Å²	50.3	3%	0.033	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-43	-42.8	179.2	-68.4	-179.3	-16	0	0	114.5	Y321 M324 P325 V330 M331 Q332 F393	Y321-Q328 HydrophobicContact CD1-CG 3.94Å; Y321-Q328 HydrophobicContact CE1-CB 3.91Å; Y321-Q328 VanDerWaalsContact CE1-CD 3.47Å; Y321-Q328 HydrophobicContact CE1-CG 3.4Å; Y321-Q328 HydrophobicContact CE2-CB 4.2Å; Y321-Q328 HydrophobicContact CE2-CG 4.19Å; Y321-Q328 HydrophobicContact CG-CG 4.48Å; Y321-Q328 WeakPolarHBondContact O-CG 3.35Å; Y321-Q328 PolarHBondContact O-NE2 3.47Å; Y321-Q328 WeakPolarHBondContact OH-CB 3.43Å; Y321-Q328 PolarHBondContact OH-O 3.32Å; M324-Q328 WeakPolarHBondContact O-CG 3.46Å; M324-Q328 PolarHBondContact O-N 3Å; P325-Q328 WeakPolarHBondContact O-CB 3.44Å; P325-Q328 WeakPolarHBondContact O-CG 3.38Å; P325-Q328 PolarHBondContact O-N 2.99Å; Q328-V330 PolarHBondContact O-N 3.38Å; Q328-M331 PolarHBondContact O-N 3.14Å; Q328-M331 VanDerWaalsContact O-N 3.14Å; Q328-Q332 PolarHBondContact O-NE2 3.49Å; Q328-F393 HydrophobicContact CB-CE2 4.3Å; Q328-F393 HydrophobicContact CB-CZ 3.89Å
329	P	97.1	Very high	95.6	Very high	4 Å²	4	50.7 Å²	50.7	3%	0.026	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-62.3	-27.6	179.7	-26	40.2	0	0	0	114.2	Y326 M327 I390 G391 F393 Y395 R416	Y326-P329 WeakPolarHBondContact O-CD 3.14Å; M327-P329 WeakPolarHBondContact O-CD 3.38Å; P329-I390 HydrophobicContact CB-CB 3.94Å; P329-I390 HydrophobicContact CB-CG2 3.64Å; P329-I390 WeakPolarHBondContact CB-O 3.48Å; P329-G391 WeakPolarHBondContact O-CA 3.15Å; P329-F393 HydrophobicContact CB-CB 4.4Å; P329-F393 HydrophobicContact CB-CD2 3.82Å; P329-F393 HydrophobicContact CB-CE2 4.45Å; P329-F393 HydrophobicContact CB-CG 4.31Å; P329-F393 HydrophobicContact CG-CB 4.07Å; P329-F393 HydrophobicContact CG-CD1 4.43Å; P329-F393 HydrophobicContact CG-CD2 3.68Å; P329-F393 HydrophobicContact CG-CE2 4.21Å; P329-F393 HydrophobicContact CG-CG 3.82Å; P329-Y395 HydrophobicContact CB-CE2 4.47Å; P329-Y395 HydrophobicContact CG-CE2 4.28Å; P329-Y395 WeakPolarHBondContact CG-OH 3.24Å; P329-R416 VanDerWaalsContact CD-NH1 3.32Å
330	V	97.2	Very high	95.4	Very high	39 Å²	39	49.3 Å²	49.3	24%	0.236	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-103.2	5.2	179	-61.2	0	0	0	0	113.1	M327 Q328 I390 G444 P466 R467	M327-V330 HydrophobicContact CB-CG2 4.48Å; M327-V330 WeakPolarHBondContact O-CG2 3.49Å; M327-V330 PolarHBondContact O-N 2.94Å; Q328-V330 PolarHBondContact O-N 3.38Å; V330-I390 HydrophobicContact CG1-CG2 4Å; V330-G444 WeakPolarHBondContact CG1-O 3.3Å; V330-P466 HydrophobicContact CG1-CB 4.27Å; V330-P466 HydrophobicContact CG1-CG 4.08Å; V330-P466 HydrophobicContact CG2-CB 4.41Å; V330-R467 HydrophobicContact CG2-CG 4.34Å
331	M	96.1	Very high	95.1	Very high	60 Å²	60	50.7 Å²	50.7	30%	0.296	26%	0.263	S	S	.	.	S	Bend	trans	-110	33.3	177.9	-66.7	174.9	66.4	0	0	111.5	Y321 M324 M327 Q328	Y321-M331 HydrophobicContact CD2-CB 4.03Å; Y321-M331 HydrophobicContact CD2-CE 4.29Å; Y321-M331 HydrophobicContact CE2-CB 3.89Å; Y321-M331 WeakPolarHBondContact CE2-O 3.41Å; M324-M331 HydrophobicContact CB-SD 4.37Å; M327-M331 HydrophobicContact CB-CG 4.18Å; M327-M331 HydrophobicContact CB-SD 3.51Å; M327-M331 VanDerWaalsContact CB-SD 3.51Å; M327-M331 HydrophobicContact CE-SD 4.14Å; M327-M331 WeakPolarHBondContact O-CG 3.33Å; M327-M331 PolarHBondContact O-N 2.93Å; Q328-M331 PolarHBondContact O-N 3.14Å; Q328-M331 VanDerWaalsContact O-N 3.14Å
332	Q	95.2	Very high	94.8	Very high	69 Å²	69	53.7 Å²	53.7	32%	0.322	28%	0.281	S	S	.	.			trans	-76.1	137.9	-174.9	-66.1	-57.7	-56.6	0	0	113.1	Y321 Q328 T336	Y321-Q332 PolarHBondContact OH-NE2 3.49Å; Q328-Q332 PolarHBondContact O-NE2 3.49Å; Q332-T336 VanDerWaalsContact CA-OG1 3.3Å; Q332-T336 WeakPolarHBondContact CA-OG1 3.39Å; Q332-T336 PolarHBondContact OE1-OG1 3.24Å; Q332-T336 VanDerWaalsContact OE1-OG1 3.1Å
333	S	95.1	Very high	94.7	Very high	48 Å²	48	54.4 Å²	54.4	34%	0.336	29%	0.288	S	S	.	.			trans	-146.9	172.4	168.9	70.1	0	0	0	0	109.6	R335 T336 A337	S333-R335 PolarHBondContact O-N 3.41Å; S333-R335 PolarHBondContact OG-N 2.9Å; S333-T336 PolarHBondContact N-OG1 3.22Å; S333-T336 PolarHBondContact O-N 2.99Å; S333-T336 PolarHBondContact O-OG1 3.05Å; S333-T336 VanDerWaalsContact O-OG1 3.07Å; S333-A337 PolarHBondContact O-N 3.23Å; S333-A337 VanDerWaalsContact O-N 3.16Å
334	D	93.2	Very high	94.6	Very high	143 Å²	143	47.7 Å²	47.7	77%	0.765	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.8	174.9	-59.8	-22.2	0	0	0	113	R286	R286-D334 PolarHBondContact NE-O 2.75Å
335	R	95.6	Very high	94.6	Very high	75 Å²	75	43.9 Å²	43.9	28%	0.283	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.7	178.6	-64.9	-162.3	-59	-125.8	-0.2	115	R286 E317 S333	R286-R335 VanDerWaalsContact CB-O 3.3Å; R286-R335 WeakPolarHBondContact CB-O 3.4Å; E317-R335 IonicContact OE1-CZ 3.67Å; E317-R335 IonicContact OE1-NE 2.74Å; E317-R335 PolarHBondContact OE1-NE 3.22Å; E317-R335 IonicContact OE1-NH2 2.89Å; E317-R335 PolarHBondContact OE1-NH2 3.1Å; E317-R335 IonicContact OE2-CZ 3.46Å; E317-R335 IonicContact OE2-NE 2.94Å; E317-R335 PolarHBondContact OE2-NE 3.17Å; E317-R335 IonicContact OE2-NH2 3.23Å; E317-R335 PolarHBondContact OE2-NH2 3.07Å; S333-R335 PolarHBondContact O-N 3.41Å; S333-R335 PolarHBondContact OG-N 2.9Å
336	T	95.4	Very high	94.7	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.012	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-10	175.6	66.7	0	0	0	0	112	P288 L289 Y321 Q332 S333	P288-T336 HydrophobicContact CB-CG2 3.79Å; P288-T336 HydrophobicContact CG-CG2 4.02Å; L289-T336 VanDerWaalsContact CD2-O 3.26Å; L289-T336 WeakPolarHBondContact CD2-O 3.29Å; Y321-T336 HydrophobicContact CD2-CG2 3.54Å; Y321-T336 HydrophobicContact CE2-CG2 3.35Å; Y321-T336 HydrophobicContact CG-CG2 4.27Å; Q332-T336 VanDerWaalsContact CA-OG1 3.3Å; Q332-T336 WeakPolarHBondContact CA-OG1 3.39Å; Q332-T336 PolarHBondContact OE1-OG1 3.24Å; Q332-T336 VanDerWaalsContact OE1-OG1 3.1Å; S333-T336 PolarHBondContact N-OG1 3.22Å; S333-T336 PolarHBondContact O-N 2.99Å; S333-T336 PolarHBondContact O-OG1 3.05Å; S333-T336 VanDerWaalsContact O-OG1 3.07Å
337	A	94	Very high	94.7	Very high	38 Å²	38	37.8 Å²	37.8	31%	0.314	21%	0.207	S	C	.	.	S	Bend	trans	-78.7	146.8	176.2	0	0	0	0	0	111.6	R286 L289 S333	R286-A337 WeakPolarHBondContact CD-O 3.33Å; R286-A337 PolarHBondContact NH1-O 3.46Å; L289-A337 WeakPolarHBondContact CD1-O 3.34Å; S333-A337 PolarHBondContact O-N 3.23Å; S333-A337 VanDerWaalsContact O-N 3.16Å
338	I	92.7	Very high	94.6	Very high	7 Å²	7	36.2 Å²	36.2	4%	0.036	20%	0.2	C	C	.	.			trans	-57	142.4	172.6	-68.3	172.4	0	0	0	109.9	R286 S340 P419 R420 T638 F640	R286-I338 PolarHBondContact NH1-O 2.82Å; I338-S340 PolarHBondContact O-N 3.33Å; I338-P419 HydrophobicContact CD1-CB 3.93Å; I338-P419 HydrophobicContact CD1-CG 3.91Å; I338-R420 HydrophobicContact CD1-CB 4.44Å; I338-R420 HydrophobicContact CD1-CG 3.76Å; I338-R420 HydrophobicContact CG1-CB 4.35Å; I338-R420 HydrophobicContact CG1-CG 3.48Å; I338-R420 VanDerWaalsContact CG1-CG 3.48Å; I338-T638 HydrophobicContact CB-CG2 4.39Å; I338-T638 WeakPolarHBondContact CD1-O 3.2Å; I338-F640 HydrophobicContact CG2-CD2 3.95Å; I338-F640 HydrophobicContact CG2-CE1 4.02Å; I338-F640 HydrophobicContact CG2-CE2 3.36Å; I338-F640 HydrophobicContact CG2-CZ 3.39Å
339	R	92.7	Very high	94.4	Very high	8 Å²	8	36 Å²	36	3%	0.03	20%	0.199	C	C	.	.	S	Bend	trans	-75.8	66.7	175.3	-169.4	179.9	-66.3	-82.6	7.3	111.5	L247 S249 E257 N284 R286	L247-R339 VanDerWaalsContact O-CZ 3.26Å; L247-R339 PolarHBondContact O-NH1 3.43Å; L247-R339 PolarHBondContact O-NH2 2.9Å; L247-R339 VanDerWaalsContact O-NH2 3.16Å; S249-R339 WeakPolarHBondContact O-CD 3.43Å; S249-R339 VanDerWaalsContact O-CG 3.25Å; S249-R339 WeakPolarHBondContact O-CG 3.47Å; S249-R339 PolarHBondContact O-NH1 2.96Å; E257-R339 IonicContact OE1-CZ 3.47Å; E257-R339 VanDerWaalsContact OE1-CZ 3.25Å; E257-R339 IonicContact OE1-NE 2.72Å; E257-R339 PolarHBondContact OE1-NE 2.9Å; E257-R339 IonicContact OE1-NH2 2.8Å; E257-R339 PolarHBondContact OE1-NH2 3.21Å; E257-R339 IonicContact OE2-NH2 2.61Å; E257-R339 PolarHBondContact OE2-NH2 3.37Å; E257-R339 VanDerWaalsContact OE2-NH2 3.1Å; N284-R339 PolarHBondContact O-NH2 2.93Å; R286-R339 VanDerWaalsContact NH1-N 3.19Å
340	S	91.9	Very high	94.2	Very high	15 Å²	15	35.8 Å²	35.8	11%	0.105	20%	0.198	C	C	.	.			trans	-162.2	138.9	178	-177.3	0	0	0	0	109.4	I338 T342 T638	I338-S340 PolarHBondContact O-N 3.33Å; S340-T342 VanDerWaalsContact C-N 3.35Å; S340-T342 WeakPolarHBondContact OG-CB 3.47Å; S340-T342 PolarHBondContact OG-N 3.08Å; S340-T342 PolarHBondContact OG-OG1 2.98Å; S340-T638 WeakPolarHBondContact O-CG2 3.43Å
341	D	89.8	Confident	93.9	Very high	112 Å²	112	34.1 Å²	34.1	60%	0.599	19%	0.188	S	C	*	.			trans	-93.5	-0.6	166.9	-58.6	-48.6	0	0	0	111.7	N250 T343	N250-D341 VanDerWaalsContact CB-CG 3.49Å; N250-D341 WeakPolarHBondContact CB-OD1 3.28Å; N250-D341 WeakPolarHBondContact CB-OD2 3.5Å; N250-D341 PolarHBondContact ND2-OD1 3.08Å; D341-T343 PolarHBondContact O-N 3.31Å
342	T	90.3	Very high	93.4	Very high	66 Å²	66	32.6 Å²	32.6	41%	0.405	18%	0.181	S	C	.	.			trans	-83.5	115.5	-173.9	-41.6	0	0	0	0	109.3	S340 H344 T638	S340-T342 VanDerWaalsContact C-N 3.35Å; S340-T342 WeakPolarHBondContact OG-CB 3.47Å; S340-T342 PolarHBondContact OG-N 3.08Å; S340-T342 PolarHBondContact OG-OG1 2.98Å; T342-H344 WeakPolarHBondContact CG2-CE1 3.16Å; T342-H344 WeakPolarHBondContact CG2-NE2 3.41Å; T342-T638 WeakPolarHBondContact O-CG2 3.34Å
343	T	93.4	Very high	92.3	Very high	48 Å²	48	33.9 Å²	33.9	29%	0.294	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	148.3	174.5	-59.7	0	0	0	0	108.7	D341 F588 T636 T638	D341-T343 PolarHBondContact O-N 3.31Å; T343-F588 HydrophobicContact CG2-CD2 4.37Å; T343-F588 HydrophobicContact CG2-CE2 4.18Å; T343-F588 VanDerWaalsContact O-CE2 3.23Å; T343-F588 WeakPolarHBondContact O-CE2 3.38Å; T343-T636 HydrophobicContact CG2-CG2 4.46Å; T343-T638 PolarHBondContact OG1-OG1 3.14Å
344	H	95.1	Very high	91.3	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.028	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.4	-175.5	-61.9	-74.5	0	0	0	111	T342 V346 M364 Y365 T636 L637 V639	T342-H344 WeakPolarHBondContact CG2-CE1 3.16Å; T342-H344 WeakPolarHBondContact CG2-NE2 3.41Å; H344-V346 PolarHBondContact O-N 3.31Å; H344-M364 HydrophobicContact CB-CB 4.41Å; H344-M364 HydrophobicContact CB-CE 3.79Å; H344-M364 WeakPolarHBondContact ND1-CE 3.25Å; H344-Y365 PolarHBondContact ND1-O 3.11Å; H344-T636 VanDerWaalsContact O-CA 3.29Å; H344-T636 WeakPolarHBondContact O-CA 3.47Å; H344-L637 PolarHBondContact N-O 3.15Å; H344-L637 PolarHBondContact O-N 2.99Å; H344-V639 PolarHBondContact CD2-O 3.23Å
345	L	96.1	Very high	90.5	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	127.5	163.1	-179.5	66.4	0	0	0	108.6	M364 Y365 W372 A586 Y593 V595 F623 A634	L345-M364 CarbonylContact O-C 3.46Å; L345-M364 WeakPolarHBondContact O-CA 3.49Å; L345-Y365 PolarHBondContact O-N 3.06Å; L345-W372 HydrophobicContact CD2-CH2 3.79Å; L345-W372 HydrophobicContact CD2-CZ2 4.31Å; L345-W372 HydrophobicContact CG-CH2 4.06Å; L345-A586 HydrophobicContact CD1-CB 3.36Å; L345-Y593 HydrophobicContact CD2-CD1 4.32Å; L345-V595 HydrophobicContact CD2-CG2 4.28Å; L345-F623 HydrophobicContact CD2-CE2 4.11Å; L345-F623 HydrophobicContact CD2-CZ 3.99Å; L345-A634 HydrophobicContact CD1-CB 4.42Å
346	V	96.8	Very high	89.8	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	134.5	-179.1	175.9	0	0	0	0	109.6	H344 L362 R363 M364 A634 C635 L637	H344-V346 PolarHBondContact O-N 3.31Å; V346-L362 HydrophobicContact CG1-CD1 3.37Å; V346-L362 HydrophobicContact CG1-CG 4.06Å; V346-R363 CarbonylContact C-O 3.54Å; V346-R363 VanDerWaalsContact CA-O 3.27Å; V346-R363 WeakPolarHBondContact CA-O 3.46Å; V346-M364 HydrophobicContact CG2-CB 4.03Å; V346-A634 CarbonylContact O-C 3.5Å; V346-A634 WeakPolarHBondContact O-CA 3.46Å; V346-C635 PolarHBondContact N-O 3.08Å; V346-C635 PolarHBondContact O-N 3.34Å; V346-L637 HydrophobicContact CB-CD1 4.36Å; V346-L637 HydrophobicContact CG1-CD1 4.17Å; V346-L637 HydrophobicContact CG2-CB 4Å; V346-L637 HydrophobicContact CG2-CD1 4.18Å; V346-L637 HydrophobicContact CG2-CG 4.31Å
347	T	95.8	Very high	89.4	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.025	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.6	177.5	60.2	0	0	0	0	111.3	R363 W372 V595 L625 I632 R633 A634	T347-R363 PolarHBondContact N-O 3.11Å; T347-R363 PolarHBondContact O-N 2.79Å; T347-W372 HydrophobicContact CG2-CH2 3.36Å; T347-W372 HydrophobicContact CG2-CZ2 4.33Å; T347-W372 HydrophobicContact CG2-CZ3 3.61Å; T347-W372 WeakPolarHBondContact OG1-CZ3 3.48Å; T347-V595 HydrophobicContact CG2-CG1 3.74Å; T347-L625 HydrophobicContact CG2-CD2 4.31Å; T347-I632 HydrophobicContact CG2-CD1 4.19Å; T347-R633 CarbonylContact C-O 3.55Å; T347-R633 VanDerWaalsContact CA-O 3.23Å; T347-R633 WeakPolarHBondContact CA-O 3.26Å; T347-A634 HydrophobicContact CG2-CB 4.18Å
348	L	95.6	Very high	89.3	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.7	-179.3	178.8	72.2	0	0	0	112	E361 L362 M378 I387 V396 W424 R633	L348-E361 WeakPolarHBondContact CA-O 3.34Å; L348-L362 HydrophobicContact CB-CD1 3.96Å; L348-L362 HydrophobicContact CD1-CB 3.96Å; L348-L362 HydrophobicContact CD1-CD1 3.92Å; L348-L362 HydrophobicContact CG-CD1 4.43Å; L348-M378 HydrophobicContact CD1-CG 4.07Å; L348-M378 HydrophobicContact CD1-SD 3.87Å; L348-M378 HydrophobicContact CD2-SD 3.88Å; L348-M378 HydrophobicContact CG-SD 4.32Å; L348-I387 HydrophobicContact CD2-CG2 4.37Å; L348-V396 HydrophobicContact CD2-CB 4.18Å; L348-V396 HydrophobicContact CD2-CG1 3.91Å; L348-V396 HydrophobicContact CD2-CG2 3.17Å; L348-W424 HydrophobicContact CD1-CH2 4.4Å; L348-W424 HydrophobicContact CD1-CZ2 4.3Å; L348-W424 HydrophobicContact CD2-CH2 4.24Å; L348-R633 PolarHBondContact N-O 2.72Å; L348-R633 PolarHBondContact O-N 2.91Å; L348-R633 VanDerWaalsContact O-N 3.08Å
349	G	93.8	Very high	89.3	Confident	2 Å²	2	43.7 Å²	43.7	2%	0.021	23%	0.225	C	C	.	.			trans	65.4	-143.3	163.6	0	0	0	0	0	113.3	S359 E361 R382	G349-S359 WeakPolarHBondContact CA-O 3.32Å; G349-E361 PolarHBondContact N-O 2.84Å; G349-R382 CarbonylContact C-O 3.59Å; G349-R382 VanDerWaalsContact CA-O 3.26Å; G349-R382 WeakPolarHBondContact CA-O 3.25Å
350	G	92.4	Very high	89.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.242	C	C	.	.			trans	95.6	179.3	-173.2	0	0	0	0	0	112.6	V358 S359 R382 G630	G350-V358 CarbonylContact O-C 3.59Å; G350-V358 WeakPolarHBondContact O-CA 3.33Å; G350-V358 WeakPolarHBondContact O-CG1 3.43Å; G350-S359 PolarHBondContact O-N 3.26Å; G350-R382 PolarHBondContact N-O 2.58Å; G350-G630 CarbonylContact C-O 3.59Å; G350-G630 WeakPolarHBondContact CA-O 3.23Å
351	V	91.3	Very high	89.6	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.4	-175.1	66.1	0	0	0	0	112	R353 V357 V358 Y383 Y403 M605 G630	V351-R353 PolarHBondContact O-N 3.23Å; V351-V357 WeakPolarHBondContact CA-O 3.47Å; V351-V357 WeakPolarHBondContact CG2-O 3.47Å; V351-V358 HydrophobicContact CB-CG2 4.37Å; V351-V358 HydrophobicContact CG2-CG2 4.02Å; V351-Y383 HydrophobicContact CB-CD2 4.16Å; V351-Y383 HydrophobicContact CB-CG 4.06Å; V351-Y383 HydrophobicContact CG1-CD2 3.84Å; V351-Y383 HydrophobicContact CG1-CE2 4.4Å; V351-Y383 HydrophobicContact CG1-CG 4.25Å; V351-Y403 HydrophobicContact CG1-CD2 4.08Å; V351-Y403 HydrophobicContact CG1-CE2 4.38Å; V351-Y403 HydrophobicContact CG2-CD2 3.84Å; V351-Y403 HydrophobicContact CG2-CG 4.49Å; V351-M605 HydrophobicContact CG1-CE 4.28Å; V351-G630 PolarHBondContact N-O 2.95Å; V351-G630 PolarHBondContact O-N 3.42Å; V351-G630 VanDerWaalsContact O-N 3.08Å
352	L	85.4	Confident	89.8	Confident	29 Å²	29	44 Å²	44	15%	0.152	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	93.4	164.8	-67.5	106.7	0	0	0	108.4	Q354 Q355 L356 V357 E627 L629	L352-Q354 PolarHBondContact O-N 2.79Å; L352-Q354 VanDerWaalsContact O-N 3.15Å; L352-Q355 HydrophobicContact CB-CB 4.37Å; L352-Q355 CarbonylContact O-C 3.58Å; L352-Q355 PolarHBondContact O-N 2.8Å; L352-L356 PolarHBondContact O-N 2.75Å; L352-V357 PolarHBondContact N-O 3.13Å; L352-V357 PolarHBondContact O-N 2.87Å; L352-E627 WeakPolarHBondContact CD1-OE2 3.37Å; L352-E627 HydrophobicContact CD2-CB 4.34Å; L352-E627 HydrophobicContact CD2-CG 4.44Å; L352-L629 HydrophobicContact CD1-CD2 3.56Å; L352-L629 HydrophobicContact CG-CD2 3.67Å
353	R	72.7	Confident	90.1	Very high	96 Å²	96	42.3 Å²	42.3	36%	0.362	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.2	-172.7	-176.9	173.7	177.7	-178.5	0.7	114.3	V351 Q355 L356 Y403 Y598 M605	V351-R353 PolarHBondContact O-N 3.23Å; R353-Q355 VanDerWaalsContact C-N 3.29Å; R353-Q355 PolarHBondContact O-N 2.94Å; R353-L356 WeakPolarHBondContact O-CD2 3.48Å; R353-L356 PolarHBondContact O-N 3.14Å; R353-Y403 HydrophobicContact CG-CE2 4.18Å; R353-Y403 PolarHBondContact NE-OH 3.48Å; R353-Y598 PolarHBondContact NH1-OH 2.91Å; R353-Y598 VanDerWaalsContact NH1-OH 3.08Å; R353-M605 HydrophobicContact CB-CE 3.55Å; R353-M605 HydrophobicContact CB-CG 4.15Å; R353-M605 HydrophobicContact CG-CE 4.3Å
354	Q	72.8	Confident	90.2	Very high	187 Å²	187	40 Å²	40	87%	0.874	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-31.8	178.8	-68.9	164.1	-10.6	0	0	112.4	L352	L352-Q354 PolarHBondContact O-N 2.79Å; L352-Q354 VanDerWaalsContact O-N 3.15Å
355	Q	76.2	Confident	90.1	Very high	130 Å²	130	40.3 Å²	40.3	61%	0.607	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-10	-179.7	-60.1	176.6	5.8	0	0	112.1	L352 R353 V357	L352-Q355 HydrophobicContact CB-CB 4.37Å; L352-Q355 CarbonylContact O-C 3.58Å; L352-Q355 PolarHBondContact O-N 2.8Å; R353-Q355 VanDerWaalsContact C-N 3.29Å; R353-Q355 PolarHBondContact O-N 2.94Å; Q355-V357 HydrophobicContact CB-CB 4.23Å; Q355-V357 HydrophobicContact CB-CG2 3.8Å; Q355-V357 PolarHBondContact O-N 3.27Å
356	L	81.7	Confident	89.8	Confident	104 Å²	104	41 Å²	41	55%	0.545	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	26.3	-171.1	-55.2	173.4	0	0	0	112.8	L352 R353 Y403	L352-L356 PolarHBondContact O-N 2.75Å; R353-L356 WeakPolarHBondContact O-CD2 3.48Å; R353-L356 PolarHBondContact O-N 3.14Å; L356-Y403 HydrophobicContact CD2-CD1 3.56Å; L356-Y403 HydrophobicContact CD2-CE1 4.06Å; L356-Y403 HydrophobicContact CD2-CG 3.85Å
357	V	87.3	Confident	89.2	Confident	71 Å²	71	44.3 Å²	44.3	43%	0.43	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.9	-178.6	176.5	0	0	0	0	109.5	V351 L352 Q355	V351-V357 WeakPolarHBondContact CA-O 3.47Å; V351-V357 WeakPolarHBondContact CG2-O 3.47Å; L352-V357 PolarHBondContact N-O 3.13Å; L352-V357 PolarHBondContact O-N 2.87Å; Q355-V357 HydrophobicContact CB-CB 4.23Å; Q355-V357 HydrophobicContact CB-CG2 3.8Å; Q355-V357 PolarHBondContact O-N 3.27Å
358	V	92.1	Very high	88.8	Confident	15 Å²	15	52.2 Å²	52.2	9%	0.091	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132.5	174.2	-174.9	0	0	0	0	108.9	G350 V351 P381 Y383 S401	G350-V358 CarbonylContact O-C 3.59Å; G350-V358 WeakPolarHBondContact O-CA 3.33Å; G350-V358 WeakPolarHBondContact O-CG1 3.43Å; V351-V358 HydrophobicContact CB-CG2 4.37Å; V351-V358 HydrophobicContact CG2-CG2 4.02Å; V358-P381 HydrophobicContact CB-CB 3.88Å; V358-P381 HydrophobicContact CB-CG 4.39Å; V358-P381 HydrophobicContact CG1-CB 3.77Å; V358-P381 WeakPolarHBondContact O-CB 2.92Å; V358-Y383 HydrophobicContact CB-CD1 4.27Å; V358-Y383 HydrophobicContact CG1-CD1 3.63Å; V358-Y383 HydrophobicContact CG1-CG 4.26Å; V358-Y383 HydrophobicContact CG2-CD1 3.52Å; V358-Y383 HydrophobicContact CG2-CE1 3.82Å; V358-Y383 HydrophobicContact CG2-CG 4.42Å; V358-S401 WeakPolarHBondContact CB-O 3.43Å; V358-S401 VanDerWaalsContact CG2-O 3.26Å; V358-S401 WeakPolarHBondContact CG2-O 3.42Å
359	S	93.3	Very high	88.4	Confident	12 Å²	12	54 Å²	54	8%	0.084	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-80.7	149	178.9	-178.3	0	0	0	0	111.6	G349 G350 E361 P381 R382	G349-S359 WeakPolarHBondContact CA-O 3.32Å; G350-S359 PolarHBondContact O-N 3.26Å; S359-E361 PolarHBondContact OG-N 3.15Å; S359-E361 VanDerWaalsContact OG-N 3.14Å; S359-P381 WeakPolarHBondContact O-CA 3.19Å; S359-P381 WeakPolarHBondContact O-CB 3.45Å; S359-R382 PolarHBondContact O-N 3.06Å
360	K	94.1	Very high	88.2	Confident	88 Å²	88	60.6 Å²	60.6	38%	0.383	29%	0.291	S	S	.	.			trans	-115.3	1.2	171.4	65.8	-176.2	-167.5	160.8	0	112.3	P377 M378 P381	K360-P377 HydrophobicContact CG-CB 4.16Å; K360-M378 HydrophobicContact CB-CB 4.36Å; K360-M378 WeakPolarHBondContact CD-O 3.36Å; K360-M378 PolarHBondContact O-N 2.9Å; K360-P381 HydrophobicContact CB-CB 4.11Å
361	E	95.1	Very high	88.1	Confident	52 Å²	52	66.4 Å²	66.4	24%	0.243	32%	0.318	C	S	.	.			trans	-77	129.1	-170.1	-60.8	-57.1	130.8	0	0	110.4	L348 G349 S359 R363	L348-E361 WeakPolarHBondContact CA-O 3.34Å; G349-E361 PolarHBondContact N-O 2.84Å; S359-E361 PolarHBondContact OG-N 3.15Å; S359-E361 VanDerWaalsContact OG-N 3.14Å; E361-R363 HydrophobicContact CB-CG 4.33Å
362	L	95.8	Very high	88.1	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.6	166	-177.1	70.5	0	0	0	106.9	V346 L348 L375 L394 F417 W424	V346-L362 HydrophobicContact CG1-CD1 3.37Å; V346-L362 HydrophobicContact CG1-CG 4.06Å; L348-L362 HydrophobicContact CB-CD1 3.96Å; L348-L362 HydrophobicContact CD1-CB 3.96Å; L348-L362 HydrophobicContact CD1-CD1 3.92Å; L348-L362 HydrophobicContact CG-CD1 4.43Å; L362-L375 HydrophobicContact CB-CB 4.21Å; L362-L375 HydrophobicContact CD2-CB 3.76Å; L362-L375 HydrophobicContact CD2-CD1 3.74Å; L362-L375 HydrophobicContact CD2-CG 4.4Å; L362-L375 HydrophobicContact CG-CB 3.98Å; L362-L375 HydrophobicContact CG-CD1 4.01Å; L362-L375 PolarHBondContact O-N 2.82Å; L362-L394 HydrophobicContact CD1-CD2 3.76Å; L362-F417 HydrophobicContact CD2-CD1 3.82Å; L362-F417 HydrophobicContact CD2-CD2 3.92Å; L362-F417 HydrophobicContact CD2-CE1 3.67Å; L362-F417 HydrophobicContact CD2-CE2 3.78Å; L362-F417 HydrophobicContact CD2-CG 3.93Å; L362-F417 HydrophobicContact CD2-CZ 3.65Å; L362-W424 HydrophobicContact CB-CZ2 4.27Å; L362-W424 HydrophobicContact CD1-CZ2 4.47Å; L362-W424 HydrophobicContact CD2-CZ2 3.83Å; L362-W424 HydrophobicContact CG-CZ2 4.41Å
363	R	95.4	Very high	88.5	Confident	31 Å²	31	68.8 Å²	68.8	12%	0.117	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.2	-177.7	-62.1	178	177.9	159.3	-1.9	110	V346 T347 E361 W372 K373 E627	V346-R363 CarbonylContact C-O 3.54Å; V346-R363 VanDerWaalsContact CA-O 3.27Å; V346-R363 WeakPolarHBondContact CA-O 3.46Å; T347-R363 PolarHBondContact N-O 3.11Å; T347-R363 PolarHBondContact O-N 2.79Å; E361-R363 HydrophobicContact CB-CG 4.33Å; R363-W372 HydrophobicContact CB-CE3 3.85Å; R363-W372 HydrophobicContact CB-CZ3 4.48Å; R363-K373 CarbonylContact C-O 3.59Å; R363-K373 WeakPolarHBondContact CA-O 3.42Å; R363-E627 IonicContact CZ-OE1 3.69Å; R363-E627 IonicContact NH1-OE1 3.61Å; R363-E627 IonicContact NH2-OE1 2.82Å; R363-E627 PolarHBondContact NH2-OE1 2.9Å
364	M	95	Very high	89.5	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	146.5	170.8	66.3	151.9	-68.3	0	0	110.3	H344 L345 V346 D366 W372 K373 L375 V639 P641	H344-M364 HydrophobicContact CB-CB 4.41Å; H344-M364 HydrophobicContact CB-CE 3.79Å; H344-M364 WeakPolarHBondContact ND1-CE 3.25Å; L345-M364 CarbonylContact O-C 3.46Å; L345-M364 WeakPolarHBondContact O-CA 3.49Å; V346-M364 HydrophobicContact CG2-CB 4.03Å; M364-D366 HydrophobicContact CE-CB 4.43Å; M364-W372 CarbonylContact O-C 3.56Å; M364-W372 WeakPolarHBondContact O-CA 3.43Å; M364-K373 HydrophobicContact CG-CB 4.13Å; M364-K373 PolarHBondContact N-O 2.86Å; M364-K373 PolarHBondContact O-N 3.07Å; M364-L375 HydrophobicContact CB-CD1 4.13Å; M364-L375 HydrophobicContact CB-CG 4.36Å; M364-L375 HydrophobicContact CG-CD1 4.4Å; M364-L375 HydrophobicContact CG-CD2 4.19Å; M364-L375 HydrophobicContact CG-CG 4.15Å; M364-L375 HydrophobicContact SD-CD2 4.37Å; M364-V639 HydrophobicContact SD-CG1 4.08Å; M364-P641 HydrophobicContact CE-CB 4.5Å; M364-P641 HydrophobicContact CE-CG 4.33Å; M364-P641 HydrophobicContact SD-CB 4.26Å; M364-P641 HydrophobicContact SD-CG 4.49Å
365	Y	93.1	Very high	90.6	Very high	13 Å²	13	58.9 Å²	58.9	5%	0.051	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120.2	173.4	-171.5	-109.8	0	0	0	109.9	H344 L345 E367 H370 W372 F623	H344-Y365 PolarHBondContact ND1-O 3.11Å; L345-Y365 PolarHBondContact O-N 3.06Å; Y365-E367 HydrophobicContact CD1-CG 4.1Å; Y365-E367 HydrophobicContact CE1-CG 4.3Å; Y365-H370 WeakPolarHBondContact OH-CA 3.37Å; Y365-H370 PolarHBondContact OH-ND1 3.24Å; Y365-W372 HydrophobicContact CD2-CD2 4.01Å; Y365-W372 AromaticContact CD2-CE2 3.84Å; Y365-W372 HydrophobicContact CD2-CG 4.22Å; Y365-W372 HydrophobicContact CD2-CZ2 4.3Å; Y365-W372 AromaticContact CD2-NE1 3.9Å; Y365-F623 AromaticContact CD1-CE1 3.82Å; Y365-F623 HydrophobicContact CD1-CE1 3.82Å; Y365-F623 HydrophobicContact CD1-CE2 4.4Å; Y365-F623 AromaticContact CD1-CZ 3.7Å; Y365-F623 HydrophobicContact CD1-CZ 3.7Å; Y365-F623 HydrophobicContact CD2-CD2 4.36Å; Y365-F623 HydrophobicContact CD2-CE2 4.08Å; Y365-F623 HydrophobicContact CD2-CZ 4.18Å; Y365-F623 AromaticContact CE1-CD1 3.79Å; Y365-F623 HydrophobicContact CE1-CD1 3.79Å; Y365-F623 AromaticContact CE1-CE1 3.28Å; Y365-F623 HydrophobicContact CE1-CE1 3.28Å; Y365-F623 HydrophobicContact CE1-CE2 4.45Å; Y365-F623 AromaticContact CE1-CZ 3.67Å; Y365-F623 HydrophobicContact CE1-CZ 3.67Å; Y365-F623 AromaticContact CE2-CD1 3.97Å; Y365-F623 HydrophobicContact CE2-CD1 3.97Å; Y365-F623 HydrophobicContact CE2-CD2 4.05Å; Y365-F623 HydrophobicContact CE2-CE1 4.08Å; Y365-F623 HydrophobicContact CE2-CE2 4.13Å; Y365-F623 AromaticContact CE2-CG 3.97Å; Y365-F623 HydrophobicContact CE2-CG 3.97Å; Y365-F623 HydrophobicContact CE2-CZ 4.16Å; Y365-F623 HydrophobicContact CG-CE1 4.41Å; Y365-F623 HydrophobicContact CG-CE2 4.23Å; Y365-F623 AromaticContact CG-CZ 3.96Å; Y365-F623 HydrophobicContact CG-CZ 3.96Å; Y365-F623 AromaticContact CZ-CD1 3.41Å; Y365-F623 VanDerWaalsContact CZ-CD1 3.41Å; Y365-F623 AromaticContact CZ-CE1 3.43Å; Y365-F623 VanDerWaalsContact CZ-CE1 3.43Å; Y365-F623 AromaticContact CZ-CG 3.89Å; Y365-F623 AromaticContact CZ-CZ 3.91Å; Y365-F623 VanDerWaalsContact OH-CD1 3.28Å; Y365-F623 WeakPolarHBondContact OH-CD1 3.49Å
366	D	90	Very high	91.5	Very high	19 Å²	19	53.7 Å²	53.7	10%	0.102	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	105.4	171.9	-174.8	-20.3	0	0	0	108.9	M364 K368 A369 H370 E371 K373	M364-D366 HydrophobicContact CE-CB 4.43Å; D366-K368 PolarHBondContact O-N 3.38Å; D366-K368 PolarHBondContact OD1-N 2.8Å; D366-A369 HydrophobicContact CB-CB 4.09Å; D366-A369 PolarHBondContact O-N 3.24Å; D366-A369 PolarHBondContact OD1-N 2.79Å; D366-H370 WeakPolarHBondContact O-CA 3.1Å; D366-H370 PolarHBondContact O-N 3.01Å; D366-E371 PolarHBondContact N-O 2.93Å; D366-E371 PolarHBondContact O-N 3.34Å; D366-K373 HydrophobicContact CB-CD 4.13Å; D366-K373 WeakPolarHBondContact OD2-CE 3.23Å; D366-K373 IonicContact OD2-NZ 3.26Å; D366-K373 PolarHBondContact OD2-NZ 2.83Å
367	E	85.6	Confident	92.2	Very high	72 Å²	72	51.2 Å²	51.2	34%	0.336	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-26.1	-177.1	-54.8	-163.9	126.6	0	0	113.7	Y365 H370 F588	Y365-E367 HydrophobicContact CD1-CG 4.1Å; Y365-E367 HydrophobicContact CE1-CG 4.3Å; E367-H370 PolarHBondContact O-CE1 2.93Å; E367-H370 VanDerWaalsContact O-CE1 3.28Å; E367-H370 PolarHBondContact O-ND1 2.91Å; E367-F588 WeakPolarHBondContact OE1-CE1 3.47Å; E367-F588 WeakPolarHBondContact OE1-CZ 3.47Å
368	K	86.4	Confident	92.5	Very high	170 Å²	170	48 Å²	48	74%	0.739	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-38.8	-179	-66.4	-178.1	-179.8	176	0	111.3	D366 H370	D366-K368 PolarHBondContact O-N 3.38Å; D366-K368 PolarHBondContact OD1-N 2.8Å; K368-H370 VanDerWaalsContact C-N 3.34Å
369	A	87.4	Confident	92.5	Very high	41 Å²	41	54.2 Å²	54.2	34%	0.339	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-16.7	175.4	0	0	0	0	0	112.4	D366 E371	D366-A369 HydrophobicContact CB-CB 4.09Å; D366-A369 PolarHBondContact O-N 3.24Å; D366-A369 PolarHBondContact OD1-N 2.79Å; A369-E371 HydrophobicContact CB-CB 4.21Å; A369-E371 PolarHBondContact O-N 3.07Å
370	H	88.3	Confident	92.4	Very high	139 Å²	139	54.8 Å²	54.8	64%	0.644	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	33.4	-169	-65.7	-66.7	0	0	0	113.8	Y365 D366 E367 K368	Y365-H370 WeakPolarHBondContact OH-CA 3.37Å; Y365-H370 PolarHBondContact OH-ND1 3.24Å; D366-H370 WeakPolarHBondContact O-CA 3.1Å; D366-H370 PolarHBondContact O-N 3.01Å; E367-H370 PolarHBondContact O-CE1 2.93Å; E367-H370 VanDerWaalsContact O-CE1 3.28Å; E367-H370 PolarHBondContact O-ND1 2.91Å; K368-H370 VanDerWaalsContact C-N 3.34Å
371	E	91	Very high	92.4	Very high	122 Å²	122	52.5 Å²	52.5	57%	0.57	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.4	-171.7	-74.3	178.8	175.1	0	0	112.7	D366 A369	D366-E371 PolarHBondContact N-O 2.93Å; D366-E371 PolarHBondContact O-N 3.34Å; A369-E371 HydrophobicContact CB-CB 4.21Å; A369-E371 PolarHBondContact O-N 3.07Å
372	W	91.8	Very high	92.3	Very high	41 Å²	41	50.4 Å²	50.4	16%	0.155	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.8	170.9	-70.2	95	0	0	0	110.5	L345 T347 R363 M364 Y365 F623 D624 L625 P626	L345-W372 HydrophobicContact CD2-CH2 3.79Å; L345-W372 HydrophobicContact CD2-CZ2 4.31Å; L345-W372 HydrophobicContact CG-CH2 4.06Å; T347-W372 HydrophobicContact CG2-CH2 3.36Å; T347-W372 HydrophobicContact CG2-CZ2 4.33Å; T347-W372 HydrophobicContact CG2-CZ3 3.61Å; T347-W372 WeakPolarHBondContact OG1-CZ3 3.48Å; R363-W372 HydrophobicContact CB-CE3 3.85Å; R363-W372 HydrophobicContact CB-CZ3 4.48Å; M364-W372 CarbonylContact O-C 3.56Å; M364-W372 WeakPolarHBondContact O-CA 3.43Å; Y365-W372 HydrophobicContact CD2-CD2 4.01Å; Y365-W372 AromaticContact CD2-CE2 3.84Å; Y365-W372 HydrophobicContact CD2-CG 4.22Å; Y365-W372 HydrophobicContact CD2-CZ2 4.3Å; Y365-W372 AromaticContact CD2-NE1 3.9Å; W372-F623 HydrophobicContact CZ2-CD2 4.25Å; W372-F623 AromaticContact CZ2-CE2 3.74Å; W372-F623 HydrophobicContact CZ2-CE2 3.74Å; W372-D624 PolarHBondContact NE1-O 2.84Å; W372-L625 HydrophobicContact CH2-CD2 4.14Å; W372-L625 HydrophobicContact CZ2-CD2 3.6Å; W372-P626 HydrophobicContact CB-CG 3.91Å; W372-P626 HydrophobicContact CG-CG 3.97Å
373	K	93.4	Very high	92.2	Very high	41 Å²	41	50.4 Å²	50.4	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.6	176.8	-66.7	-178.1	174.6	174	0	110.8	R363 M364 D366 P642	R363-K373 CarbonylContact C-O 3.59Å; R363-K373 WeakPolarHBondContact CA-O 3.42Å; M364-K373 HydrophobicContact CG-CB 4.13Å; M364-K373 PolarHBondContact N-O 2.86Å; M364-K373 PolarHBondContact O-N 3.07Å; D366-K373 HydrophobicContact CB-CD 4.13Å; D366-K373 WeakPolarHBondContact OD2-CE 3.23Å; D366-K373 IonicContact OD2-NZ 3.26Å; D366-K373 PolarHBondContact OD2-NZ 2.83Å; K373-P642 HydrophobicContact CB-CG 3.99Å; K373-P642 HydrophobicContact CD-CG 4.45Å
374	S	93.8	Very high	92.1	Very high	67 Å²	67	49.6 Å²	49.6	47%	0.469	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.3	178.1	-66.4	0	0	0	0	111.6
375	L	95.8	Very high	92.2	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.042	26%	0.261	C	S	.	.			trans	-92	-177.2	163.9	-63.1	177.1	0	0	0	109.3	L362 M364 P377 F417 V639	L362-L375 HydrophobicContact CB-CB 4.21Å; L362-L375 HydrophobicContact CD2-CB 3.76Å; L362-L375 HydrophobicContact CD2-CD1 3.74Å; L362-L375 HydrophobicContact CD2-CG 4.4Å; L362-L375 HydrophobicContact CG-CB 3.98Å; L362-L375 HydrophobicContact CG-CD1 4.01Å; L362-L375 PolarHBondContact O-N 2.82Å; M364-L375 HydrophobicContact CB-CD1 4.13Å; M364-L375 HydrophobicContact CB-CG 4.36Å; M364-L375 HydrophobicContact CG-CD1 4.4Å; M364-L375 HydrophobicContact CG-CD2 4.19Å; M364-L375 HydrophobicContact CG-CG 4.15Å; M364-L375 HydrophobicContact SD-CD2 4.37Å; L375-P377 WeakPolarHBondContact O-CD 3.39Å; L375-F417 HydrophobicContact CB-CZ 4.34Å; L375-F417 HydrophobicContact CD1-CE1 4.26Å; L375-F417 HydrophobicContact CD1-CZ 4.22Å; L375-V639 HydrophobicContact CD1-CG1 4.21Å; L375-V639 HydrophobicContact CD1-CG2 4.26Å; L375-V639 HydrophobicContact CD2-CG2 4.08Å
376	A	95.4	Very high	92.4	Very high	21 Å²	21	49.1 Å²	49.1	17%	0.174	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-59.6	123.9	177	0	0	0	0	0	110	F417 N422 W424	A376-F417 HydrophobicContact CB-CE2 4.34Å; A376-N422 WeakPolarHBondContact CB-O 3.46Å; A376-N422 WeakPolarHBondContact CB-OD1 3.46Å; A376-N422 PolarHBondContact N-ND2 2.8Å; A376-N422 PolarHBondContact N-OD1 2.9Å; A376-W424 PolarHBondContact O-NE1 2.81Å
377	P	95.7	Very high	92.8	Very high	52 Å²	52	49.6 Å²	49.6	34%	0.338	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-71.4	159.5	179.5	30.4	-35.1	0	0	0	110.6	K360 L375 W424	K360-P377 HydrophobicContact CG-CB 4.16Å; L375-P377 WeakPolarHBondContact O-CD 3.39Å; P377-W424 PolarHBondContact O-NE1 2.8Å
378	M	95.2	Very high	93.4	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.015	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-69.3	154.3	167.8	-66.2	-176.3	65.1	0	0	110.8	L348 K360 A380 R382 V396 F415 W424	L348-M378 HydrophobicContact CD1-CG 4.07Å; L348-M378 HydrophobicContact CD1-SD 3.87Å; L348-M378 HydrophobicContact CD2-SD 3.88Å; L348-M378 HydrophobicContact CG-SD 4.32Å; K360-M378 HydrophobicContact CB-CB 4.36Å; K360-M378 WeakPolarHBondContact CD-O 3.36Å; K360-M378 PolarHBondContact O-N 2.9Å; M378-A380 VanDerWaalsContact C-N 3.35Å; M378-A380 WeakPolarHBondContact CB-O 3.43Å; M378-R382 HydrophobicContact CE-CG 3.67Å; M378-R382 HydrophobicContact SD-CB 4.47Å; M378-R382 HydrophobicContact SD-CG 4Å; M378-V396 HydrophobicContact CE-CB 4.25Å; M378-V396 HydrophobicContact CE-CG1 3.84Å; M378-V396 HydrophobicContact SD-CB 4.36Å; M378-V396 HydrophobicContact SD-CG1 3.88Å; M378-V396 HydrophobicContact SD-CG2 4.25Å; M378-F415 HydrophobicContact CE-CB 4.03Å; M378-F415 HydrophobicContact CE-CD2 3.45Å; M378-F415 VanDerWaalsContact CE-CD2 3.45Å; M378-F415 HydrophobicContact CE-CE2 4.12Å; M378-F415 HydrophobicContact CE-CG 3.87Å; M378-W424 HydrophobicContact CG-CD2 4.12Å; M378-W424 HydrophobicContact CG-CE3 4.35Å; M378-W424 HydrophobicContact CG-CH2 3.8Å; M378-W424 HydrophobicContact CG-CZ2 3.53Å; M378-W424 HydrophobicContact CG-CZ3 4.19Å; M378-W424 HydrophobicContact SD-CH2 4.14Å; M378-W424 HydrophobicContact SD-CZ2 4.43Å; M378-W424 HydrophobicContact SD-CZ3 4.44Å
379	D	91	Very high	94	Very high	146 Å²	146	40.7 Å²	40.7	78%	0.781	23%	0.229	S	C	*	.	S	Bend	trans	-67.6	-38.4	172	-68	-31.6	0	0	0	111.8
380	A	90.9	Very high	94.5	Very high	25 Å²	25	39.3 Å²	39.3	21%	0.207	22%	0.216	C	C	.	.	S	Bend	trans	-113.1	135.6	179.4	0	0	0	0	0	111.3	M378	M378-A380 VanDerWaalsContact C-N 3.35Å; M378-A380 WeakPolarHBondContact CB-O 3.43Å
381	P	93.5	Very high	94.8	Very high	39 Å²	39	34 Å²	34	25%	0.253	20%	0.199	S	C	.	.			trans	-69.7	151.2	177.3	32	-36.9	0	0	0	111.7	V358 S359 K360	V358-P381 HydrophobicContact CB-CB 3.88Å; V358-P381 HydrophobicContact CB-CG 4.39Å; V358-P381 HydrophobicContact CG1-CB 3.77Å; V358-P381 WeakPolarHBondContact O-CB 2.92Å; S359-P381 WeakPolarHBondContact O-CA 3.19Å; S359-P381 WeakPolarHBondContact O-CB 3.45Å; K360-P381 HydrophobicContact CB-CB 4.11Å
382	R	94.3	Very high	95.1	Very high	9 Å²	9	30.1 Å²	30.1	3%	0.034	18%	0.181	C	C	.	.			trans	-143.8	133.9	-175.8	-66.8	-72.6	173.3	-103.8	9.9	111.7	G349 G350 S359 M378 H385 V396 G398 S401 T413	G349-R382 CarbonylContact C-O 3.59Å; G349-R382 VanDerWaalsContact CA-O 3.26Å; G349-R382 WeakPolarHBondContact CA-O 3.25Å; G350-R382 PolarHBondContact N-O 2.58Å; S359-R382 PolarHBondContact O-N 3.06Å; M378-R382 HydrophobicContact CE-CG 3.67Å; M378-R382 HydrophobicContact SD-CB 4.47Å; M378-R382 HydrophobicContact SD-CG 4Å; R382-H385 HydrophobicContact CB-CB 4.32Å; R382-H385 WeakPolarHBondContact CB-ND1 3.3Å; R382-H385 PolarHBondContact O-ND1 3.31Å; R382-V396 HydrophobicContact CG-CG1 4.22Å; R382-G398 WeakPolarHBondContact CD-O 3.5Å; R382-S401 PolarHBondContact NH1-OG 3.17Å; R382-T413 PolarHBondContact NH2-OG1 2.69Å
383	Y	92.7	Very high	95.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-137.2	158.8	161.8	77.2	-66	0	0	0	109.6	V351 V358 H385 Q400 N402 Y403 D404	V351-Y383 HydrophobicContact CB-CD2 4.16Å; V351-Y383 HydrophobicContact CB-CG 4.06Å; V351-Y383 HydrophobicContact CG1-CD2 3.84Å; V351-Y383 HydrophobicContact CG1-CE2 4.4Å; V351-Y383 HydrophobicContact CG1-CG 4.25Å; V358-Y383 HydrophobicContact CB-CD1 4.27Å; V358-Y383 HydrophobicContact CG1-CD1 3.63Å; V358-Y383 HydrophobicContact CG1-CG 4.26Å; V358-Y383 HydrophobicContact CG2-CD1 3.52Å; V358-Y383 HydrophobicContact CG2-CE1 3.82Å; V358-Y383 HydrophobicContact CG2-CG 4.42Å; Y383-H385 PolarHBondContact O-N 3.47Å; Y383-Q400 HydrophobicContact CD1-CB 4.04Å; Y383-Q400 VanDerWaalsContact CD1-O 3.23Å; Y383-Q400 WeakPolarHBondContact CD1-O 3.45Å; Y383-Q400 HydrophobicContact CE1-CB 3.31Å; Y383-Q400 HydrophobicContact CE1-CG 4.44Å; Y383-Q400 PolarHBondContact N-O 2.91Å; Y383-Q400 PolarHBondContact O-N 2.83Å; Y383-Q400 PolarHBondContact OH-NE2 3.06Å; Y383-N402 WeakPolarHBondContact CE1-O 3.38Å; Y383-N402 PolarHBondContact OH-O 2.85Å; Y383-Y403 HydrophobicContact CE2-CD2 4.4Å; Y383-Y403 VanDerWaalsContact OH-CA 3.29Å; Y383-Y403 WeakPolarHBondContact OH-CA 3.31Å; Y383-D404 PolarHBondContact OH-N 3.37Å; Y383-D404 PolarHBondContact OH-O 2.94Å
384	Q	94	Very high	95.7	Very high	13 Å²	13	26.4 Å²	26.4	6%	0.061	17%	0.167	C	C	.	.	S	Bend	trans	54.6	24.1	-175.6	-68.8	166.3	-5.1	0	0	114.6	T435 F436 D582 G631	Q384-T435 WeakPolarHBondContact CB-OG1 3.39Å; Q384-T435 PolarHBondContact O-OG1 3Å; Q384-F436 HydrophobicContact CG-CD1 4.16Å; Q384-F436 HydrophobicContact CG-CE1 3.96Å; Q384-F436 HydrophobicContact CG-CZ 4.31Å; Q384-F436 PolarHBondContact O-N 3.47Å; Q384-D582 VanDerWaalsContact CG-OD2 3.29Å; Q384-D582 WeakPolarHBondContact CG-OD2 3.4Å; Q384-D582 PolarHBondContact NE2-OD2 2.96Å; Q384-G631 PolarHBondContact N-O 3.28Å
385	H	96.8	Very high	95.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.144	C	C	.	.			trans	-80.1	161.7	172.9	57.6	-85.2	0	0	0	110.1	R382 Y383 I387 V396 V397 R633	R382-H385 HydrophobicContact CB-CB 4.32Å; R382-H385 WeakPolarHBondContact CB-ND1 3.3Å; R382-H385 PolarHBondContact O-ND1 3.31Å; Y383-H385 PolarHBondContact O-N 3.47Å; H385-I387 WeakPolarHBondContact CD2-CG2 3.48Å; H385-V396 HydrophobicContact CB-CG1 4.29Å; H385-V397 WeakPolarHBondContact CB-O 3.2Å; H385-R633 WeakPolarHBondContact NE2-CG 3.43Å; H385-R633 PolarHBondContact O-NE 2.89Å
386	G	97.6	Very high	96	Very high	4 Å²	4	22.9 Å²	22.9	4%	0.041	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	143.1	167.6	0	0	0	0	0	110.4	V396 V397	G386-V396 WeakPolarHBondContact O-CA 3.43Å; G386-V397 PolarHBondContact N-O 3.25Å; G386-V397 PolarHBondContact O-N 2.88Å
387	I	97.8	Very high	96.2	Very high	28 Å²	28	21.9 Å²	21.9	14%	0.144	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	148.4	166.4	64.9	166.5	0	0	0	111.7	L348 H385 L394 Y395 V396 R633 A634 C635	L348-I387 HydrophobicContact CD2-CG2 4.37Å; H385-I387 WeakPolarHBondContact CD2-CG2 3.48Å; I387-L394 HydrophobicContact CB-CD1 3.92Å; I387-L394 HydrophobicContact CD1-CD1 4.48Å; I387-L394 HydrophobicContact CG2-CD1 4.25Å; I387-Y395 VanDerWaalsContact CA-O 3.23Å; I387-Y395 WeakPolarHBondContact CA-O 3.29Å; I387-V396 HydrophobicContact CG2-CG2 4.33Å; I387-R633 HydrophobicContact CB-CB 4.43Å; I387-R633 HydrophobicContact CD1-CB 3.54Å; I387-R633 HydrophobicContact CG1-CB 3.79Å; I387-R633 HydrophobicContact CG1-CG 4.38Å; I387-R633 HydrophobicContact CG2-CB 3.8Å; I387-R633 HydrophobicContact CG2-CG 4.16Å; I387-A634 VanDerWaalsContact CD1-O 3.26Å; I387-A634 WeakPolarHBondContact CD1-O 3.43Å; I387-C635 HydrophobicContact CD1-CB 3.87Å
388	A	98.3	Very high	96.3	Very high	10 Å²	10	19.4 Å²	19.4	8%	0.083	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	155	176.3	0	0	0	0	0	109.3	Y395 L439 A441 L446	A388-Y395 PolarHBondContact N-O 3.23Å; A388-Y395 PolarHBondContact O-N 2.93Å; A388-L439 HydrophobicContact CB-CD2 3.74Å; A388-L439 HydrophobicContact CB-CG 3.97Å; A388-A441 HydrophobicContact CB-CB 4.23Å; A388-L446 HydrophobicContact CB-CD2 3.56Å
389	V	98.4	Very high	96.4	Very high	46 Å²	46	19.3 Å²	19.3	28%	0.279	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.4	179.4	-179.1	0	0	0	0	109.2	F393 L394 A441 C635 L637	V389-F393 VanDerWaalsContact CA-O 3.3Å; V389-F393 WeakPolarHBondContact CA-O 3.34Å; V389-L394 HydrophobicContact CG2-CD1 4.34Å; V389-A441 WeakPolarHBondContact O-CB 3.41Å; V389-C635 HydrophobicContact CG2-CB 4.17Å; V389-L637 HydrophobicContact CB-CD2 4.49Å; V389-L637 HydrophobicContact CG1-CD2 3.8Å; V389-L637 HydrophobicContact CG2-CD2 3.79Å
390	I	98.1	Very high	96.5	Very high	12 Å²	12	12.3 Å²	12.3	6%	0.062	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.2	169.8	-59.5	175.6	0	0	0	107.2	P329 V330 N392 F393 Y395 A441 L446 P466	P329-I390 HydrophobicContact CB-CB 3.94Å; P329-I390 HydrophobicContact CB-CG2 3.64Å; P329-I390 WeakPolarHBondContact CB-O 3.48Å; V330-I390 HydrophobicContact CG1-CG2 4Å; I390-N392 PolarHBondContact O-N 3.42Å; I390-F393 PolarHBondContact N-O 3.29Å; I390-F393 WeakPolarHBondContact O-CB 3.32Å; I390-F393 PolarHBondContact O-N 2.92Å; I390-Y395 HydrophobicContact CB-CE2 4.21Å; I390-Y395 HydrophobicContact CD1-CE2 4.34Å; I390-Y395 HydrophobicContact CG1-CE2 4.44Å; I390-A441 HydrophobicContact CD1-CB 4.41Å; I390-A441 HydrophobicContact CG1-CB 3.68Å; I390-L446 HydrophobicContact CD1-CD2 3.41Å; I390-L446 VanDerWaalsContact CD1-CD2 3.41Å; I390-L446 HydrophobicContact CD1-CG 3.66Å; I390-L446 HydrophobicContact CG1-CD2 3.82Å; I390-P466 HydrophobicContact CD1-CG 4.27Å
391	G	96.4	Very high	96.6	Very high	28 Å²	28	12.7 Å²	12.7	29%	0.289	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	38.5	175.1	0	0	0	0	0	114.1	P329 F393	P329-G391 WeakPolarHBondContact O-CA 3.15Å; G391-F393 WeakPolarHBondContact O-CD2 3.43Å; G391-F393 WeakPolarHBondContact O-CE2 3.26Å; G391-F393 PolarHBondContact O-N 3.45Å
392	N	97.2	Very high	96.3	Very high	39 Å²	39	15.9 Å²	15.9	21%	0.209	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	11.3	-174.3	-163.2	49.3	0	0	0	115.4	I390 P419 T638	I390-N392 PolarHBondContact O-N 3.42Å; N392-P419 WeakPolarHBondContact ND2-CG 3.39Å; N392-P419 WeakPolarHBondContact O-CD 3.45Å; N392-P419 WeakPolarHBondContact O-CG 3.19Å; N392-T638 PolarHBondContact ND2-O 2.77Å; N392-T638 PolarHBondContact OD1-N 3.1Å
393	F	98.1	Very high	96	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.018	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.2	168.4	-63.8	-100.5	0	0	0	109.9	Q328 P329 V389 I390 G391 Y395 R416 D418	Q328-F393 HydrophobicContact CB-CE2 4.3Å; Q328-F393 HydrophobicContact CB-CZ 3.89Å; P329-F393 HydrophobicContact CB-CB 4.4Å; P329-F393 HydrophobicContact CB-CD2 3.82Å; P329-F393 HydrophobicContact CB-CE2 4.45Å; P329-F393 HydrophobicContact CB-CG 4.31Å; P329-F393 HydrophobicContact CG-CB 4.07Å; P329-F393 HydrophobicContact CG-CD1 4.43Å; P329-F393 HydrophobicContact CG-CD2 3.68Å; P329-F393 HydrophobicContact CG-CE2 4.21Å; P329-F393 HydrophobicContact CG-CG 3.82Å; V389-F393 VanDerWaalsContact CA-O 3.3Å; V389-F393 WeakPolarHBondContact CA-O 3.34Å; I390-F393 PolarHBondContact N-O 3.29Å; I390-F393 WeakPolarHBondContact O-CB 3.32Å; I390-F393 PolarHBondContact O-N 2.92Å; G391-F393 WeakPolarHBondContact O-CD2 3.43Å; G391-F393 WeakPolarHBondContact O-CE2 3.26Å; G391-F393 PolarHBondContact O-N 3.45Å; F393-Y395 HydrophobicContact CB-CE2 4.26Å; F393-R416 HydrophobicContact CB-CG 3.99Å; F393-R416 HydrophobicContact CD1-CG 4.36Å; F393-D418 HydrophobicContact CD1-CB 4.09Å; F393-D418 HydrophobicContact CE1-CB 3.94Å; F393-D418 VanDerWaalsContact CE1-CG 3.44Å; F393-D418 WeakPolarHBondContact CE1-OD2 3.42Å
394	L	98.6	Very high	95.8	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.6	176.7	166	66.7	0	0	0	110	L362 I387 V389 V396 R416 F417 W424 L637	L362-L394 HydrophobicContact CD1-CD2 3.76Å; I387-L394 HydrophobicContact CB-CD1 3.92Å; I387-L394 HydrophobicContact CD1-CD1 4.48Å; I387-L394 HydrophobicContact CG2-CD1 4.25Å; V389-L394 HydrophobicContact CG2-CD1 4.34Å; L394-V396 HydrophobicContact CG-CG2 4.36Å; L394-R416 CarbonylContact O-C 3.57Å; L394-R416 VanDerWaalsContact O-CA 3.3Å; L394-R416 WeakPolarHBondContact O-CA 3.42Å; L394-F417 HydrophobicContact CB-CB 4.15Å; L394-F417 PolarHBondContact N-O 2.84Å; L394-F417 PolarHBondContact O-N 2.76Å; L394-W424 HydrophobicContact CD2-CH2 4.22Å; L394-L637 HydrophobicContact CB-CD1 3.82Å; L394-L637 HydrophobicContact CB-CD2 4.21Å; L394-L637 HydrophobicContact CD2-CD1 4.11Å
395	Y	98.7	Very high	95.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	141.4	171.9	-75	-97.5	0	0	0	110.8	P329 I387 A388 I390 F393 V414 F415 R416 V427 L446 Y464	P329-Y395 HydrophobicContact CB-CE2 4.47Å; P329-Y395 HydrophobicContact CG-CE2 4.28Å; P329-Y395 WeakPolarHBondContact CG-OH 3.24Å; I387-Y395 VanDerWaalsContact CA-O 3.23Å; I387-Y395 WeakPolarHBondContact CA-O 3.29Å; A388-Y395 PolarHBondContact N-O 3.23Å; A388-Y395 PolarHBondContact O-N 2.93Å; I390-Y395 HydrophobicContact CB-CE2 4.21Å; I390-Y395 HydrophobicContact CD1-CE2 4.34Å; I390-Y395 HydrophobicContact CG1-CE2 4.44Å; F393-Y395 HydrophobicContact CB-CE2 4.26Å; Y395-V414 HydrophobicContact CD1-CG1 4.2Å; Y395-F415 CarbonylContact C-O 3.51Å; Y395-F415 WeakPolarHBondContact CA-O 3.45Å; Y395-R416 HydrophobicContact CD1-CB 4.14Å; Y395-R416 HydrophobicContact CD1-CG 4.26Å; Y395-R416 HydrophobicContact CD2-CG 4.3Å; Y395-R416 HydrophobicContact CE1-CB 4.01Å; Y395-R416 HydrophobicContact CE1-CG 3.97Å; Y395-R416 HydrophobicContact CE2-CG 3.99Å; Y395-R416 HydrophobicContact CG-CG 4.44Å; Y395-V427 HydrophobicContact CD1-CG2 4.49Å; Y395-V427 HydrophobicContact CE1-CG2 4.23Å; Y395-L446 HydrophobicContact CD1-CD1 3.5Å; Y395-L446 HydrophobicContact CD2-CD1 4.11Å; Y395-L446 HydrophobicContact CE1-CD1 3.97Å; Y395-L446 HydrophobicContact CG-CD1 3.55Å; Y395-Y464 HydrophobicContact CE1-CD1 4.45Å; Y395-Y464 AromaticContact CE1-CE1 3.88Å; Y395-Y464 HydrophobicContact CE1-CE1 3.88Å
396	V	98.4	Very high	94.8	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	112.2	177.3	-178.1	0	0	0	0	107.5	L348 M378 R382 H385 G386 I387 L394 V414 F415 W424	L348-V396 HydrophobicContact CD2-CB 4.18Å; L348-V396 HydrophobicContact CD2-CG1 3.91Å; L348-V396 HydrophobicContact CD2-CG2 3.17Å; M378-V396 HydrophobicContact CE-CB 4.25Å; M378-V396 HydrophobicContact CE-CG1 3.84Å; M378-V396 HydrophobicContact SD-CB 4.36Å; M378-V396 HydrophobicContact SD-CG1 3.88Å; M378-V396 HydrophobicContact SD-CG2 4.25Å; R382-V396 HydrophobicContact CG-CG1 4.22Å; H385-V396 HydrophobicContact CB-CG1 4.29Å; G386-V396 WeakPolarHBondContact O-CA 3.43Å; I387-V396 HydrophobicContact CG2-CG2 4.33Å; L394-V396 HydrophobicContact CG-CG2 4.36Å; V396-V414 WeakPolarHBondContact O-CA 3.42Å; V396-F415 HydrophobicContact CB-CB 4.5Å; V396-F415 PolarHBondContact N-O 2.69Å; V396-F415 PolarHBondContact O-N 3.32Å; V396-W424 HydrophobicContact CB-CZ3 4.33Å; V396-W424 HydrophobicContact CG2-CH2 3.59Å; V396-W424 HydrophobicContact CG2-CZ3 3.56Å
397	V	98.6	Very high	94.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.7	-169.3	178.9	0	0	0	0	109.3	H385 G386 V414 L430 F437 L439 W471	H385-V397 WeakPolarHBondContact CB-O 3.2Å; G386-V397 PolarHBondContact N-O 3.25Å; G386-V397 PolarHBondContact O-N 2.88Å; V397-V414 HydrophobicContact CB-CG1 4.5Å; V397-V414 HydrophobicContact CB-CG2 4.31Å; V397-V414 HydrophobicContact CG1-CG2 3.93Å; V397-V414 HydrophobicContact CG2-CB 4.49Å; V397-V414 HydrophobicContact CG2-CG1 3.64Å; V397-V414 HydrophobicContact CG2-CG2 4.13Å; V397-L430 HydrophobicContact CG1-CD1 3.6Å; V397-L430 HydrophobicContact CG1-CD2 3.9Å; V397-L430 HydrophobicContact CG1-CG 3.82Å; V397-F437 HydrophobicContact CB-CE2 4.45Å; V397-F437 HydrophobicContact CB-CZ 3.94Å; V397-F437 HydrophobicContact CG1-CE2 4.07Å; V397-F437 HydrophobicContact CG1-CZ 3.7Å; V397-F437 WeakPolarHBondContact O-CE1 3.34Å; V397-F437 WeakPolarHBondContact O-CZ 3.41Å; V397-L439 HydrophobicContact CB-CD1 4.22Å; V397-L439 HydrophobicContact CB-CD2 3.83Å; V397-L439 HydrophobicContact CG1-CD1 4.34Å; V397-L439 HydrophobicContact CG2-CD1 3.94Å; V397-L439 HydrophobicContact CG2-CD2 3.45Å; V397-L439 VanDerWaalsContact CG2-CD2 3.45Å; V397-L439 HydrophobicContact CG2-CG 4.39Å; V397-W471 HydrophobicContact CG1-CH2 4.13Å; V397-W471 HydrophobicContact CG1-CZ2 4.05Å; V397-W471 HydrophobicContact CG2-CH2 4.33Å; V397-W471 HydrophobicContact CG2-CZ2 4.14Å
398	G	98.1	Very high	94.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.			trans	58.1	-139.6	171.2	0	0	0	0	0	114.1	R382 V411 T413	R382-G398 WeakPolarHBondContact CD-O 3.5Å; G398-V411 WeakPolarHBondContact CA-O 3.36Å; G398-V411 WeakPolarHBondContact O-CG2 3.41Å; G398-T413 PolarHBondContact N-O 3.48Å; G398-T413 VanDerWaalsContact N-O 3.15Å
399	G	96.8	Very high	93.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.191	C	C	.	.			trans	83.1	-150.3	-175.9	0	0	0	0	0	112.1	A410 V411 R434	G399-A410 WeakPolarHBondContact O-CA 3.43Å; G399-V411 WeakPolarHBondContact O-CG2 3.4Å; G399-V411 PolarHBondContact O-N 2.96Å; G399-R434 PolarHBondContact N-O 2.82Å
400	Q	94.1	Very high	93.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-139.9	141.3	-175.5	-63.4	-178	105.3	0	0	110.7	Y383 D404 T409 T435	Y383-Q400 HydrophobicContact CD1-CB 4.04Å; Y383-Q400 VanDerWaalsContact CD1-O 3.23Å; Y383-Q400 WeakPolarHBondContact CD1-O 3.45Å; Y383-Q400 HydrophobicContact CE1-CB 3.31Å; Y383-Q400 HydrophobicContact CE1-CG 4.44Å; Y383-Q400 PolarHBondContact N-O 2.91Å; Y383-Q400 PolarHBondContact O-N 2.83Å; Y383-Q400 PolarHBondContact OH-NE2 3.06Å; Q400-D404 PolarHBondContact NE2-O 3.2Å; Q400-D404 PolarHBondContact OE1-O 3.12Å; Q400-D404 PolarHBondContact OE1-OD2 3.42Å; Q400-T409 PolarHBondContact OE1-OG1 2.99Å; Q400-T435 HydrophobicContact CG-CG2 4.07Å; Q400-T435 PolarHBondContact NE2-OG1 2.83Å
401	S	91.2	Very high	93.8	Very high	33 Å²	33	35 Å²	35	23%	0.231	19%	0.185	C	C	.	.	S	Bend	trans	-83.9	-26.1	173.2	-50.3	0	0	0	0	112.8	V358 R382	V358-S401 WeakPolarHBondContact CB-O 3.43Å; V358-S401 VanDerWaalsContact CG2-O 3.26Å; V358-S401 WeakPolarHBondContact CG2-O 3.42Å; R382-S401 PolarHBondContact NH1-OG 3.17Å
402	N	88.7	Confident	93.9	Very high	105 Å²	105	35.9 Å²	35.9	56%	0.561	18%	0.183	S	C	*	.	S	Bend	trans	-125.5	144.1	-173.8	-62.9	-26.5	0	0	0	109.6	Y383 D404 T409	Y383-N402 WeakPolarHBondContact CE1-O 3.38Å; Y383-N402 PolarHBondContact OH-O 2.85Å; N402-D404 PolarHBondContact O-N 3.25Å; N402-T409 HydrophobicContact CB-CG2 4.41Å; N402-T409 PolarHBondContact O-OG1 3.23Å; N402-T409 VanDerWaalsContact O-OG1 3.14Å
403	Y	87.3	Confident	93.9	Very high	68 Å²	68	35.3 Å²	35.3	27%	0.267	18%	0.181	S	C	.	.			trans	-60.7	121.2	178.2	-176.4	-93.5	0	0	0	112	V351 R353 L356 Y383 T405	V351-Y403 HydrophobicContact CG1-CD2 4.08Å; V351-Y403 HydrophobicContact CG1-CE2 4.38Å; V351-Y403 HydrophobicContact CG2-CD2 3.84Å; V351-Y403 HydrophobicContact CG2-CG 4.49Å; R353-Y403 HydrophobicContact CG-CE2 4.18Å; R353-Y403 PolarHBondContact NE-OH 3.48Å; L356-Y403 HydrophobicContact CD2-CD1 3.56Å; L356-Y403 HydrophobicContact CD2-CE1 4.06Å; L356-Y403 HydrophobicContact CD2-CG 3.85Å; Y383-Y403 HydrophobicContact CE2-CD2 4.4Å; Y383-Y403 VanDerWaalsContact OH-CA 3.29Å; Y383-Y403 WeakPolarHBondContact OH-CA 3.31Å; Y403-T405 HydrophobicContact CE1-CG2 4.18Å; Y403-T405 WeakPolarHBondContact OH-CG2 3.17Å
404	D	88.4	Confident	94	Very high	31 Å²	31	35.1 Å²	35.1	17%	0.166	18%	0.181	C	C	.	.			trans	-161	128.9	178	178.4	69.8	0	0	0	108.9	Y383 Q400 N402 K406 G407 K408 T409	Y383-D404 PolarHBondContact OH-N 3.37Å; Y383-D404 PolarHBondContact OH-O 2.94Å; Q400-D404 PolarHBondContact NE2-O 3.2Å; Q400-D404 PolarHBondContact OE1-O 3.12Å; Q400-D404 PolarHBondContact OE1-OD2 3.42Å; N402-D404 PolarHBondContact O-N 3.25Å; D404-K406 VanDerWaalsContact OD2-C 3.29Å; D404-K406 WeakPolarHBondContact OD2-CA 3.26Å; D404-K406 PolarHBondContact OD2-N 3.07Å; D404-G407 WeakPolarHBondContact OD2-CA 3.44Å; D404-G407 PolarHBondContact OD2-N 3.03Å; D404-K408 PolarHBondContact OD2-N 2.84Å; D404-T409 HydrophobicContact CB-CG2 4.18Å
405	T	83.5	Confident	93.9	Very high	78 Å²	78	36 Å²	36	48%	0.479	19%	0.185	S	C	.	.	S	Bend	trans	-91.5	-5.1	-177.7	56.1	0	0	0	0	113.1	Y403	Y403-T405 HydrophobicContact CE1-CG2 4.18Å; Y403-T405 WeakPolarHBondContact OH-CG2 3.17Å
406	K	86.4	Confident	93.9	Very high	124 Å²	124	36.1 Å²	36.1	54%	0.539	19%	0.185	S	C	.	.	S	Bend	trans	-107.7	-2.5	-173.3	-65.2	-167.8	177.2	-169.6	0	113.7	D404 K408 R452	D404-K406 VanDerWaalsContact OD2-C 3.29Å; D404-K406 WeakPolarHBondContact OD2-CA 3.26Å; D404-K406 PolarHBondContact OD2-N 3.07Å; K406-K408 HydrophobicContact CB-CG 4.37Å; K406-R452 VanDerWaalsContact C-NE 3.33Å; K406-R452 VanDerWaalsContact O-CZ 3.28Å; K406-R452 PolarHBondContact O-NE 3.06Å; K406-R452 PolarHBondContact O-NH2 3.4Å
407	G	88.5	Confident	93.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	79.1	13.8	-179.4	0	0	0	0	0	114.9	D404 T409 A410 N453 A454	D404-G407 WeakPolarHBondContact OD2-CA 3.44Å; D404-G407 PolarHBondContact OD2-N 3.03Å; G407-T409 PolarHBondContact O-N 3.35Å; G407-A410 WeakPolarHBondContact O-CB 3.39Å; G407-A410 PolarHBondContact O-N 3.31Å; G407-N453 CarbonylContact O-C 3.19Å; G407-N453 VanDerWaalsContact O-CA 3.26Å; G407-N453 WeakPolarHBondContact O-CA 3.49Å; G407-A454 PolarHBondContact O-N 3.28Å
408	K	91.8	Very high	93.8	Very high	143 Å²	143	36.7 Å²	36.7	62%	0.622	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-26.5	-178.1	-68.1	-176.8	176.5	-175.5	0	112.9	D404 K406	D404-K408 PolarHBondContact OD2-N 2.84Å; K406-K408 HydrophobicContact CB-CG 4.37Å
409	T	95	Very high	93.6	Very high	46 Å²	46	37 Å²	37	28%	0.282	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	19.7	-178.4	63.6	0	0	0	0	112.3	Q400 N402 D404 G407	Q400-T409 PolarHBondContact OE1-OG1 2.99Å; N402-T409 HydrophobicContact CB-CG2 4.41Å; N402-T409 PolarHBondContact O-OG1 3.23Å; N402-T409 VanDerWaalsContact O-OG1 3.14Å; D404-T409 HydrophobicContact CB-CG2 4.18Å; G407-T409 PolarHBondContact O-N 3.35Å
410	A	97.3	Very high	93.3	Very high	8 Å²	8	38.6 Å²	38.6	7%	0.066	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-54.4	142.4	175.1	0	0	0	0	0	111.4	G399 G407 K433 T435 N453	G399-A410 WeakPolarHBondContact O-CA 3.43Å; G407-A410 WeakPolarHBondContact O-CB 3.39Å; G407-A410 PolarHBondContact O-N 3.31Å; A410-K433 HydrophobicContact CB-CB 4Å; A410-K433 WeakPolarHBondContact O-CD 3.38Å; A410-T435 HydrophobicContact CB-CG2 4.19Å; A410-N453 HydrophobicContact CB-CB 3.96Å
411	V	97.6	Very high	93.1	Very high	25 Å²	25	41.8 Å²	41.8	15%	0.152	21%	0.208	C	C	.	.			trans	-119.6	164.7	175.5	-59.8	0	0	0	0	111	G398 G399 R434	G398-V411 WeakPolarHBondContact CA-O 3.36Å; G398-V411 WeakPolarHBondContact O-CG2 3.41Å; G399-V411 WeakPolarHBondContact O-CG2 3.4Å; G399-V411 PolarHBondContact O-N 2.96Å; V411-R434 PolarHBondContact O-N 2.96Å
412	D	97.9	Very high	93.2	Very high	47 Å²	47	43 Å²	43	25%	0.251	21%	0.213	S	C	.	.			trans	-111.1	-11.7	-179.8	46.7	26.3	0	0	0	112.5	S429 L430 K433	D412-S429 CarbonylContact O-C 3.43Å; D412-S429 VanDerWaalsContact O-CA 3.3Å; D412-S429 WeakPolarHBondContact O-CA 3.33Å; D412-S429 WeakPolarHBondContact O-CB 3.19Å; D412-L430 HydrophobicContact CB-CB 4.07Å; D412-L430 PolarHBondContact O-N 3.06Å; D412-K433 HydrophobicContact CB-CG 3.82Å; D412-K433 VanDerWaalsContact OD2-CE 3.32Å; D412-K433 WeakPolarHBondContact OD2-CE 3.41Å
413	T	98.2	Very high	93.5	Very high	27 Å²	27	44.8 Å²	44.8	17%	0.166	22%	0.215	C	C	.	.			trans	-60.4	141.3	-175.8	59.3	0	0	0	0	112	R382 G398	R382-T413 PolarHBondContact NH2-OG1 2.69Å; G398-T413 PolarHBondContact N-O 3.48Å; G398-T413 VanDerWaalsContact N-O 3.15Å
414	V	98.3	Very high	94	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	128.2	176.2	-174.5	0	0	0	0	110.5	Y395 V396 V397 Q426 V427 A428 L430 W471	Y395-V414 HydrophobicContact CD1-CG1 4.2Å; V396-V414 WeakPolarHBondContact O-CA 3.42Å; V397-V414 HydrophobicContact CB-CG1 4.5Å; V397-V414 HydrophobicContact CB-CG2 4.31Å; V397-V414 HydrophobicContact CG1-CG2 3.93Å; V397-V414 HydrophobicContact CG2-CB 4.49Å; V397-V414 HydrophobicContact CG2-CG1 3.64Å; V397-V414 HydrophobicContact CG2-CG2 4.13Å; V414-Q426 WeakPolarHBondContact O-CA 3.4Å; V414-Q426 WeakPolarHBondContact O-CG 3.31Å; V414-V427 HydrophobicContact CB-CG2 3.66Å; V414-V427 HydrophobicContact CG1-CG2 3.36Å; V414-V427 PolarHBondContact O-N 3.26Å; V414-A428 WeakPolarHBondContact CB-O 3.45Å; V414-A428 WeakPolarHBondContact CG2-O 3.48Å; V414-L430 HydrophobicContact CG2-CG 4.4Å; V414-W471 HydrophobicContact CG2-CZ2 4Å
415	F	98	Very high	94.3	Very high	20 Å²	20	44.5 Å²	44.5	9%	0.088	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.4	176.8	-62.2	-84.7	0	0	0	110.5	M378 Y395 V396 W424 M425 Q426	M378-F415 HydrophobicContact CE-CB 4.03Å; M378-F415 HydrophobicContact CE-CD2 3.45Å; M378-F415 VanDerWaalsContact CE-CD2 3.45Å; M378-F415 HydrophobicContact CE-CE2 4.12Å; M378-F415 HydrophobicContact CE-CG 3.87Å; Y395-F415 CarbonylContact C-O 3.51Å; Y395-F415 WeakPolarHBondContact CA-O 3.45Å; V396-F415 HydrophobicContact CB-CB 4.5Å; V396-F415 PolarHBondContact N-O 2.69Å; V396-F415 PolarHBondContact O-N 3.32Å; F415-W424 HydrophobicContact CB-CE3 3.82Å; F415-W424 HydrophobicContact CB-CZ3 4.1Å; F415-M425 CarbonylContact C-O 3.57Å; F415-M425 WeakPolarHBondContact CA-O 3.35Å; F415-Q426 HydrophobicContact CD1-CB 4.06Å; F415-Q426 HydrophobicContact CD1-CG 4.38Å; F415-Q426 HydrophobicContact CE1-CB 3.95Å; F415-Q426 HydrophobicContact CE1-CG 4.12Å
416	R	97.9	Very high	95	Very high	3 Å²	3	45.7 Å²	45.7	1%	0.011	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.6	174	-173.1	-170.1	76	171.9	8.8	109.6	P325 P329 F393 L394 Y395 W424 M425 V427	P325-R416 VanDerWaalsContact O-CZ 3.29Å; P325-R416 PolarHBondContact O-NH1 2.77Å; P325-R416 PolarHBondContact O-NH2 3.24Å; P329-R416 VanDerWaalsContact CD-NH1 3.32Å; F393-R416 HydrophobicContact CB-CG 3.99Å; F393-R416 HydrophobicContact CD1-CG 4.36Å; L394-R416 CarbonylContact O-C 3.57Å; L394-R416 VanDerWaalsContact O-CA 3.3Å; L394-R416 WeakPolarHBondContact O-CA 3.42Å; Y395-R416 HydrophobicContact CD1-CB 4.14Å; Y395-R416 HydrophobicContact CD1-CG 4.26Å; Y395-R416 HydrophobicContact CD2-CG 4.3Å; Y395-R416 HydrophobicContact CE1-CB 4.01Å; Y395-R416 HydrophobicContact CE1-CG 3.97Å; Y395-R416 HydrophobicContact CE2-CG 3.99Å; Y395-R416 HydrophobicContact CG-CG 4.44Å; R416-W424 CarbonylContact O-C 3.54Å; R416-W424 WeakPolarHBondContact O-CA 3.18Å; R416-M425 HydrophobicContact CB-CG 4.13Å; R416-M425 PolarHBondContact N-O 2.93Å; R416-M425 PolarHBondContact NH2-SD 2.95Å; R416-M425 PolarHBondContact O-N 2.79Å; R416-V427 HydrophobicContact CB-CG1 4.19Å
417	F	98.2	Very high	95.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131	171.5	-179.1	-110.7	0	0	0	110.7	L362 L375 A376 L394 P419 N422 W424 L637	L362-F417 HydrophobicContact CD2-CD1 3.82Å; L362-F417 HydrophobicContact CD2-CD2 3.92Å; L362-F417 HydrophobicContact CD2-CE1 3.67Å; L362-F417 HydrophobicContact CD2-CE2 3.78Å; L362-F417 HydrophobicContact CD2-CG 3.93Å; L362-F417 HydrophobicContact CD2-CZ 3.65Å; L375-F417 HydrophobicContact CB-CZ 4.34Å; L375-F417 HydrophobicContact CD1-CE1 4.26Å; L375-F417 HydrophobicContact CD1-CZ 4.22Å; A376-F417 HydrophobicContact CB-CE2 4.34Å; L394-F417 HydrophobicContact CB-CB 4.15Å; L394-F417 PolarHBondContact N-O 2.84Å; L394-F417 PolarHBondContact O-N 2.76Å; F417-P419 HydrophobicContact CD1-CB 4.39Å; F417-P419 HydrophobicContact CE1-CB 3.9Å; F417-N422 WeakPolarHBondContact CE2-OD1 3.41Å; F417-N422 VanDerWaalsContact CZ-OD1 3.23Å; F417-N422 WeakPolarHBondContact CZ-OD1 3.43Å; F417-W424 HydrophobicContact CB-CD2 3.89Å; F417-W424 HydrophobicContact CB-CE3 3.64Å; F417-W424 HydrophobicContact CB-CH2 3.65Å; F417-W424 HydrophobicContact CB-CZ2 3.87Å; F417-W424 HydrophobicContact CB-CZ3 3.53Å; F417-W424 AromaticContact CD2-CD2 3.89Å; F417-W424 HydrophobicContact CD2-CD2 3.89Å; F417-W424 AromaticContact CD2-CE2 3.56Å; F417-W424 HydrophobicContact CD2-CG 4.19Å; F417-W424 AromaticContact CD2-CZ2 3.96Å; F417-W424 HydrophobicContact CD2-CZ2 3.96Å; F417-W424 AromaticContact CD2-NE1 3.62Å; F417-W424 HydrophobicContact CG-CD2 4.36Å; F417-W424 HydrophobicContact CG-CH2 4.35Å; F417-W424 HydrophobicContact CG-CZ2 4.12Å; F417-L637 HydrophobicContact CD1-CD1 4.34Å
418	D	95.9	Very high	96	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.07	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	106.1	171.9	-172	-18.9	0	0	0	109.6	F393 R420 Y421 N422 K423	F393-D418 HydrophobicContact CD1-CB 4.09Å; F393-D418 HydrophobicContact CE1-CB 3.94Å; F393-D418 VanDerWaalsContact CE1-CG 3.44Å; F393-D418 WeakPolarHBondContact CE1-OD2 3.42Å; D418-R420 PolarHBondContact O-N 2.89Å; D418-R420 WeakPolarHBondContact OD1-CB 3.42Å; D418-R420 WeakPolarHBondContact OD1-CG 3.43Å; D418-R420 IonicContact OD1-CZ 2.69Å; D418-R420 PolarHBondContact OD1-N 3.19Å; D418-R420 IonicContact OD1-NE 3.35Å; D418-R420 PolarHBondContact OD1-NE 2.82Å; D418-R420 IonicContact OD1-NH2 3.83Å; D418-R420 IonicContact OD2-CZ 2.91Å; D418-R420 IonicContact OD2-NE 2.63Å; D418-R420 PolarHBondContact OD2-NE 3.28Å; D418-R420 IonicContact OD2-NH2 2.72Å; D418-R420 PolarHBondContact OD2-NH2 2.97Å; D418-Y421 PolarHBondContact O-N 3.17Å; D418-Y421 WeakPolarHBondContact OD2-CD2 3.46Å; D418-N422 PolarHBondContact O-N 2.88Å; D418-K423 PolarHBondContact N-O 2.86Å; D418-K423 PolarHBondContact O-N 3.05Å
419	P	95.1	Very high	96.4	Very high	6 Å²	6	36.7 Å²	36.7	4%	0.039	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.1	-178.2	28.8	-35.6	0	0	0	113.5	I338 N392 F417 V639	I338-P419 HydrophobicContact CD1-CB 3.93Å; I338-P419 HydrophobicContact CD1-CG 3.91Å; N392-P419 WeakPolarHBondContact ND2-CG 3.39Å; N392-P419 WeakPolarHBondContact O-CD 3.45Å; N392-P419 WeakPolarHBondContact O-CG 3.19Å; F417-P419 HydrophobicContact CD1-CB 4.39Å; F417-P419 HydrophobicContact CE1-CB 3.9Å; P419-V639 HydrophobicContact CB-CB 3.86Å; P419-V639 HydrophobicContact CB-CG2 3.81Å
420	R	90.2	Very high	96.5	Very high	33 Å²	33	34.9 Å²	34.9	13%	0.125	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-36	-179.7	-58.8	171.1	-65.3	162.7	9.2	111.7	L289 Y321 I338 D418	L289-R420 VanDerWaalsContact CD2-CD 3.45Å; L289-R420 HydrophobicContact CD2-CG 4.22Å; Y321-R420 PolarHBondContact OH-NH1 2.88Å; I338-R420 HydrophobicContact CD1-CB 4.44Å; I338-R420 HydrophobicContact CD1-CG 3.76Å; I338-R420 HydrophobicContact CG1-CB 4.35Å; I338-R420 HydrophobicContact CG1-CG 3.48Å; I338-R420 VanDerWaalsContact CG1-CG 3.48Å; D418-R420 PolarHBondContact O-N 2.89Å; D418-R420 WeakPolarHBondContact OD1-CB 3.42Å; D418-R420 WeakPolarHBondContact OD1-CG 3.43Å; D418-R420 IonicContact OD1-CZ 2.69Å; D418-R420 PolarHBondContact OD1-N 3.19Å; D418-R420 IonicContact OD1-NE 3.35Å; D418-R420 PolarHBondContact OD1-NE 2.82Å; D418-R420 IonicContact OD1-NH2 3.83Å; D418-R420 IonicContact OD2-CZ 2.91Å; D418-R420 IonicContact OD2-NE 2.63Å; D418-R420 PolarHBondContact OD2-NE 3.28Å; D418-R420 IonicContact OD2-NH2 2.72Å; D418-R420 PolarHBondContact OD2-NH2 2.97Å
421	Y	89.3	Confident	96.6	Very high	67 Å²	67	38.6 Å²	38.6	26%	0.263	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	0.9	-176.5	-52.2	-61.6	0	0	0	112.9	L289 T291 Q322 D418 K423	L289-Y421 WeakPolarHBondContact O-CE1 3.23Å; L289-Y421 PolarHBondContact O-OH 2.67Å; T291-Y421 HydrophobicContact CG2-CE1 4.49Å; Q322-Y421 PolarHBondContact NE2-OH 3.26Å; D418-Y421 PolarHBondContact O-N 3.17Å; D418-Y421 WeakPolarHBondContact OD2-CD2 3.46Å; Y421-K423 VanDerWaalsContact C-N 3.31Å; Y421-K423 WeakPolarHBondContact O-CG 3.4Å; Y421-K423 PolarHBondContact O-N 2.77Å
422	N	93.6	Very high	96.6	Very high	60 Å²	60	40 Å²	40	32%	0.321	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	50.4	-173.9	-168.5	30.4	0	0	0	111.3	A376 F417 D418	A376-N422 WeakPolarHBondContact CB-O 3.46Å; A376-N422 WeakPolarHBondContact CB-OD1 3.46Å; A376-N422 PolarHBondContact N-ND2 2.8Å; A376-N422 PolarHBondContact N-OD1 2.9Å; F417-N422 WeakPolarHBondContact CE2-OD1 3.41Å; F417-N422 VanDerWaalsContact CZ-OD1 3.23Å; F417-N422 WeakPolarHBondContact CZ-OD1 3.43Å; D418-N422 PolarHBondContact O-N 2.88Å
423	K	94.6	Very high	96.6	Very high	141 Å²	141	42.9 Å²	42.9	61%	0.613	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.2	-173.2	-79.6	177.5	-174.4	-178.6	0	112.3	D418 Y421	D418-K423 PolarHBondContact N-O 2.86Å; D418-K423 PolarHBondContact O-N 3.05Å; Y421-K423 VanDerWaalsContact C-N 3.31Å; Y421-K423 WeakPolarHBondContact O-CG 3.4Å; Y421-K423 PolarHBondContact O-N 2.77Å
424	W	97.4	Very high	96.5	Very high	43 Å²	43	41.6 Å²	41.6	16%	0.163	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	150.3	172.9	-66.9	94.5	0	0	0	111.1	L348 L362 A376 P377 M378 L394 V396 F415 R416 F417	L348-W424 HydrophobicContact CD1-CH2 4.4Å; L348-W424 HydrophobicContact CD1-CZ2 4.3Å; L348-W424 HydrophobicContact CD2-CH2 4.24Å; L362-W424 HydrophobicContact CB-CZ2 4.27Å; L362-W424 HydrophobicContact CD1-CZ2 4.47Å; L362-W424 HydrophobicContact CD2-CZ2 3.83Å; L362-W424 HydrophobicContact CG-CZ2 4.41Å; A376-W424 PolarHBondContact O-NE1 2.81Å; P377-W424 PolarHBondContact O-NE1 2.8Å; M378-W424 HydrophobicContact CG-CD2 4.12Å; M378-W424 HydrophobicContact CG-CE3 4.35Å; M378-W424 HydrophobicContact CG-CH2 3.8Å; M378-W424 HydrophobicContact CG-CZ2 3.53Å; M378-W424 HydrophobicContact CG-CZ3 4.19Å; M378-W424 HydrophobicContact SD-CH2 4.14Å; M378-W424 HydrophobicContact SD-CZ2 4.43Å; M378-W424 HydrophobicContact SD-CZ3 4.44Å; L394-W424 HydrophobicContact CD2-CH2 4.22Å; V396-W424 HydrophobicContact CB-CZ3 4.33Å; V396-W424 HydrophobicContact CG2-CH2 3.59Å; V396-W424 HydrophobicContact CG2-CZ3 3.56Å; F415-W424 HydrophobicContact CB-CE3 3.82Å; F415-W424 HydrophobicContact CB-CZ3 4.1Å; R416-W424 CarbonylContact O-C 3.54Å; R416-W424 WeakPolarHBondContact O-CA 3.18Å; F417-W424 HydrophobicContact CB-CD2 3.89Å; F417-W424 HydrophobicContact CB-CE3 3.64Å; F417-W424 HydrophobicContact CB-CH2 3.65Å; F417-W424 HydrophobicContact CB-CZ2 3.87Å; F417-W424 HydrophobicContact CB-CZ3 3.53Å; F417-W424 AromaticContact CD2-CD2 3.89Å; F417-W424 HydrophobicContact CD2-CD2 3.89Å; F417-W424 AromaticContact CD2-CE2 3.56Å; F417-W424 HydrophobicContact CD2-CG 4.19Å; F417-W424 AromaticContact CD2-CZ2 3.96Å; F417-W424 HydrophobicContact CD2-CZ2 3.96Å; F417-W424 AromaticContact CD2-NE1 3.62Å; F417-W424 HydrophobicContact CG-CD2 4.36Å; F417-W424 HydrophobicContact CG-CH2 4.35Å; F417-W424 HydrophobicContact CG-CZ2 4.12Å
425	M	96.6	Very high	96.5	Very high	50 Å²	50	41.6 Å²	41.6	25%	0.246	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	146.9	164.4	67.5	179.1	-64.4	0	0	110.3	P325 Y326 F415 R416 V427	P325-M425 HydrophobicContact CB-CE 4.3Å; Y326-M425 HydrophobicContact CD1-CE 3.8Å; Y326-M425 HydrophobicContact CE1-CE 3.42Å; Y326-M425 VanDerWaalsContact CE1-CE 3.42Å; F415-M425 CarbonylContact C-O 3.57Å; F415-M425 WeakPolarHBondContact CA-O 3.35Å; R416-M425 HydrophobicContact CB-CG 4.13Å; R416-M425 PolarHBondContact N-O 2.93Å; R416-M425 PolarHBondContact NH2-SD 2.95Å; R416-M425 PolarHBondContact O-N 2.79Å; M425-V427 HydrophobicContact CE-CG1 4.46Å; M425-V427 HydrophobicContact CG-CG1 4.48Å
426	Q	97.4	Very high	96.4	Very high	104 Å²	104	41.3 Å²	41.3	49%	0.486	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	137.9	170.6	-169	171.3	-10.8	0	0	109.8	V414 F415	V414-Q426 WeakPolarHBondContact O-CA 3.4Å; V414-Q426 WeakPolarHBondContact O-CG 3.31Å; F415-Q426 HydrophobicContact CD1-CB 4.06Å; F415-Q426 HydrophobicContact CD1-CG 4.38Å; F415-Q426 HydrophobicContact CE1-CB 3.95Å; F415-Q426 HydrophobicContact CE1-CG 4.12Å
427	V	98.2	Very high	96.4	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.042	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	-177	171.9	-59.1	0	0	0	0	108.9	Y326 Y395 V414 R416 M425 S429 Y464 N469	Y326-V427 HydrophobicContact CD1-CG1 4.01Å; Y326-V427 HydrophobicContact CE1-CG1 4.27Å; Y395-V427 HydrophobicContact CD1-CG2 4.49Å; Y395-V427 HydrophobicContact CE1-CG2 4.23Å; V414-V427 HydrophobicContact CB-CG2 3.66Å; V414-V427 HydrophobicContact CG1-CG2 3.36Å; V414-V427 PolarHBondContact O-N 3.26Å; R416-V427 HydrophobicContact CB-CG1 4.19Å; M425-V427 HydrophobicContact CE-CG1 4.46Å; M425-V427 HydrophobicContact CG-CG1 4.48Å; V427-S429 PolarHBondContact O-N 2.85Å; V427-Y464 HydrophobicContact CG2-CE2 4.48Å; V427-N469 WeakPolarHBondContact CB-OD1 3.25Å
428	A	98.5	Very high	96.4	Very high	25 Å²	25	42.7 Å²	42.7	21%	0.207	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-55.3	134.5	-179.3	0	0	0	0	0	112.3	V414 Y464 N469 W471	V414-A428 WeakPolarHBondContact CB-O 3.45Å; V414-A428 WeakPolarHBondContact CG2-O 3.48Å; A428-Y464 HydrophobicContact CB-CE2 4.35Å; A428-N469 WeakPolarHBondContact CB-O 3.44Å; A428-N469 PolarHBondContact N-OD1 2.84Å; A428-W471 PolarHBondContact O-NE1 3.03Å
429	S	98.6	Very high	96.6	Very high	46 Å²	46	42.6 Å²	42.6	32%	0.322	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-70.9	154.2	175.1	-63.3	0	0	0	0	111.1	D412 V427	D412-S429 CarbonylContact O-C 3.43Å; D412-S429 VanDerWaalsContact O-CA 3.3Å; D412-S429 WeakPolarHBondContact O-CA 3.33Å; D412-S429 WeakPolarHBondContact O-CB 3.19Å; V427-S429 PolarHBondContact O-N 2.85Å
430	L	98.7	Very high	96.7	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.042	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-56	153.5	169	-68.8	165.9	0	0	0	111.2	V397 D412 V414 E432 R434 A448 E462 W471	V397-L430 HydrophobicContact CG1-CD1 3.6Å; V397-L430 HydrophobicContact CG1-CD2 3.9Å; V397-L430 HydrophobicContact CG1-CG 3.82Å; D412-L430 HydrophobicContact CB-CB 4.07Å; D412-L430 PolarHBondContact O-N 3.06Å; V414-L430 HydrophobicContact CG2-CG 4.4Å; L430-E432 VanDerWaalsContact CB-O 3.24Å; L430-E432 WeakPolarHBondContact CB-O 3.46Å; L430-R434 HydrophobicContact CD1-CB 4.25Å; L430-R434 HydrophobicContact CD1-CG 4.36Å; L430-A448 HydrophobicContact CD2-CB 3.94Å; L430-E462 HydrophobicContact CD2-CB 4.46Å; L430-W471 HydrophobicContact CD2-CD2 3.76Å; L430-W471 HydrophobicContact CD2-CE3 3.75Å; L430-W471 HydrophobicContact CD2-CG 4.49Å; L430-W471 HydrophobicContact CD2-CH2 3.75Å; L430-W471 HydrophobicContact CD2-CZ2 3.76Å; L430-W471 HydrophobicContact CD2-CZ3 3.75Å; L430-W471 HydrophobicContact CG-CZ2 4.46Å
431	N	98.5	Very high	97.1	Very high	85 Å²	85	42.9 Å²	42.9	46%	0.455	22%	0.215	S	C	.	.	S	Bend	trans	-71.4	-34.2	171.1	-61.3	-79.3	0	0	0	111.3	E462 W471 Y473	N431-E462 VanDerWaalsContact CB-OE2 3.24Å; N431-E462 WeakPolarHBondContact CB-OE2 3.18Å; N431-E462 PolarHBondContact N-OE2 2.66Å; N431-E462 PolarHBondContact ND2-OE2 3.08Å; N431-W471 VanDerWaalsContact ND2-CB 3.31Å; N431-W471 WeakPolarHBondContact ND2-CB 3.23Å; N431-W471 PolarHBondContact ND2-O 3.3Å; N431-Y473 HydrophobicContact CB-CE1 4.44Å; N431-Y473 HydrophobicContact CB-CE2 3.9Å; N431-Y473 VanDerWaalsContact CB-OH 3.24Å; N431-Y473 WeakPolarHBondContact CB-OH 3.37Å
432	E	96.8	Very high	97.5	Very high	55 Å²	55	39.9 Å²	39.9	26%	0.257	20%	0.203	S	C	.	.	S	Bend	trans	-120.7	137.5	173.9	-74.9	171.6	171	0	0	111.2	L430 R434 T460 E462 Y473	L430-E432 VanDerWaalsContact CB-O 3.24Å; L430-E432 WeakPolarHBondContact CB-O 3.46Å; E432-R434 WeakPolarHBondContact O-CG 3.3Å; E432-R434 IonicContact OE2-CZ 2.94Å; E432-R434 IonicContact OE2-NH1 3.1Å; E432-R434 IonicContact OE2-NH2 2.73Å; E432-R434 PolarHBondContact OE2-NH2 3.37Å; E432-T460 WeakPolarHBondContact OE2-CB 3.45Å; E432-T460 PolarHBondContact OE2-OG1 2.94Å; E432-E462 PolarHBondContact N-OE1 3.4Å; E432-Y473 WeakPolarHBondContact CG-OH 3.39Å
433	K	98.1	Very high	97.7	Very high	107 Å²	107	41.7 Å²	41.7	47%	0.465	21%	0.208	S	C	.	.			trans	-62.7	136	171	-64.5	171.2	176.7	-175	0	109.4	A410 D412 N453	A410-K433 HydrophobicContact CB-CB 4Å; A410-K433 WeakPolarHBondContact O-CD 3.38Å; D412-K433 HydrophobicContact CB-CG 3.82Å; D412-K433 VanDerWaalsContact OD2-CE 3.32Å; D412-K433 WeakPolarHBondContact OD2-CE 3.41Å; K433-N453 HydrophobicContact CB-CB 4.47Å; K433-N453 WeakPolarHBondContact O-CB 3.4Å; K433-N453 PolarHBondContact O-ND2 3.11Å
434	R	97.8	Very high	97.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.192	C	C	.	.			trans	-142.1	138.5	-176.3	-64.5	174.2	-168.1	-78	-9.9	112	G399 V411 L430 E432 F437 G450 L458 T460 E462	G399-R434 PolarHBondContact N-O 2.82Å; V411-R434 PolarHBondContact O-N 2.96Å; L430-R434 HydrophobicContact CD1-CB 4.25Å; L430-R434 HydrophobicContact CD1-CG 4.36Å; E432-R434 WeakPolarHBondContact O-CG 3.3Å; E432-R434 IonicContact OE2-CZ 2.94Å; E432-R434 IonicContact OE2-NH1 3.1Å; E432-R434 IonicContact OE2-NH2 2.73Å; E432-R434 PolarHBondContact OE2-NH2 3.37Å; R434-F437 HydrophobicContact CB-CB 4.33Å; R434-F437 HydrophobicContact CB-CD1 3.6Å; R434-F437 HydrophobicContact CB-CE1 4.02Å; R434-F437 HydrophobicContact CB-CG 3.96Å; R434-G450 PolarHBondContact NH1-O 2.93Å; R434-L458 HydrophobicContact CG-CD1 3.74Å; R434-T460 PolarHBondContact NH1-O 3.38Å; R434-T460 VanDerWaalsContact NH1-O 3.11Å; R434-T460 PolarHBondContact NH1-OG1 2.86Å; R434-T460 PolarHBondContact NH2-OG1 3.16Å; R434-E462 IonicContact CZ-OE1 2.96Å; R434-E462 VanDerWaalsContact CZ-OE1 3.24Å; R434-E462 IonicContact NE-OE1 2.8Å; R434-E462 PolarHBondContact NE-OE1 2.8Å; R434-E462 IonicContact NH2-OE1 3.25Å; R434-E462 PolarHBondContact NH2-OE1 3.07Å
435	T	97.5	Very high	97.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-133.3	164.4	162.5	-175.6	0	0	0	0	109.4	Q384 Q400 A410 F437 G451 R452	Q384-T435 WeakPolarHBondContact CB-OG1 3.39Å; Q384-T435 PolarHBondContact O-OG1 3Å; Q400-T435 HydrophobicContact CG-CG2 4.07Å; Q400-T435 PolarHBondContact NE2-OG1 2.83Å; A410-T435 HydrophobicContact CB-CG2 4.19Å; T435-F437 PolarHBondContact O-N 3.33Å; T435-F437 VanDerWaalsContact O-N 3.15Å; T435-G451 CarbonylContact O-C 3.5Å; T435-G451 VanDerWaalsContact O-CA 3.27Å; T435-G451 WeakPolarHBondContact O-CA 3.27Å; T435-R452 HydrophobicContact CG2-CG 3.93Å; T435-R452 VanDerWaalsContact CG2-O 3.29Å; T435-R452 WeakPolarHBondContact CG2-O 3.39Å; T435-R452 PolarHBondContact N-O 3.01Å; T435-R452 PolarHBondContact O-N 2.74Å
436	F	96.7	Very high	98	Very high	15 Å²	15	35.3 Å²	35.3	7%	0.066	19%	0.186	C	C	.	.	S	Bend	trans	53.5	32.6	-178.3	-62	-83.5	0	0	0	113.9	Q384 R452 Y482 G483 L530	Q384-F436 HydrophobicContact CG-CD1 4.16Å; Q384-F436 HydrophobicContact CG-CE1 3.96Å; Q384-F436 HydrophobicContact CG-CZ 4.31Å; Q384-F436 PolarHBondContact O-N 3.47Å; F436-R452 HydrophobicContact CB-CG 4.45Å; F436-R452 HydrophobicContact CD2-CG 3.92Å; F436-Y482 HydrophobicContact CB-CD2 4.1Å; F436-Y482 HydrophobicContact CG-CD2 4.31Å; F436-Y482 WeakPolarHBondContact O-CA 3.45Å; F436-G483 PolarHBondContact O-N 3.14Å; F436-L530 HydrophobicContact CD1-CD2 3.59Å; F436-L530 HydrophobicContact CE1-CD2 3.73Å
437	F	97.9	Very high	98	Very high	9 Å²	9	31.1 Å²	31.1	4%	0.039	17%	0.166	C	C	.	.			trans	-105.2	163.8	-179.6	72.1	-81	0	0	0	109.8	V397 R434 T435 L439 A448 V449 G450	V397-F437 HydrophobicContact CB-CE2 4.45Å; V397-F437 HydrophobicContact CB-CZ 3.94Å; V397-F437 HydrophobicContact CG1-CE2 4.07Å; V397-F437 HydrophobicContact CG1-CZ 3.7Å; V397-F437 WeakPolarHBondContact O-CE1 3.34Å; V397-F437 WeakPolarHBondContact O-CZ 3.41Å; R434-F437 HydrophobicContact CB-CB 4.33Å; R434-F437 HydrophobicContact CB-CD1 3.6Å; R434-F437 HydrophobicContact CB-CE1 4.02Å; R434-F437 HydrophobicContact CB-CG 3.96Å; T435-F437 PolarHBondContact O-N 3.33Å; T435-F437 VanDerWaalsContact O-N 3.15Å; F437-L439 HydrophobicContact CE2-CB 3.93Å; F437-L439 HydrophobicContact CE2-CD1 4.14Å; F437-A448 HydrophobicContact CD2-CB 3.91Å; F437-A448 HydrophobicContact CE2-CB 3.76Å; F437-V449 WeakPolarHBondContact CB-O 3.23Å; F437-G450 WeakPolarHBondContact CB-O 3.39Å
438	H	97.9	Very high	98.1	Very high	23 Å²	23	30.8 Å²	30.8	11%	0.106	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	138.3	170.9	178.1	66.2	0	0	0	111.3	S440 A448 V449 H484 G486 I495	H438-S440 PolarHBondContact CE1-OG 2.94Å; H438-S440 VanDerWaalsContact CE1-OG 3.26Å; H438-S440 WeakPolarHBondContact NE2-CB 3.4Å; H438-S440 PolarHBondContact NE2-OG 3.04Å; H438-A448 WeakPolarHBondContact O-CA 3.17Å; H438-V449 HydrophobicContact CB-CB 4.39Å; H438-V449 PolarHBondContact N-O 3.27Å; H438-V449 PolarHBondContact O-N 2.99Å; H438-H484 WeakPolarHBondContact CB-NE2 3.33Å; H438-H484 PolarHBondContact N-NE2 3.19Å; H438-G486 WeakPolarHBondContact CE1-CA 3.42Å; H438-G486 PolarHBondContact CE1-O 2.84Å; H438-G486 PolarHBondContact ND1-N 2.82Å; H438-I495 HydrophobicContact CB-CD1 3.96Å; H438-I495 WeakPolarHBondContact CD2-CD1 3.15Å
439	L	98.6	Very high	98.1	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.052	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.6	171.3	-172	76.4	0	0	0	109.5	A388 V397 F437 L446 Y447 A448 W471	A388-L439 HydrophobicContact CB-CD2 3.74Å; A388-L439 HydrophobicContact CB-CG 3.97Å; V397-L439 HydrophobicContact CB-CD1 4.22Å; V397-L439 HydrophobicContact CB-CD2 3.83Å; V397-L439 HydrophobicContact CG1-CD1 4.34Å; V397-L439 HydrophobicContact CG2-CD1 3.94Å; V397-L439 HydrophobicContact CG2-CD2 3.45Å; V397-L439 VanDerWaalsContact CG2-CD2 3.45Å; V397-L439 HydrophobicContact CG2-CG 4.39Å; F437-L439 HydrophobicContact CE2-CB 3.93Å; F437-L439 HydrophobicContact CE2-CD1 4.14Å; L439-L446 HydrophobicContact CD1-CB 4.2Å; L439-Y447 WeakPolarHBondContact CA-O 3.35Å; L439-A448 HydrophobicContact CD1-CB 4.07Å; L439-W471 HydrophobicContact CD1-CH2 4.19Å
440	S	97.8	Very high	98.1	Very high	13 Å²	13	27.4 Å²	27.4	9%	0.091	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	146	172.2	-92.3	0	0	0	0	112.1	H438 L446 Y447	H438-S440 PolarHBondContact CE1-OG 2.94Å; H438-S440 VanDerWaalsContact CE1-OG 3.26Å; H438-S440 WeakPolarHBondContact NE2-CB 3.4Å; H438-S440 PolarHBondContact NE2-OG 3.04Å; S440-L446 CarbonylContact O-C 3.52Å; S440-L446 WeakPolarHBondContact O-CA 3.46Å; S440-Y447 PolarHBondContact N-O 3.27Å; S440-Y447 VanDerWaalsContact N-O 3.14Å; S440-Y447 PolarHBondContact O-N 2.83Å
441	A	98.4	Very high	98	Very high	33 Å²	33	27 Å²	27	27%	0.273	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	123.8	163.7	0	0	0	0	0	109.4	A388 V389 I390 Y445 L446	A388-A441 HydrophobicContact CB-CB 4.23Å; V389-A441 WeakPolarHBondContact O-CB 3.41Å; I390-A441 HydrophobicContact CD1-CB 4.41Å; I390-A441 HydrophobicContact CG1-CB 3.68Å; A441-Y445 CarbonylContact C-O 3.5Å; A441-Y445 VanDerWaalsContact CA-O 3.31Å; A441-Y445 WeakPolarHBondContact CA-O 2.93Å; A441-L446 HydrophobicContact CB-CD2 4.1Å
442	L	98.4	Very high	97.9	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	123.9	-179.1	174.4	62.4	0	0	0	109.9	G444 Y445 Y447 V488 M493 P513	L442-G444 PolarHBondContact O-N 3.25Å; L442-G444 VanDerWaalsContact O-N 3.08Å; L442-Y445 PolarHBondContact N-O 2.82Å; L442-Y445 PolarHBondContact O-N 2.81Å; L442-Y447 HydrophobicContact CB-CD2 3.78Å; L442-Y447 HydrophobicContact CB-CE2 3.75Å; L442-Y447 HydrophobicContact CD2-CD2 4.33Å; L442-Y447 HydrophobicContact CD2-CE2 4.1Å; L442-Y447 HydrophobicContact CG-CE2 4.14Å; L442-V488 HydrophobicContact CB-CG2 4.14Å; L442-V488 HydrophobicContact CD1-CG1 3.55Å; L442-V488 HydrophobicContact CD1-CG2 4.27Å; L442-M493 HydrophobicContact CD2-CB 4.08Å; L442-P513 HydrophobicContact CD2-CB 4.22Å; L442-P513 HydrophobicContact CD2-CG 3.64Å; L442-P513 HydrophobicContact CG-CG 4.18Å
443	K	97	Very high	97.9	Very high	97 Å²	97	23.1 Å²	23.1	42%	0.422	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	31.9	179.6	-65.8	176.5	172.2	165.8	0	114.2	Y445 G491 P513 D514	K443-Y445 VanDerWaalsContact O-CD2 3.24Å; K443-Y445 WeakPolarHBondContact O-CD2 3.4Å; K443-Y445 WeakPolarHBondContact O-CE2 3.29Å; K443-G491 WeakPolarHBondContact CE-O 3.37Å; K443-G491 PolarHBondContact NZ-O 3.5Å; K443-P513 HydrophobicContact CD-CG 3.95Å; K443-D514 IonicContact NZ-OD1 2.74Å; K443-D514 PolarHBondContact NZ-OD1 2.89Å; K443-D514 IonicContact NZ-OD2 2.82Å; K443-D514 PolarHBondContact NZ-OD2 2.8Å
444	G	97.2	Very high	97.8	Very high	26 Å²	26	21.8 Å²	21.8	27%	0.268	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	7.6	-179.7	0	0	0	0	0	115.3	V330 L442 P466	V330-G444 WeakPolarHBondContact CG1-O 3.3Å; L442-G444 PolarHBondContact O-N 3.25Å; L442-G444 VanDerWaalsContact O-N 3.08Å; G444-P466 WeakPolarHBondContact O-CD 3.47Å; G444-P466 WeakPolarHBondContact O-CG 3.29Å
445	Y	98.7	Very high	97.6	Very high	75 Å²	75	26.6 Å²	26.6	29%	0.294	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	163.6	174.6	-61.1	-98.6	0	0	0	110.1	A441 L442 K443 Y464 N465	A441-Y445 CarbonylContact C-O 3.5Å; A441-Y445 VanDerWaalsContact CA-O 3.31Å; A441-Y445 WeakPolarHBondContact CA-O 2.93Å; L442-Y445 PolarHBondContact N-O 2.82Å; L442-Y445 PolarHBondContact O-N 2.81Å; K443-Y445 VanDerWaalsContact O-CD2 3.24Å; K443-Y445 WeakPolarHBondContact O-CD2 3.4Å; K443-Y445 WeakPolarHBondContact O-CE2 3.29Å; Y445-Y464 WeakPolarHBondContact CA-O 3.44Å; Y445-Y464 WeakPolarHBondContact CB-O 3.48Å; Y445-Y464 WeakPolarHBondContact CD1-O 3.32Å; Y445-N465 HydrophobicContact CD1-CB 3.95Å; Y445-N465 HydrophobicContact CE1-CB 3.77Å
446	L	98.9	Very high	97.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	138.5	168.4	-54.5	171.4	0	0	0	110	A388 I390 Y395 L439 S440 A441 C463 Y464 W471	A388-L446 HydrophobicContact CB-CD2 3.56Å; I390-L446 HydrophobicContact CD1-CD2 3.41Å; I390-L446 VanDerWaalsContact CD1-CD2 3.41Å; I390-L446 HydrophobicContact CD1-CG 3.66Å; I390-L446 HydrophobicContact CG1-CD2 3.82Å; Y395-L446 HydrophobicContact CD1-CD1 3.5Å; Y395-L446 HydrophobicContact CD2-CD1 4.11Å; Y395-L446 HydrophobicContact CE1-CD1 3.97Å; Y395-L446 HydrophobicContact CG-CD1 3.55Å; L439-L446 HydrophobicContact CD1-CB 4.2Å; S440-L446 CarbonylContact O-C 3.52Å; S440-L446 WeakPolarHBondContact O-CA 3.46Å; A441-L446 HydrophobicContact CB-CD2 4.1Å; L446-C463 CarbonylContact O-C 3.24Å; L446-C463 VanDerWaalsContact O-CA 3.25Å; L446-C463 WeakPolarHBondContact O-CA 3.2Å; L446-Y464 HydrophobicContact CD1-CD1 3.83Å; L446-Y464 HydrophobicContact CD1-CG 4.39Å; L446-Y464 HydrophobicContact CG-CD1 4.15Å; L446-Y464 PolarHBondContact N-O 2.89Å; L446-Y464 PolarHBondContact O-N 3.07Å; L446-W471 HydrophobicContact CB-CH2 4.04Å
447	Y	98.8	Very high	97.4	Very high	16 Å²	16	29.2 Å²	29.2	6%	0.063	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.1	175.5	-67.8	-96.8	0	0	0	109.8	L439 S440 L442 E462 C463 V474 M493 F511 P513	L439-Y447 WeakPolarHBondContact CA-O 3.35Å; S440-Y447 PolarHBondContact N-O 3.27Å; S440-Y447 VanDerWaalsContact N-O 3.14Å; S440-Y447 PolarHBondContact O-N 2.83Å; L442-Y447 HydrophobicContact CB-CD2 3.78Å; L442-Y447 HydrophobicContact CB-CE2 3.75Å; L442-Y447 HydrophobicContact CD2-CD2 4.33Å; L442-Y447 HydrophobicContact CD2-CE2 4.1Å; L442-Y447 HydrophobicContact CG-CE2 4.14Å; Y447-E462 CarbonylContact C-O 3.24Å; Y447-E462 VanDerWaalsContact CA-O 3.29Å; Y447-E462 WeakPolarHBondContact CA-O 3.42Å; Y447-C463 HydrophobicContact CD1-CB 4.02Å; Y447-C463 HydrophobicContact CE1-CB 3.74Å; Y447-C463 VanDerWaalsContact CZ-SG 3.59Å; Y447-V474 HydrophobicContact CD1-CG2 4.3Å; Y447-V474 HydrophobicContact CE1-CG2 4.37Å; Y447-M493 HydrophobicContact CG-CE 4.43Å; Y447-F511 AromaticContact CD1-CE1 3.89Å; Y447-F511 HydrophobicContact CD1-CE1 3.89Å; Y447-F511 AromaticContact CE1-CE1 3.63Å; Y447-F511 HydrophobicContact CE1-CE1 3.63Å; Y447-F511 HydrophobicContact CE1-CZ 4.29Å; Y447-P513 HydrophobicContact CE1-CB 4.47Å; Y447-P513 WeakPolarHBondContact OH-CB 3.3Å
448	A	98.8	Very high	97.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.7	173.9	0	0	0	0	0	109	L430 F437 H438 L439 V461 E462 W471	L430-A448 HydrophobicContact CD2-CB 3.94Å; F437-A448 HydrophobicContact CD2-CB 3.91Å; F437-A448 HydrophobicContact CE2-CB 3.76Å; H438-A448 WeakPolarHBondContact O-CA 3.17Å; L439-A448 HydrophobicContact CD1-CB 4.07Å; A448-V461 WeakPolarHBondContact O-CA 3.28Å; A448-E462 PolarHBondContact N-O 2.76Å; A448-E462 PolarHBondContact O-N 3.05Å; A448-W471 HydrophobicContact CB-CH2 4.17Å; A448-W471 HydrophobicContact CB-CZ3 3.88Å
449	V	98.7	Very high	97.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.8	-170.7	-177.8	0	0	0	0	110.7	F437 H438 V461 M477 H484 M493 I495 W518	F437-V449 WeakPolarHBondContact CB-O 3.23Å; H438-V449 HydrophobicContact CB-CB 4.39Å; H438-V449 PolarHBondContact N-O 3.27Å; H438-V449 PolarHBondContact O-N 2.99Å; V449-V461 HydrophobicContact CG1-CG2 4.12Å; V449-V461 HydrophobicContact CG2-CG1 3.94Å; V449-V461 HydrophobicContact CG2-CG2 4.5Å; V449-M477 HydrophobicContact CG1-CE 4.02Å; V449-M477 HydrophobicContact CG1-CG 4.28Å; V449-M477 HydrophobicContact CG1-SD 3.6Å; V449-M477 VanDerWaalsContact CG1-SD 3.6Å; V449-H484 PolarHBondContact O-CE1 2.81Å; V449-H484 PolarHBondContact O-NE2 3.38Å; V449-M493 HydrophobicContact CG2-CE 3.35Å; V449-M493 HydrophobicContact CG2-SD 3.81Å; V449-I495 HydrophobicContact CB-CD1 4.4Å; V449-I495 HydrophobicContact CG1-CD1 4.31Å; V449-I495 HydrophobicContact CG1-CG1 4.19Å; V449-I495 HydrophobicContact CG2-CD1 4.3Å; V449-W518 HydrophobicContact CG1-CH2 4Å; V449-W518 HydrophobicContact CG1-CZ2 4.2Å; V449-W518 HydrophobicContact CG2-CH2 4.41Å
450	G	98.1	Very high	97.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	20%	0.196	C	C	.	.			trans	61.1	-133.5	171.1	0	0	0	0	0	114.3	R434 F437 L458 T460	R434-G450 PolarHBondContact NH1-O 2.93Å; F437-G450 WeakPolarHBondContact CB-O 3.39Å; G450-L458 WeakPolarHBondContact CA-O 3.38Å; G450-T460 PolarHBondContact N-O 2.89Å
451	G	97.4	Very high	97.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.191	C	C	.	.			trans	94.1	-156.9	-175.3	0	0	0	0	0	112.9	T435 L458 H481	T435-G451 CarbonylContact O-C 3.5Å; T435-G451 VanDerWaalsContact O-CA 3.27Å; T435-G451 WeakPolarHBondContact O-CA 3.27Å; G451-L458 PolarHBondContact O-N 3.35Å; G451-H481 PolarHBondContact N-O 3.24Å
452	R	96.3	Very high	97.4	Very high	36 Å²	36	28.7 Å²	28.7	14%	0.136	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	159.6	176.6	63	-174.2	-68.4	154.8	3	111.8	K406 T435 F436 G456 Y482	K406-R452 VanDerWaalsContact C-NE 3.33Å; K406-R452 VanDerWaalsContact O-CZ 3.28Å; K406-R452 PolarHBondContact O-NE 3.06Å; K406-R452 PolarHBondContact O-NH2 3.4Å; T435-R452 HydrophobicContact CG2-CG 3.93Å; T435-R452 VanDerWaalsContact CG2-O 3.29Å; T435-R452 WeakPolarHBondContact CG2-O 3.39Å; T435-R452 PolarHBondContact N-O 3.01Å; T435-R452 PolarHBondContact O-N 2.74Å; F436-R452 HydrophobicContact CB-CG 4.45Å; F436-R452 HydrophobicContact CD2-CG 3.92Å; R452-G456 CarbonylContact C-O 3.6Å; R452-G456 WeakPolarHBondContact CA-O 3.32Å; R452-G456 WeakPolarHBondContact CB-O 3.45Å; R452-Y482 HydrophobicContact CB-CG 4.47Å; R452-Y482 HydrophobicContact CG-CD2 4.49Å; R452-Y482 HydrophobicContact CG-CG 4.3Å; R452-Y482 PolarHBondContact NH1-OH 3.5Å
453	N	96.8	Very high	97.5	Very high	22 Å²	22	28.9 Å²	28.9	12%	0.118	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	-164.6	172.5	65.7	25.6	0	0	0	111	G407 A410 K433 A455 G456 L458	G407-N453 CarbonylContact O-C 3.19Å; G407-N453 VanDerWaalsContact O-CA 3.26Å; G407-N453 WeakPolarHBondContact O-CA 3.49Å; A410-N453 HydrophobicContact CB-CB 3.96Å; K433-N453 HydrophobicContact CB-CB 4.47Å; K433-N453 WeakPolarHBondContact O-CB 3.4Å; K433-N453 PolarHBondContact O-ND2 3.11Å; N453-A455 PolarHBondContact O-N 3.4Å; N453-A455 WeakPolarHBondContact OD1-CA 3.46Å; N453-A455 WeakPolarHBondContact OD1-CB 3.48Å; N453-A455 PolarHBondContact OD1-N 2.8Å; N453-G456 PolarHBondContact N-O 3.29Å; N453-G456 PolarHBondContact O-N 2.94Å; N453-G456 VanDerWaalsContact O-N 3.15Å; N453-G456 PolarHBondContact OD1-N 3.31Å; N453-L458 HydrophobicContact CB-CD1 4.48Å
454	A	95.5	Very high	97.5	Very high	79 Å²	79	24.3 Å²	24.3	65%	0.653	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.2	-179.7	0	0	0	0	0	114.1	G407	G407-A454 PolarHBondContact O-N 3.28Å
455	A	94.5	Very high	97.6	Very high	100 Å²	100	24.6 Å²	24.6	83%	0.826	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-19.4	178.2	0	0	0	0	0	113.2	N453	N453-A455 PolarHBondContact O-N 3.4Å; N453-A455 WeakPolarHBondContact OD1-CA 3.46Å; N453-A455 WeakPolarHBondContact OD1-CB 3.48Å; N453-A455 PolarHBondContact OD1-N 2.8Å
456	G	94.6	Very high	97.6	Very high	26 Å²	26	21.1 Å²	21.1	27%	0.268	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	135.4	-156.8	179.3	0	0	0	0	0	113.3	R452 N453	R452-G456 CarbonylContact C-O 3.6Å; R452-G456 WeakPolarHBondContact CA-O 3.32Å; R452-G456 WeakPolarHBondContact CB-O 3.45Å; N453-G456 PolarHBondContact N-O 3.29Å; N453-G456 PolarHBondContact O-N 2.94Å; N453-G456 VanDerWaalsContact O-N 3.15Å; N453-G456 PolarHBondContact OD1-N 3.31Å
457	E	95.9	Very high	97.5	Very high	45 Å²	45	27.7 Å²	27.7	21%	0.21	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	144.5	177.9	-51.8	172.8	167.7	0	0	110.3	P480 Y482 H501	E457-P480 HydrophobicContact CB-CB 3.63Å; E457-P480 HydrophobicContact CB-CG 4.05Å; E457-Y482 HydrophobicContact CG-CD1 3.87Å; E457-Y482 HydrophobicContact CG-CE1 4.14Å; E457-Y482 WeakPolarHBondContact OE1-CE1 3.28Å; E457-H501 PolarHBondContact OE1-N 3.43Å; E457-H501 IonicContact OE2-CE1 3.7Å; E457-H501 PolarHBondContact OE2-N 3.4Å; E457-H501 VanDerWaalsContact OE2-N 3.09Å; E457-H501 IonicContact OE2-ND1 2.69Å; E457-H501 PolarHBondContact OE2-ND1 3.48Å
458	L	97.3	Very high	97.4	Very high	15 Å²	15	30.4 Å²	30.4	8%	0.079	19%	0.185	C	C	.	.			trans	-115.6	130.6	-172.3	-60.1	170.1	0	0	0	111.1	R434 G450 G451 N453 H481	R434-L458 HydrophobicContact CG-CD1 3.74Å; G450-L458 WeakPolarHBondContact CA-O 3.38Å; G451-L458 PolarHBondContact O-N 3.35Å; N453-L458 HydrophobicContact CB-CD1 4.48Å; L458-H481 PolarHBondContact O-N 3.38Å
459	P	97.4	Very high	97.4	Very high	35 Å²	35	32 Å²	32	23%	0.227	19%	0.194	C	C	.	.			trans	-93	-12.2	169.2	35.5	-32.7	0	0	0	112.6	K476 M477 P480	P459-K476 WeakPolarHBondContact O-CA 3.26Å; P459-K476 WeakPolarHBondContact O-CB 3.3Å; P459-M477 PolarHBondContact O-N 3.14Å; P459-P480 HydrophobicContact CB-CB 4.3Å
460	T	98.5	Very high	97.4	Very high	26 Å²	26	37.3 Å²	37.3	16%	0.16	22%	0.219	C	C	.	.			trans	-67.7	147.6	-172.3	42.1	0	0	0	0	112.1	E432 R434 G450 Y473	E432-T460 WeakPolarHBondContact OE2-CB 3.45Å; E432-T460 PolarHBondContact OE2-OG1 2.94Å; R434-T460 PolarHBondContact NH1-O 3.38Å; R434-T460 VanDerWaalsContact NH1-O 3.11Å; R434-T460 PolarHBondContact NH1-OG1 2.86Å; R434-T460 PolarHBondContact NH2-OG1 3.16Å; G450-T460 PolarHBondContact N-O 2.89Å; T460-Y473 HydrophobicContact CG2-CE1 4.32Å
461	V	98.7	Very high	97.4	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.9	177.4	-174.3	0	0	0	0	108.2	A448 V449 Y473 V474 A475 W518	A448-V461 WeakPolarHBondContact O-CA 3.28Å; V449-V461 HydrophobicContact CG1-CG2 4.12Å; V449-V461 HydrophobicContact CG2-CG1 3.94Å; V449-V461 HydrophobicContact CG2-CG2 4.5Å; V461-Y473 WeakPolarHBondContact O-CA 3.23Å; V461-V474 HydrophobicContact CB-CG2 3.72Å; V461-V474 HydrophobicContact CG1-CG2 3.45Å; V461-V474 VanDerWaalsContact CG1-CG2 3.45Å; V461-V474 PolarHBondContact O-N 2.81Å; V461-A475 WeakPolarHBondContact CG2-O 3.45Å; V461-W518 HydrophobicContact CG2-CZ2 3.92Å
462	E	98.7	Very high	97.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	139.8	179.9	-60.8	-178	-120.2	0	0	110.7	L430 N431 E432 R434 Y447 A448 W471 T472 Y473	L430-E462 HydrophobicContact CD2-CB 4.46Å; N431-E462 VanDerWaalsContact CB-OE2 3.24Å; N431-E462 WeakPolarHBondContact CB-OE2 3.18Å; N431-E462 PolarHBondContact N-OE2 2.66Å; N431-E462 PolarHBondContact ND2-OE2 3.08Å; E432-E462 PolarHBondContact N-OE1 3.4Å; R434-E462 IonicContact CZ-OE1 2.96Å; R434-E462 VanDerWaalsContact CZ-OE1 3.24Å; R434-E462 IonicContact NE-OE1 2.8Å; R434-E462 PolarHBondContact NE-OE1 2.8Å; R434-E462 IonicContact NH2-OE1 3.25Å; R434-E462 PolarHBondContact NH2-OE1 3.07Å; Y447-E462 CarbonylContact C-O 3.24Å; Y447-E462 VanDerWaalsContact CA-O 3.29Å; Y447-E462 WeakPolarHBondContact CA-O 3.42Å; A448-E462 PolarHBondContact N-O 2.76Å; A448-E462 PolarHBondContact O-N 3.05Å; E462-W471 HydrophobicContact CB-CE3 3.63Å; E462-W471 HydrophobicContact CB-CZ3 4.13Å; E462-T472 CarbonylContact C-O 3.58Å; E462-T472 VanDerWaalsContact CA-O 3.32Å; E462-T472 WeakPolarHBondContact CA-O 3.23Å; E462-Y473 HydrophobicContact CG-CD1 3.79Å; E462-Y473 HydrophobicContact CG-CE1 3.75Å
463	C	98.8	Very high	97.6	Very high	9 Å²	9	45.2 Å²	45.2	6%	0.061	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.6	178.3	179.5	0	0	0	0	110.3	L446 Y447 W471 T472 V474	L446-C463 CarbonylContact O-C 3.24Å; L446-C463 VanDerWaalsContact O-CA 3.25Å; L446-C463 WeakPolarHBondContact O-CA 3.2Å; Y447-C463 HydrophobicContact CD1-CB 4.02Å; Y447-C463 HydrophobicContact CE1-CB 3.74Å; Y447-C463 VanDerWaalsContact CZ-SG 3.59Å; C463-W471 CarbonylContact O-C 3.56Å; C463-W471 WeakPolarHBondContact O-CA 3.4Å; C463-T472 PolarHBondContact N-O 3.14Å; C463-T472 PolarHBondContact O-N 2.85Å; C463-T472 PolarHBondContact O-OG1 3.27Å; C463-V474 HydrophobicContact CB-CG1 3.65Å
464	Y	98.9	Very high	97.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	128.2	173.3	179.4	-111.2	0	0	0	110.9	Y395 V427 A428 Y445 L446 P466 N469 E470 W471	Y395-Y464 HydrophobicContact CE1-CD1 4.45Å; Y395-Y464 AromaticContact CE1-CE1 3.88Å; Y395-Y464 HydrophobicContact CE1-CE1 3.88Å; V427-Y464 HydrophobicContact CG2-CE2 4.48Å; A428-Y464 HydrophobicContact CB-CE2 4.35Å; Y445-Y464 WeakPolarHBondContact CA-O 3.44Å; Y445-Y464 WeakPolarHBondContact CB-O 3.48Å; Y445-Y464 WeakPolarHBondContact CD1-O 3.32Å; L446-Y464 HydrophobicContact CD1-CD1 3.83Å; L446-Y464 HydrophobicContact CD1-CG 4.39Å; L446-Y464 HydrophobicContact CG-CD1 4.15Å; L446-Y464 PolarHBondContact N-O 2.89Å; L446-Y464 PolarHBondContact O-N 3.07Å; Y464-P466 HydrophobicContact CD1-CG 4Å; Y464-P466 HydrophobicContact CE1-CB 4.07Å; Y464-P466 HydrophobicContact CE1-CG 3.79Å; Y464-P466 WeakPolarHBondContact O-CD 3.37Å; Y464-N469 PolarHBondContact OH-OD1 3.28Å; Y464-E470 WeakPolarHBondContact CA-O 3.35Å; Y464-W471 AromaticContact CD2-CD1 3.76Å; Y464-W471 HydrophobicContact CD2-CD2 4.11Å; Y464-W471 AromaticContact CD2-CE2 3.75Å; Y464-W471 HydrophobicContact CD2-CG 4.14Å; Y464-W471 HydrophobicContact CD2-CZ2 4.32Å; Y464-W471 AromaticContact CD2-NE1 3.49Å; Y464-W471 HydrophobicContact CG-CD2 4.3Å; Y464-W471 AromaticContact CG-CE2 3.94Å; Y464-W471 HydrophobicContact CG-CZ2 4.1Å; Y464-W471 VanDerWaalsContact N-CE3 3.33Å
465	N	98.3	Very high	97.8	Very high	33 Å²	33	43.1 Å²	43.1	18%	0.176	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	109.7	172.3	-175.4	-7.7	0	0	0	110.8	Y445 R467 T468 N469 E470	Y445-N465 HydrophobicContact CD1-CB 3.95Å; Y445-N465 HydrophobicContact CE1-CB 3.77Å; N465-R467 PolarHBondContact O-N 2.96Å; N465-R467 WeakPolarHBondContact OD1-CA 3.25Å; N465-R467 WeakPolarHBondContact OD1-CB 3.35Å; N465-R467 WeakPolarHBondContact OD1-CG 3.45Å; N465-R467 PolarHBondContact OD1-N 2.85Å; N465-T468 PolarHBondContact O-N 2.89Å; N465-N469 WeakPolarHBondContact O-CA 3.32Å; N465-N469 PolarHBondContact O-N 2.77Å; N465-E470 PolarHBondContact N-O 3.42Å
466	P	98	Very high	98	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.7	175.9	-23.4	33.4	0	0	0	114.5	Y326 V330 I390 G444 Y464	Y326-P466 CarbonylContact C-O 3.52Å; Y326-P466 VanDerWaalsContact C-O 3.24Å; Y326-P466 WeakPolarHBondContact CB-O 3.32Å; Y326-P466 WeakPolarHBondContact O-CB 3.43Å; V330-P466 HydrophobicContact CG1-CB 4.27Å; V330-P466 HydrophobicContact CG1-CG 4.08Å; V330-P466 HydrophobicContact CG2-CB 4.41Å; I390-P466 HydrophobicContact CD1-CG 4.27Å; G444-P466 WeakPolarHBondContact O-CD 3.47Å; G444-P466 WeakPolarHBondContact O-CG 3.29Å; Y464-P466 HydrophobicContact CD1-CG 4Å; Y464-P466 HydrophobicContact CE1-CB 4.07Å; Y464-P466 HydrophobicContact CE1-CG 3.79Å; Y464-P466 WeakPolarHBondContact O-CD 3.37Å
467	R	96.6	Very high	98.1	Very high	138 Å²	138	44.3 Å²	44.3	52%	0.521	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-38.7	178.7	-55.1	-175.9	-179.1	-85.4	-4	113.5	M327 V330 N465	M327-R467 HydrophobicContact CE-CB 4.48Å; M327-R467 HydrophobicContact CE-CG 4.1Å; M327-R467 VanDerWaalsContact CE-NH1 3.35Å; M327-R467 HydrophobicContact CG-CB 4.39Å; M327-R467 HydrophobicContact CG-CG 4.47Å; M327-R467 HydrophobicContact SD-CB 4.31Å; V330-R467 HydrophobicContact CG2-CG 4.34Å; N465-R467 PolarHBondContact O-N 2.96Å; N465-R467 WeakPolarHBondContact OD1-CA 3.25Å; N465-R467 WeakPolarHBondContact OD1-CB 3.35Å; N465-R467 WeakPolarHBondContact OD1-CG 3.45Å; N465-R467 PolarHBondContact OD1-N 2.85Å
468	T	97.4	Very high	97.9	Very high	74 Å²	74	46.8 Å²	46.8	45%	0.454	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-12.7	179.3	59.8	0	0	0	0	112.2	N465 E470	N465-T468 PolarHBondContact O-N 2.89Å; T468-E470 VanDerWaalsContact C-N 3.34Å; T468-E470 WeakPolarHBondContact CB-OE2 3.26Å; T468-E470 PolarHBondContact OG1-OE2 3.4Å
469	N	98.3	Very high	97.8	Very high	32 Å²	32	50.5 Å²	50.5	17%	0.171	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	50.6	-171.3	-179.3	46.2	0	0	0	110.6	Y326 V427 A428 Y464 N465	Y326-N469 HydrophobicContact CD1-CB 4.23Å; Y326-N469 HydrophobicContact CD2-CB 3.9Å; Y326-N469 HydrophobicContact CE2-CB 4.39Å; Y326-N469 HydrophobicContact CG-CB 3.82Å; V427-N469 WeakPolarHBondContact CB-OD1 3.25Å; A428-N469 WeakPolarHBondContact CB-O 3.44Å; A428-N469 PolarHBondContact N-OD1 2.84Å; Y464-N469 PolarHBondContact OH-OD1 3.28Å; N465-N469 WeakPolarHBondContact O-CA 3.32Å; N465-N469 PolarHBondContact O-N 2.77Å
470	E	98.5	Very high	97.6	Very high	112 Å²	112	49.8 Å²	49.8	52%	0.523	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	150.3	-177.1	-68.1	171.1	156.7	0	0	110.9	Y464 N465 T468	Y464-E470 WeakPolarHBondContact CA-O 3.35Å; N465-E470 PolarHBondContact N-O 3.42Å; T468-E470 VanDerWaalsContact C-N 3.34Å; T468-E470 WeakPolarHBondContact CB-OE2 3.26Å; T468-E470 PolarHBondContact OG1-OE2 3.4Å
471	W	98.8	Very high	97.3	Very high	14 Å²	14	49.5 Å²	49.5	5%	0.053	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.2	171.5	-71.6	91.2	0	0	0	110.2	V397 V414 A428 L430 N431 L439 L446 A448 E462 C463 Y464	V397-W471 HydrophobicContact CG1-CH2 4.13Å; V397-W471 HydrophobicContact CG1-CZ2 4.05Å; V397-W471 HydrophobicContact CG2-CH2 4.33Å; V397-W471 HydrophobicContact CG2-CZ2 4.14Å; V414-W471 HydrophobicContact CG2-CZ2 4Å; A428-W471 PolarHBondContact O-NE1 3.03Å; L430-W471 HydrophobicContact CD2-CD2 3.76Å; L430-W471 HydrophobicContact CD2-CE3 3.75Å; L430-W471 HydrophobicContact CD2-CG 4.49Å; L430-W471 HydrophobicContact CD2-CH2 3.75Å; L430-W471 HydrophobicContact CD2-CZ2 3.76Å; L430-W471 HydrophobicContact CD2-CZ3 3.75Å; L430-W471 HydrophobicContact CG-CZ2 4.46Å; N431-W471 VanDerWaalsContact ND2-CB 3.31Å; N431-W471 WeakPolarHBondContact ND2-CB 3.23Å; N431-W471 PolarHBondContact ND2-O 3.3Å; L439-W471 HydrophobicContact CD1-CH2 4.19Å; L446-W471 HydrophobicContact CB-CH2 4.04Å; A448-W471 HydrophobicContact CB-CH2 4.17Å; A448-W471 HydrophobicContact CB-CZ3 3.88Å; E462-W471 HydrophobicContact CB-CE3 3.63Å; E462-W471 HydrophobicContact CB-CZ3 4.13Å; C463-W471 CarbonylContact O-C 3.56Å; C463-W471 WeakPolarHBondContact O-CA 3.4Å; Y464-W471 AromaticContact CD2-CD1 3.76Å; Y464-W471 HydrophobicContact CD2-CD2 4.11Å; Y464-W471 AromaticContact CD2-CE2 3.75Å; Y464-W471 HydrophobicContact CD2-CG 4.14Å; Y464-W471 HydrophobicContact CD2-CZ2 4.32Å; Y464-W471 AromaticContact CD2-NE1 3.49Å; Y464-W471 HydrophobicContact CG-CD2 4.3Å; Y464-W471 AromaticContact CG-CE2 3.94Å; Y464-W471 HydrophobicContact CG-CZ2 4.1Å; Y464-W471 VanDerWaalsContact N-CE3 3.33Å
472	T	98.6	Very high	97.2	Very high	74 Å²	74	50.6 Å²	50.6	45%	0.454	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.9	177.4	54.4	0	0	0	0	110.4	E462 C463	E462-T472 CarbonylContact C-O 3.58Å; E462-T472 VanDerWaalsContact CA-O 3.32Å; E462-T472 WeakPolarHBondContact CA-O 3.23Å; C463-T472 PolarHBondContact N-O 3.14Å; C463-T472 PolarHBondContact O-N 2.85Å; C463-T472 PolarHBondContact O-OG1 3.27Å
473	Y	98.8	Very high	97.1	Very high	114 Å²	114	50.8 Å²	50.8	45%	0.447	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	140.3	173.6	-66.2	-77.2	0	0	0	111	N431 E432 T460 V461 E462	N431-Y473 HydrophobicContact CB-CE1 4.44Å; N431-Y473 HydrophobicContact CB-CE2 3.9Å; N431-Y473 VanDerWaalsContact CB-OH 3.24Å; N431-Y473 WeakPolarHBondContact CB-OH 3.37Å; E432-Y473 WeakPolarHBondContact CG-OH 3.39Å; T460-Y473 HydrophobicContact CG2-CE1 4.32Å; V461-Y473 WeakPolarHBondContact O-CA 3.23Å; E462-Y473 HydrophobicContact CG-CD1 3.79Å; E462-Y473 HydrophobicContact CG-CE1 3.75Å
474	V	98.6	Very high	97.1	Very high	33 Å²	33	50.9 Å²	50.9	20%	0.2	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	-175	172.7	-59.8	0	0	0	0	109.4	Y447 V461 C463 K476 F511 D516	Y447-V474 HydrophobicContact CD1-CG2 4.3Å; Y447-V474 HydrophobicContact CE1-CG2 4.37Å; V461-V474 HydrophobicContact CB-CG2 3.72Å; V461-V474 HydrophobicContact CG1-CG2 3.45Å; V461-V474 VanDerWaalsContact CG1-CG2 3.45Å; V461-V474 PolarHBondContact O-N 2.81Å; C463-V474 HydrophobicContact CB-CG1 3.65Å; V474-K476 PolarHBondContact O-N 3.25Å; V474-K476 VanDerWaalsContact O-N 3.16Å; V474-F511 HydrophobicContact CB-CZ 4.35Å; V474-F511 HydrophobicContact CG2-CZ 4.02Å; V474-D516 WeakPolarHBondContact CB-OD1 3.27Å
475	A	98.4	Very high	97	Very high	25 Å²	25	51.2 Å²	51.2	21%	0.207	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-54.1	124.6	-178.5	0	0	0	0	0	112.1	V461 F511 D516 W518	V461-A475 WeakPolarHBondContact CG2-O 3.45Å; A475-F511 HydrophobicContact CB-CE2 4.2Å; A475-D516 WeakPolarHBondContact CB-O 3.15Å; A475-D516 VanDerWaalsContact CB-OD1 3.26Å; A475-D516 WeakPolarHBondContact CB-OD1 3.48Å; A475-D516 PolarHBondContact N-OD1 3.47Å; A475-D516 PolarHBondContact N-OD2 3.21Å; A475-W518 PolarHBondContact O-NE1 3.05Å
476	K	98.1	Very high	97	Very high	141 Å²	141	49.9 Å²	49.9	61%	0.613	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-74.7	159.5	177.8	64.4	173.8	-174.9	173.9	0	112	P459 V474	P459-K476 WeakPolarHBondContact O-CA 3.26Å; P459-K476 WeakPolarHBondContact O-CB 3.3Å; V474-K476 PolarHBondContact O-N 3.25Å; V474-K476 VanDerWaalsContact O-N 3.16Å
477	M	96.6	Very high	97	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.049	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-67.2	155.2	165.5	-62.3	-177.2	-62.7	0	0	110.4	V449 P459 E479 H481 W518	V449-M477 HydrophobicContact CG1-CE 4.02Å; V449-M477 HydrophobicContact CG1-CG 4.28Å; V449-M477 HydrophobicContact CG1-SD 3.6Å; V449-M477 VanDerWaalsContact CG1-SD 3.6Å; P459-M477 PolarHBondContact O-N 3.14Å; M477-E479 VanDerWaalsContact CB-O 3.25Å; M477-E479 WeakPolarHBondContact CB-O 3.35Å; M477-H481 HydrophobicContact CE-CB 4Å; M477-H481 HydrophobicContact SD-CB 4.43Å; M477-W518 HydrophobicContact CG-CH2 4.45Å; M477-W518 HydrophobicContact CG-CZ2 4.11Å
478	S	93.4	Very high	97.1	Very high	97 Å²	97	45.9 Å²	45.9	68%	0.678	25%	0.245	S	C	*	.	S	Bend	trans	-66	-41.9	176.8	49.3	0	0	0	0	111.9
479	E	93.4	Very high	97.1	Very high	93 Å²	93	45 Å²	45	44%	0.435	23%	0.233	S	C	.	.	S	Bend	trans	-116.9	157.1	176.8	-64.8	-56.9	146.1	0	0	110	M477 H481 T500 H501	M477-E479 VanDerWaalsContact CB-O 3.25Å; M477-E479 WeakPolarHBondContact CB-O 3.35Å; E479-H481 PolarHBondContact O-CD2 3.4Å; E479-T500 HydrophobicContact CB-CG2 4.14Å; E479-H501 IonicContact OE2-NE2 3Å
480	P	94.5	Very high	97.1	Very high	19 Å²	19	46.8 Å²	46.8	12%	0.123	26%	0.259	C	S	.	.			trans	-77.5	139.3	172.5	33.6	-35	0	0	0	110.9	E457 P459 T500	E457-P480 HydrophobicContact CB-CB 3.63Å; E457-P480 HydrophobicContact CB-CG 4.05Å; P459-P480 HydrophobicContact CB-CB 4.3Å; P480-T500 WeakPolarHBondContact O-CB 3.18Å; P480-T500 VanDerWaalsContact O-CG2 3.3Å; P480-T500 WeakPolarHBondContact O-CG2 3.49Å; P480-T500 PolarHBondContact O-OG1 3.49Å
481	H	92.7	Very high	97.1	Very high	21 Å²	21	42.7 Å²	42.7	10%	0.097	25%	0.247	C	C	.	.			trans	-135.8	140.8	178.9	-67.3	-111.1	0	0	0	110.6	G451 L458 M477 E479 H484 I499 T500	G451-H481 PolarHBondContact N-O 3.24Å; L458-H481 PolarHBondContact O-N 3.38Å; M477-H481 HydrophobicContact CE-CB 4Å; M477-H481 HydrophobicContact SD-CB 4.43Å; E479-H481 PolarHBondContact O-CD2 3.4Å; H481-H484 WeakPolarHBondContact CB-ND1 3.47Å; H481-H484 PolarHBondContact O-CE1 2.87Å; H481-H484 PolarHBondContact O-ND1 3.01Å; H481-I499 WeakPolarHBondContact CA-O 3.46Å; H481-T500 PolarHBondContact CE1-OG1 2.65Å; H481-T500 VanDerWaalsContact CE1-OG1 3.25Å; H481-T500 PolarHBondContact ND1-OG1 3.27Å; H481-T500 VanDerWaalsContact ND1-OG1 3.14Å
482	Y	96.8	Very high	97	Very high	22 Å²	22	43.1 Å²	43.1	9%	0.086	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-131.4	159.7	165	75.2	-84.8	0	0	0	111	F436 R452 E457 H484 G498 I499	F436-Y482 HydrophobicContact CB-CD2 4.1Å; F436-Y482 HydrophobicContact CG-CD2 4.31Å; F436-Y482 WeakPolarHBondContact O-CA 3.45Å; R452-Y482 HydrophobicContact CB-CG 4.47Å; R452-Y482 HydrophobicContact CG-CD2 4.49Å; R452-Y482 HydrophobicContact CG-CG 4.3Å; R452-Y482 PolarHBondContact NH1-OH 3.5Å; E457-Y482 HydrophobicContact CG-CD1 3.87Å; E457-Y482 HydrophobicContact CG-CE1 4.14Å; E457-Y482 WeakPolarHBondContact OE1-CE1 3.28Å; Y482-H484 PolarHBondContact O-N 3.13Å; Y482-H484 VanDerWaalsContact O-N 3.15Å; Y482-G498 WeakPolarHBondContact O-CA 3.45Å; Y482-I499 HydrophobicContact CD1-CB 4.19Å; Y482-I499 WeakPolarHBondContact CD1-O 3.34Å; Y482-I499 HydrophobicContact CE1-CB 3.7Å; Y482-I499 HydrophobicContact CE1-CG2 3.62Å; Y482-I499 HydrophobicContact CE2-CB 4.17Å; Y482-I499 HydrophobicContact CE2-CD1 3.72Å; Y482-I499 PolarHBondContact N-O 2.97Å; Y482-I499 VanDerWaalsContact N-O 3.07Å; Y482-I499 PolarHBondContact O-N 3.21Å; Y482-I499 WeakPolarHBondContact OH-CG2 3.48Å
483	G	96.1	Very high	97	Very high	5 Å²	5	39.6 Å²	39.6	5%	0.052	23%	0.229	C	C	.	.	S	Bend	trans	64.2	17.7	-178.6	0	0	0	0	0	113.7	F436 L530	F436-G483 PolarHBondContact O-N 3.14Å; G483-L530 PolarHBondContact O-N 2.85Å
484	H	97.7	Very high	97	Very high	11 Å²	11	34.9 Å²	34.9	5%	0.051	21%	0.211	C	C	.	.			trans	-78.3	162.7	170.2	56.6	-91.7	0	0	0	110	H438 V449 H481 Y482 I495 S496 G497	H438-H484 WeakPolarHBondContact CB-NE2 3.33Å; H438-H484 PolarHBondContact N-NE2 3.19Å; V449-H484 PolarHBondContact O-CE1 2.81Å; V449-H484 PolarHBondContact O-NE2 3.38Å; H481-H484 WeakPolarHBondContact CB-ND1 3.47Å; H481-H484 PolarHBondContact O-CE1 2.87Å; H481-H484 PolarHBondContact O-ND1 3.01Å; Y482-H484 PolarHBondContact O-N 3.13Å; Y482-H484 VanDerWaalsContact O-N 3.15Å; H484-I495 HydrophobicContact CB-CG2 3.97Å; H484-I495 WeakPolarHBondContact CD2-CG2 3.29Å; H484-S496 WeakPolarHBondContact CB-O 3.46Å; H484-G497 WeakPolarHBondContact CB-O 3.2Å
485	A	97.8	Very high	97	Very high	7 Å²	7	33.6 Å²	33.6	6%	0.058	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	156.9	174.3	0	0	0	0	0	110.4	I495 S496 H531 M533	A485-I495 CarbonylContact O-C 3.57Å; A485-I495 WeakPolarHBondContact O-CA 3.49Å; A485-S496 PolarHBondContact N-O 3.46Å; A485-S496 PolarHBondContact O-N 2.85Å; A485-S496 PolarHBondContact O-OG 2.86Å; A485-H531 VanDerWaalsContact CB-CD2 3.45Å; A485-H531 WeakPolarHBondContact CB-CD2 3.46Å; A485-H531 WeakPolarHBondContact CB-NE2 3.44Å; A485-H531 WeakPolarHBondContact CB-O 3.41Å; A485-M533 HydrophobicContact CB-CB 3.71Å
486	G	97.8	Very high	97	Very high	5 Å²	5	32.4 Å²	32.4	5%	0.052	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	167.7	179.2	0	0	0	0	0	113.3	H438 Y494	H438-G486 WeakPolarHBondContact CE1-CA 3.42Å; H438-G486 PolarHBondContact CE1-O 2.84Å; H438-G486 PolarHBondContact ND1-N 2.82Å; G486-Y494 CarbonylContact C-O 3.6Å; G486-Y494 WeakPolarHBondContact CA-O 3.43Å
487	T	98.6	Very high	97	Very high	17 Å²	17	25.8 Å²	25.8	10%	0.104	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	170.7	174.5	-160.1	0	0	0	0	110.9	Y494 M533 T535 L540	T487-Y494 PolarHBondContact N-O 3.33Å; T487-Y494 PolarHBondContact O-N 2.83Å; T487-M533 HydrophobicContact CG2-CE 3.92Å; T487-M533 HydrophobicContact CG2-CG 3.81Å; T487-M533 HydrophobicContact CG2-SD 4.1Å; T487-T535 WeakPolarHBondContact CG2-OG1 3.49Å; T487-T535 PolarHBondContact OG1-N 2.85Å; T487-T535 PolarHBondContact OG1-OG1 3.37Å; T487-T535 VanDerWaalsContact OG1-OG1 3.06Å; T487-L540 HydrophobicContact CG2-CB 4.09Å; T487-L540 HydrophobicContact CG2-CD2 3.69Å; T487-L540 HydrophobicContact CG2-CG 3.86Å
488	V	98.5	Very high	97	Very high	38 Å²	38	25.3 Å²	25.3	23%	0.23	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.9	-178	168.6	0	0	0	0	109.7	L442 V492 M493 T535	L442-V488 HydrophobicContact CB-CG2 4.14Å; L442-V488 HydrophobicContact CD1-CG1 3.55Å; L442-V488 HydrophobicContact CD1-CG2 4.27Å; V488-V492 WeakPolarHBondContact CA-O 3.39Å; V488-M493 HydrophobicContact CG2-CB 4.25Å; V488-M493 HydrophobicContact CG2-CG 4.49Å; V488-T535 PolarHBondContact O-OG1 3.36Å
489	Y	98.4	Very high	97.1	Very high	56 Å²	56	21.1 Å²	21.1	22%	0.22	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	142.2	171.4	176.5	-98.8	0	0	0	109.7	G491 V492 T535 G537 E538 L540 P565	Y489-G491 PolarHBondContact O-N 2.81Å; Y489-V492 PolarHBondContact N-O 2.98Å; Y489-V492 VanDerWaalsContact N-O 3.14Å; Y489-V492 VanDerWaalsContact O-CG2 3.23Å; Y489-V492 WeakPolarHBondContact O-CG2 3.4Å; Y489-V492 PolarHBondContact O-N 3Å; Y489-T535 HydrophobicContact CD2-CG2 3.81Å; Y489-T535 HydrophobicContact CG-CG2 4.37Å; Y489-G537 WeakPolarHBondContact CE2-O 3.23Å; Y489-E538 HydrophobicContact CE2-CB 4.21Å; Y489-E538 HydrophobicContact CE2-CG 4.3Å; Y489-E538 WeakPolarHBondContact OH-CG 3.27Å; Y489-L540 HydrophobicContact CD1-CD1 4.41Å; Y489-L540 HydrophobicContact CG-CD1 4.29Å; Y489-P565 HydrophobicContact CD1-CB 4.13Å; Y489-P565 HydrophobicContact CD1-CG 3.61Å; Y489-P565 HydrophobicContact CE1-CB 4.11Å; Y489-P565 HydrophobicContact CE1-CG 3.81Å; Y489-P565 HydrophobicContact CG-CG 4.49Å
490	G	97.1	Very high	97.2	Very high	68 Å²	68	17.1 Å²	17.1	70%	0.701	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.2	26.1	175	0	0	0	0	0	115.1	V492	G490-V492 VanDerWaalsContact C-N 3.3Å; G490-V492 PolarHBondContact O-N 2.91Å
491	G	97.6	Very high	97	Very high	26 Å²	26	21.8 Å²	21.8	27%	0.268	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	11.8	179.6	0	0	0	0	0	115.2	K443 Y489	K443-G491 WeakPolarHBondContact CE-O 3.37Å; K443-G491 PolarHBondContact NZ-O 3.5Å; Y489-G491 PolarHBondContact O-N 2.81Å
492	V	98.6	Very high	96.8	Very high	23 Å²	23	26.6 Å²	26.6	14%	0.139	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	162.1	174.9	-61	0	0	0	0	110.3	V488 Y489 G490 Y494 F511 D512	V488-V492 WeakPolarHBondContact CA-O 3.39Å; Y489-V492 PolarHBondContact N-O 2.98Å; Y489-V492 VanDerWaalsContact N-O 3.14Å; Y489-V492 VanDerWaalsContact O-CG2 3.23Å; Y489-V492 WeakPolarHBondContact O-CG2 3.4Å; Y489-V492 PolarHBondContact O-N 3Å; G490-V492 VanDerWaalsContact C-N 3.3Å; G490-V492 PolarHBondContact O-N 2.91Å; V492-Y494 HydrophobicContact CG2-CD2 4.34Å; V492-Y494 HydrophobicContact CG2-CE2 3.47Å; V492-Y494 VanDerWaalsContact CG2-CE2 3.47Å; V492-F511 WeakPolarHBondContact CA-O 3.36Å; V492-F511 WeakPolarHBondContact CB-O 3.43Å; V492-D512 HydrophobicContact CG1-CB 3.97Å
493	M	98.7	Very high	96.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	137.5	179.5	175.4	173.7	58	0	0	110.5	L442 Y447 V449 V488 I495 C510 F511 W518	L442-M493 HydrophobicContact CD2-CB 4.08Å; Y447-M493 HydrophobicContact CG-CE 4.43Å; V449-M493 HydrophobicContact CG2-CE 3.35Å; V449-M493 HydrophobicContact CG2-SD 3.81Å; V488-M493 HydrophobicContact CG2-CB 4.25Å; V488-M493 HydrophobicContact CG2-CG 4.49Å; M493-I495 HydrophobicContact CG-CD1 4.13Å; M493-I495 HydrophobicContact SD-CD1 4.18Å; M493-C510 CarbonylContact O-C 3.49Å; M493-C510 WeakPolarHBondContact O-CA 3.46Å; M493-F511 HydrophobicContact CB-CB 4.39Å; M493-F511 HydrophobicContact CE-CB 4.07Å; M493-F511 HydrophobicContact CE-CD1 3.79Å; M493-F511 HydrophobicContact CE-CG 4.2Å; M493-F511 PolarHBondContact N-O 2.82Å; M493-F511 PolarHBondContact O-N 2.96Å; M493-W518 HydrophobicContact CE-CH2 4.02Å; M493-W518 HydrophobicContact CE-CZ2 4.37Å
494	Y	98.8	Very high	96.6	Very high	15 Å²	15	30 Å²	30	6%	0.059	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.6	177.5	-65.5	-95.1	0	0	0	109.7	G486 T487 V492 L508 M509 C510 K521 L540 Y563	G486-Y494 CarbonylContact C-O 3.6Å; G486-Y494 WeakPolarHBondContact CA-O 3.43Å; T487-Y494 PolarHBondContact N-O 3.33Å; T487-Y494 PolarHBondContact O-N 2.83Å; V492-Y494 HydrophobicContact CG2-CD2 4.34Å; V492-Y494 HydrophobicContact CG2-CE2 3.47Å; V492-Y494 VanDerWaalsContact CG2-CE2 3.47Å; Y494-L508 HydrophobicContact CD1-CD1 4.32Å; Y494-L508 HydrophobicContact CD1-CD2 4.29Å; Y494-L508 HydrophobicContact CD1-CG 4.4Å; Y494-M509 CarbonylContact C-O 3.5Å; Y494-M509 WeakPolarHBondContact CA-O 3.22Å; Y494-C510 HydrophobicContact CD1-CB 4Å; Y494-C510 HydrophobicContact CE1-CB 3.9Å; Y494-K521 HydrophobicContact CE1-CG 4.43Å; Y494-L540 HydrophobicContact CD1-CD2 4.11Å; Y494-L540 HydrophobicContact CD2-CD2 3.32Å; Y494-L540 HydrophobicContact CE2-CD2 3.83Å; Y494-L540 HydrophobicContact CG-CD2 3.47Å; Y494-L540 VanDerWaalsContact CG-CD2 3.47Å; Y494-Y563 HydrophobicContact CD1-CE1 4.31Å; Y494-Y563 AromaticContact CE1-CE1 3.93Å; Y494-Y563 HydrophobicContact CE1-CE1 3.93Å
495	I	98.4	Very high	96.6	Very high	6 Å²	6	31.3 Å²	31.3	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.3	177.3	-58.9	-59	0	0	0	108.8	H438 V449 H484 A485 M493 L508 M509 W518	H438-I495 HydrophobicContact CB-CD1 3.96Å; H438-I495 WeakPolarHBondContact CD2-CD1 3.15Å; V449-I495 HydrophobicContact CB-CD1 4.4Å; V449-I495 HydrophobicContact CG1-CD1 4.31Å; V449-I495 HydrophobicContact CG1-CG1 4.19Å; V449-I495 HydrophobicContact CG2-CD1 4.3Å; H484-I495 HydrophobicContact CB-CG2 3.97Å; H484-I495 WeakPolarHBondContact CD2-CG2 3.29Å; A485-I495 CarbonylContact O-C 3.57Å; A485-I495 WeakPolarHBondContact O-CA 3.49Å; M493-I495 HydrophobicContact CG-CD1 4.13Å; M493-I495 HydrophobicContact SD-CD1 4.18Å; I495-L508 CarbonylContact O-C 3.57Å; I495-L508 WeakPolarHBondContact O-CA 3.47Å; I495-M509 PolarHBondContact N-O 3.11Å; I495-M509 PolarHBondContact O-N 2.63Å; I495-W518 HydrophobicContact CB-CZ3 4.24Å; I495-W518 HydrophobicContact CG1-CH2 3.64Å; I495-W518 HydrophobicContact CG1-CZ3 3.73Å
496	S	98.1	Very high	96.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.8	-178.6	60.3	0	0	0	0	112.4	H484 A485 E507 H531 M533	H484-S496 WeakPolarHBondContact CB-O 3.46Å; A485-S496 PolarHBondContact N-O 3.46Å; A485-S496 PolarHBondContact O-N 2.85Å; A485-S496 PolarHBondContact O-OG 2.86Å; S496-E507 WeakPolarHBondContact CA-O 3.39Å; S496-H531 PolarHBondContact O-CE1 2.77Å; S496-H531 PolarHBondContact O-NE2 3.07Å; S496-H531 VanDerWaalsContact O-NE2 3.13Å; S496-H531 PolarHBondContact OG-NE2 2.88Å; S496-M533 PolarHBondContact OG-SD 2.92Å; S496-M533 VanDerWaalsContact OG-SD 3.37Å
497	G	97.3	Very high	96.5	Very high	3 Å²	3	37.4 Å²	37.4	3%	0.031	21%	0.212	C	C	.	.			trans	57.9	-137.2	168.6	0	0	0	0	0	114.6	H484 Q505 E507	H484-G497 WeakPolarHBondContact CB-O 3.2Å; G497-Q505 WeakPolarHBondContact CA-O 3.24Å; G497-E507 PolarHBondContact N-O 2.84Å
498	G	97	Very high	96.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.207	C	C	.	.			trans	91.5	-162	-174.1	0	0	0	0	0	112.6	Y482 F504 Q505 R528	Y482-G498 WeakPolarHBondContact O-CA 3.45Å; G498-F504 WeakPolarHBondContact O-CA 3.34Å; G498-Q505 PolarHBondContact O-N 2.78Å; G498-R528 PolarHBondContact N-O 3.13Å
499	I	95.8	Very high	96.5	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.041	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.5	-174.6	-56	162	0	0	0	108.9	H481 Y482 T503 F504	H481-I499 WeakPolarHBondContact CA-O 3.46Å; Y482-I499 HydrophobicContact CD1-CB 4.19Å; Y482-I499 WeakPolarHBondContact CD1-O 3.34Å; Y482-I499 HydrophobicContact CE1-CB 3.7Å; Y482-I499 HydrophobicContact CE1-CG2 3.62Å; Y482-I499 HydrophobicContact CE2-CB 4.17Å; Y482-I499 HydrophobicContact CE2-CD1 3.72Å; Y482-I499 PolarHBondContact N-O 2.97Å; Y482-I499 VanDerWaalsContact N-O 3.07Å; Y482-I499 PolarHBondContact O-N 3.21Å; Y482-I499 WeakPolarHBondContact OH-CG2 3.48Å; I499-T503 WeakPolarHBondContact CA-O 3.42Å; I499-F504 HydrophobicContact CD1-CD1 4.38Å; I499-F504 HydrophobicContact CD1-CE1 3.88Å; I499-F504 HydrophobicContact CD1-CZ 4.35Å; I499-F504 HydrophobicContact CG1-CD1 3.8Å; I499-F504 HydrophobicContact CG1-CE1 3.82Å
500	T	94.8	Very high	96.5	Very high	9 Å²	9	34.2 Å²	34.2	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	125.3	175.8	-61.3	0	0	0	0	107.4	E479 P480 H481 D502 T503	E479-T500 HydrophobicContact CB-CG2 4.14Å; P480-T500 WeakPolarHBondContact O-CB 3.18Å; P480-T500 VanDerWaalsContact O-CG2 3.3Å; P480-T500 WeakPolarHBondContact O-CG2 3.49Å; P480-T500 PolarHBondContact O-OG1 3.49Å; H481-T500 PolarHBondContact CE1-OG1 2.65Å; H481-T500 VanDerWaalsContact CE1-OG1 3.25Å; H481-T500 PolarHBondContact ND1-OG1 3.27Å; H481-T500 VanDerWaalsContact ND1-OG1 3.14Å; T500-D502 VanDerWaalsContact C-N 3.28Å; T500-D502 PolarHBondContact O-N 3.04Å; T500-T503 PolarHBondContact N-O 2.94Å; T500-T503 WeakPolarHBondContact O-CB 3.01Å; T500-T503 PolarHBondContact O-N 3.05Å
501	H	91.6	Very high	96.6	Very high	118 Å²	118	31 Å²	31	55%	0.546	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	49.4	179	-54.1	-32.7	0	0	0	112.7	E457 E479 T503	E457-H501 PolarHBondContact OE1-N 3.43Å; E457-H501 IonicContact OE2-CE1 3.7Å; E457-H501 PolarHBondContact OE2-N 3.4Å; E457-H501 VanDerWaalsContact OE2-N 3.09Å; E457-H501 IonicContact OE2-ND1 2.69Å; E457-H501 PolarHBondContact OE2-ND1 3.48Å; E479-H501 IonicContact OE2-NE2 3Å; H501-T503 PolarHBondContact O-N 2.9Å; H501-T503 PolarHBondContact O-OG1 2.84Å
502	D	87.5	Confident	96.6	Very high	121 Å²	121	31.5 Å²	31.5	65%	0.647	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	13.7	-177.5	-61.1	-49	0	0	0	115.6	T500	T500-D502 VanDerWaalsContact C-N 3.28Å; T500-D502 PolarHBondContact O-N 3.04Å
503	T	93.3	Very high	96.6	Very high	83 Å²	83	31.5 Å²	31.5	51%	0.509	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.5	178.7	-56.3	0	0	0	0	111.3	I499 T500 H501 Q505	I499-T503 WeakPolarHBondContact CA-O 3.42Å; T500-T503 PolarHBondContact N-O 2.94Å; T500-T503 WeakPolarHBondContact O-CB 3.01Å; T500-T503 PolarHBondContact O-N 3.05Å; H501-T503 PolarHBondContact O-N 2.9Å; H501-T503 PolarHBondContact O-OG1 2.84Å; T503-Q505 PolarHBondContact O-NE2 3.34Å
504	F	95.8	Very high	96.6	Very high	17 Å²	17	37.4 Å²	37.4	8%	0.075	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	135.6	175.3	-70.3	-83.1	0	0	0	111.8	G498 I499 V527 N546 H547 F548 Y554	G498-F504 WeakPolarHBondContact O-CA 3.34Å; I499-F504 HydrophobicContact CD1-CD1 4.38Å; I499-F504 HydrophobicContact CD1-CE1 3.88Å; I499-F504 HydrophobicContact CD1-CZ 4.35Å; I499-F504 HydrophobicContact CG1-CD1 3.8Å; I499-F504 HydrophobicContact CG1-CE1 3.82Å; F504-V527 HydrophobicContact CB-CB 3.9Å; F504-V527 HydrophobicContact CB-CG2 4.05Å; F504-N546 WeakPolarHBondContact CD1-O 3.02Å; F504-N546 WeakPolarHBondContact CE1-O 3.45Å; F504-H547 HydrophobicContact CD2-CB 4.27Å; F504-H547 HydrophobicContact CE2-CB 4.5Å; F504-H547 HydrophobicContact CG-CB 4.26Å; F504-F548 AromaticContact CD2-CD2 3.77Å; F504-F548 HydrophobicContact CD2-CD2 3.77Å; F504-F548 AromaticContact CD2-CE2 3.96Å; F504-F548 HydrophobicContact CD2-CE2 3.96Å; F504-F548 HydrophobicContact CD2-CG 4.3Å; F504-F548 HydrophobicContact CE2-CD1 4.08Å; F504-F548 AromaticContact CE2-CD2 3.57Å; F504-F548 HydrophobicContact CE2-CD2 3.57Å; F504-F548 HydrophobicContact CE2-CE1 4.09Å; F504-F548 AromaticContact CE2-CE2 3.58Å; F504-F548 HydrophobicContact CE2-CE2 3.58Å; F504-F548 AromaticContact CE2-CG 3.82Å; F504-F548 HydrophobicContact CE2-CG 3.82Å; F504-F548 AromaticContact CE2-CZ 3.84Å; F504-F548 HydrophobicContact CE2-CZ 3.84Å; F504-Y554 HydrophobicContact CE2-CE1 4.32Å; F504-Y554 HydrophobicContact CZ-CD1 4.12Å; F504-Y554 AromaticContact CZ-CE1 3.83Å; F504-Y554 HydrophobicContact CZ-CE1 3.83Å
505	Q	96.9	Very high	96.5	Very high	37 Å²	37	40.1 Å²	40.1	17%	0.173	21%	0.211	C	C	.	.			trans	-105.8	158.1	-175.5	-57.1	-53.9	-48.1	0	0	110.7	G497 G498 T503 E507 V527 R528	G497-Q505 WeakPolarHBondContact CA-O 3.24Å; G498-Q505 PolarHBondContact O-N 2.78Å; T503-Q505 PolarHBondContact O-NE2 3.34Å; Q505-E507 VanDerWaalsContact CB-OE2 3.3Å; Q505-E507 WeakPolarHBondContact CB-OE2 3.5Å; Q505-E507 PolarHBondContact OE1-OE2 2.94Å; Q505-V527 WeakPolarHBondContact O-CA 3.31Å; Q505-R528 PolarHBondContact O-N 2.91Å; Q505-R528 VanDerWaalsContact O-N 3.14Å
506	K	97	Very high	96.5	Very high	83 Å²	83	43.2 Å²	43.2	36%	0.361	23%	0.227	S	C	.	.			trans	-126.6	-3.3	174.3	61.1	176	-176.5	175.1	0	113.5	P523 M524 V527	K506-P523 HydrophobicContact CD-CB 4.39Å; K506-P523 HydrophobicContact CG-CB 4.12Å; K506-P523 WeakPolarHBondContact O-CA 3.34Å; K506-M524 HydrophobicContact CB-CB 4.3Å; K506-M524 HydrophobicContact CB-CE 4.49Å; K506-M524 PolarHBondContact O-N 2.98Å; K506-V527 HydrophobicContact CB-CG1 3.87Å; K506-V527 HydrophobicContact CD-CG1 4.27Å; K506-V527 HydrophobicContact CG-CG1 4.13Å
507	E	97.7	Very high	96.5	Very high	57 Å²	57	49.5 Å²	49.5	27%	0.266	26%	0.255	S	S	.	.			trans	-63	146.8	-175.4	-70	66.1	-151.3	0	0	110.5	S496 G497 Q505	S496-E507 WeakPolarHBondContact CA-O 3.39Å; G497-E507 PolarHBondContact N-O 2.84Å; Q505-E507 VanDerWaalsContact CB-OE2 3.3Å; Q505-E507 WeakPolarHBondContact CB-OE2 3.5Å; Q505-E507 PolarHBondContact OE1-OE2 2.94Å
508	L	98.4	Very high	96.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	120.6	170.9	179.9	66.6	0	0	0	108.2	Y494 I495 K521 A522 M533 Y563 W570	Y494-L508 HydrophobicContact CD1-CD1 4.32Å; Y494-L508 HydrophobicContact CD1-CD2 4.29Å; Y494-L508 HydrophobicContact CD1-CG 4.4Å; I495-L508 CarbonylContact O-C 3.57Å; I495-L508 WeakPolarHBondContact O-CA 3.47Å; L508-K521 HydrophobicContact CB-CB 4.13Å; L508-K521 HydrophobicContact CD2-CB 3.67Å; L508-K521 HydrophobicContact CD2-CG 4.4Å; L508-K521 HydrophobicContact CG-CB 3.89Å; L508-K521 PolarHBondContact O-N 2.93Å; L508-A522 WeakPolarHBondContact CB-O 3.33Å; L508-M533 HydrophobicContact CD1-CE 4.08Å; L508-Y563 HydrophobicContact CD2-CD1 3.78Å; L508-Y563 HydrophobicContact CD2-CD2 3.71Å; L508-Y563 HydrophobicContact CD2-CE1 3.71Å; L508-Y563 HydrophobicContact CD2-CE2 3.63Å; L508-Y563 HydrophobicContact CD2-CG 3.78Å; L508-W570 HydrophobicContact CB-CZ2 4.33Å; L508-W570 HydrophobicContact CD1-CZ2 4.14Å; L508-W570 HydrophobicContact CD2-CZ2 3.8Å; L508-W570 HydrophobicContact CG-CZ2 4.31Å
509	M	98.3	Very high	96.6	Very high	36 Å²	36	55.8 Å²	55.8	18%	0.177	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.3	178	-60.5	-57.5	-66.1	0	0	109.7	Y494 I495 W518 Q520	Y494-M509 CarbonylContact C-O 3.5Å; Y494-M509 WeakPolarHBondContact CA-O 3.22Å; I495-M509 PolarHBondContact N-O 3.11Å; I495-M509 PolarHBondContact O-N 2.63Å; M509-W518 HydrophobicContact CB-CE3 3.68Å; M509-W518 HydrophobicContact CB-CZ3 3.87Å; M509-W518 HydrophobicContact CE-CB 4.16Å; M509-Q520 HydrophobicContact CE-CB 4.24Å; M509-Q520 HydrophobicContact SD-CB 3.81Å; M509-Q520 HydrophobicContact SD-CG 3.93Å
510	C	98.4	Very high	96.7	Very high	9 Å²	9	61.3 Å²	61.3	6%	0.061	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	120.4	179	178.5	0	0	0	0	109.5	M493 Y494 W518 I519 K521	M493-C510 CarbonylContact O-C 3.49Å; M493-C510 WeakPolarHBondContact O-CA 3.46Å; Y494-C510 HydrophobicContact CD1-CB 4Å; Y494-C510 HydrophobicContact CE1-CB 3.9Å; C510-W518 CarbonylContact O-C 3.6Å; C510-W518 WeakPolarHBondContact O-CA 3.45Å; C510-I519 WeakPolarHBondContact CB-O 3.5Å; C510-I519 PolarHBondContact N-O 2.92Å; C510-I519 PolarHBondContact O-N 3.19Å; C510-K521 HydrophobicContact CB-CG 3.92Å
511	F	98.7	Very high	96.9	Very high	1 Å²	1	63.6 Å²	63.6	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.8	175.1	178	-109.7	0	0	0	111.1	Y447 V474 A475 V492 M493 P513 D516 K517 W518	Y447-F511 AromaticContact CD1-CE1 3.89Å; Y447-F511 HydrophobicContact CD1-CE1 3.89Å; Y447-F511 AromaticContact CE1-CE1 3.63Å; Y447-F511 HydrophobicContact CE1-CE1 3.63Å; Y447-F511 HydrophobicContact CE1-CZ 4.29Å; V474-F511 HydrophobicContact CB-CZ 4.35Å; V474-F511 HydrophobicContact CG2-CZ 4.02Å; A475-F511 HydrophobicContact CB-CE2 4.2Å; V492-F511 WeakPolarHBondContact CA-O 3.36Å; V492-F511 WeakPolarHBondContact CB-O 3.43Å; M493-F511 HydrophobicContact CB-CB 4.39Å; M493-F511 HydrophobicContact CE-CB 4.07Å; M493-F511 HydrophobicContact CE-CD1 3.79Å; M493-F511 HydrophobicContact CE-CG 4.2Å; M493-F511 PolarHBondContact N-O 2.82Å; M493-F511 PolarHBondContact O-N 2.96Å; F511-P513 HydrophobicContact CE1-CB 3.87Å; F511-P513 HydrophobicContact CZ-CB 4.49Å; F511-D516 WeakPolarHBondContact CE2-OD1 3.44Å; F511-D516 WeakPolarHBondContact CZ-OD1 3.35Å; F511-K517 WeakPolarHBondContact CA-O 3.19Å; F511-W518 HydrophobicContact CB-CD2 3.8Å; F511-W518 HydrophobicContact CB-CE3 3.64Å; F511-W518 HydrophobicContact CB-CH2 3.61Å; F511-W518 HydrophobicContact CB-CZ2 3.71Å; F511-W518 HydrophobicContact CB-CZ3 3.57Å; F511-W518 AromaticContact CD2-CD1 3.91Å; F511-W518 AromaticContact CD2-CD2 3.96Å; F511-W518 HydrophobicContact CD2-CD2 3.96Å; F511-W518 AromaticContact CD2-CE2 3.57Å; F511-W518 HydrophobicContact CD2-CG 4.17Å; F511-W518 AromaticContact CD2-CZ2 3.99Å; F511-W518 HydrophobicContact CD2-CZ2 3.99Å; F511-W518 AromaticContact CD2-NE1 3.51Å; F511-W518 HydrophobicContact CG-CD2 4.31Å; F511-W518 AromaticContact CG-CE2 3.95Å; F511-W518 HydrophobicContact CG-CH2 4.32Å; F511-W518 AromaticContact CG-CZ2 3.95Å; F511-W518 HydrophobicContact CG-CZ2 3.95Å
512	D	98.4	Very high	97.2	Very high	35 Å²	35	59.2 Å²	59.2	19%	0.187	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.7	170.4	175.1	12.5	0	0	0	110.2	V492 D514 T515 D516 K517	V492-D512 HydrophobicContact CG1-CB 3.97Å; D512-D514 VanDerWaalsContact C-N 3.27Å; D512-D514 PolarHBondContact O-N 2.95Å; D512-D514 PolarHBondContact OD1-N 2.85Å; D512-T515 WeakPolarHBondContact CB-OG1 3.42Å; D512-T515 VanDerWaalsContact CG-OG1 3.27Å; D512-T515 VanDerWaalsContact OD2-CG2 3.31Å; D512-T515 WeakPolarHBondContact OD2-CG2 3.3Å; D512-T515 PolarHBondContact OD2-OG1 2.74Å; D512-D516 WeakPolarHBondContact O-CA 3.39Å; D512-D516 PolarHBondContact O-N 2.88Å; D512-K517 PolarHBondContact N-O 3.17Å; D512-K517 PolarHBondContact O-N 2.84Å
513	P	97.8	Very high	97.7	Very high	24 Å²	24	56.2 Å²	56.2	16%	0.156	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.9	-179.4	31.9	-38.8	0	0	0	113.6	L442 K443 Y447 F511	L442-P513 HydrophobicContact CD2-CB 4.22Å; L442-P513 HydrophobicContact CD2-CG 3.64Å; L442-P513 HydrophobicContact CG-CG 4.18Å; K443-P513 HydrophobicContact CD-CG 3.95Å; Y447-P513 HydrophobicContact CE1-CB 4.47Å; Y447-P513 WeakPolarHBondContact OH-CB 3.3Å; F511-P513 HydrophobicContact CE1-CB 3.87Å; F511-P513 HydrophobicContact CZ-CB 4.49Å
514	D	97.7	Very high	98	Very high	123 Å²	123	52.4 Å²	52.4	66%	0.658	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-33.8	-179.4	-63.8	-18.9	0	0	0	111.2	K443 D512	K443-D514 IonicContact NZ-OD1 2.74Å; K443-D514 PolarHBondContact NZ-OD1 2.89Å; K443-D514 IonicContact NZ-OD2 2.82Å; K443-D514 PolarHBondContact NZ-OD2 2.8Å; D512-D514 VanDerWaalsContact C-N 3.27Å; D512-D514 PolarHBondContact O-N 2.95Å; D512-D514 PolarHBondContact OD1-N 2.85Å
515	T	97.9	Very high	98	Very high	73 Å²	73	56.7 Å²	56.7	45%	0.448	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-7.6	177.9	58.6	0	0	0	0	113.6	D512 K517	D512-T515 WeakPolarHBondContact CB-OG1 3.42Å; D512-T515 VanDerWaalsContact CG-OG1 3.27Å; D512-T515 VanDerWaalsContact OD2-CG2 3.31Å; D512-T515 WeakPolarHBondContact OD2-CG2 3.3Å; D512-T515 PolarHBondContact OD2-OG1 2.74Å; T515-K517 VanDerWaalsContact C-N 3.35Å; T515-K517 WeakPolarHBondContact O-CG 3.46Å; T515-K517 PolarHBondContact O-N 2.8Å
516	D	98.2	Very high	97.9	Very high	71 Å²	71	56.5 Å²	56.5	38%	0.38	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	51.1	-174.4	-166.3	31.1	0	0	0	112.3	V474 A475 F511 D512	V474-D516 WeakPolarHBondContact CB-OD1 3.27Å; A475-D516 WeakPolarHBondContact CB-O 3.15Å; A475-D516 VanDerWaalsContact CB-OD1 3.26Å; A475-D516 WeakPolarHBondContact CB-OD1 3.48Å; A475-D516 PolarHBondContact N-OD1 3.47Å; A475-D516 PolarHBondContact N-OD2 3.21Å; F511-D516 WeakPolarHBondContact CE2-OD1 3.44Å; F511-D516 WeakPolarHBondContact CZ-OD1 3.35Å; D512-D516 WeakPolarHBondContact O-CA 3.39Å; D512-D516 PolarHBondContact O-N 2.88Å
517	K	98.1	Very high	97.8	Very high	131 Å²	131	55.2 Å²	55.2	57%	0.57	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.8	-174.2	-76.1	176.3	-171.7	-179.6	0	113	F511 D512 T515	F511-K517 WeakPolarHBondContact CA-O 3.19Å; D512-K517 PolarHBondContact N-O 3.17Å; D512-K517 PolarHBondContact O-N 2.84Å; T515-K517 VanDerWaalsContact C-N 3.35Å; T515-K517 WeakPolarHBondContact O-CG 3.46Å; T515-K517 PolarHBondContact O-N 2.8Å
518	W	98.4	Very high	97.8	Very high	42 Å²	42	52.5 Å²	52.5	16%	0.159	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.7	171.1	-69	92.5	0	0	0	110.8	V449 V461 A475 M477 M493 I495 M509 C510 F511	V449-W518 HydrophobicContact CG1-CH2 4Å; V449-W518 HydrophobicContact CG1-CZ2 4.2Å; V449-W518 HydrophobicContact CG2-CH2 4.41Å; V461-W518 HydrophobicContact CG2-CZ2 3.92Å; A475-W518 PolarHBondContact O-NE1 3.05Å; M477-W518 HydrophobicContact CG-CH2 4.45Å; M477-W518 HydrophobicContact CG-CZ2 4.11Å; M493-W518 HydrophobicContact CE-CH2 4.02Å; M493-W518 HydrophobicContact CE-CZ2 4.37Å; I495-W518 HydrophobicContact CB-CZ3 4.24Å; I495-W518 HydrophobicContact CG1-CH2 3.64Å; I495-W518 HydrophobicContact CG1-CZ3 3.73Å; M509-W518 HydrophobicContact CB-CE3 3.68Å; M509-W518 HydrophobicContact CB-CZ3 3.87Å; M509-W518 HydrophobicContact CE-CB 4.16Å; C510-W518 CarbonylContact O-C 3.6Å; C510-W518 WeakPolarHBondContact O-CA 3.45Å; F511-W518 HydrophobicContact CB-CD2 3.8Å; F511-W518 HydrophobicContact CB-CE3 3.64Å; F511-W518 HydrophobicContact CB-CH2 3.61Å; F511-W518 HydrophobicContact CB-CZ2 3.71Å; F511-W518 HydrophobicContact CB-CZ3 3.57Å; F511-W518 AromaticContact CD2-CD1 3.91Å; F511-W518 AromaticContact CD2-CD2 3.96Å; F511-W518 HydrophobicContact CD2-CD2 3.96Å; F511-W518 AromaticContact CD2-CE2 3.57Å; F511-W518 HydrophobicContact CD2-CG 4.17Å; F511-W518 AromaticContact CD2-CZ2 3.99Å; F511-W518 HydrophobicContact CD2-CZ2 3.99Å; F511-W518 AromaticContact CD2-NE1 3.51Å; F511-W518 HydrophobicContact CG-CD2 4.31Å; F511-W518 AromaticContact CG-CE2 3.95Å; F511-W518 HydrophobicContact CG-CH2 4.32Å; F511-W518 AromaticContact CG-CZ2 3.95Å; F511-W518 HydrophobicContact CG-CZ2 3.95Å
519	I	97.8	Very high	97.7	Very high	94 Å²	94	52.5 Å²	52.5	48%	0.482	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129.6	176.7	-58	175.4	0	0	0	108.2	C510	C510-I519 WeakPolarHBondContact CB-O 3.5Å; C510-I519 PolarHBondContact N-O 2.92Å; C510-I519 PolarHBondContact O-N 3.19Å
520	Q	98.1	Very high	97.6	Very high	124 Å²	124	52 Å²	52	58%	0.579	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	139	174.3	-172.3	172.7	-4.2	0	0	110.8	M509	M509-Q520 HydrophobicContact CE-CB 4.24Å; M509-Q520 HydrophobicContact SD-CB 3.81Å; M509-Q520 HydrophobicContact SD-CG 3.93Å
521	K	98.4	Very high	97.5	Very high	57 Å²	57	52.1 Å²	52.1	25%	0.248	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	177.3	176.5	-66	-60.1	-171	174	0	110.7	Y494 L508 C510	Y494-K521 HydrophobicContact CE1-CG 4.43Å; L508-K521 HydrophobicContact CB-CB 4.13Å; L508-K521 HydrophobicContact CD2-CB 3.67Å; L508-K521 HydrophobicContact CD2-CG 4.4Å; L508-K521 HydrophobicContact CG-CB 3.89Å; L508-K521 PolarHBondContact O-N 2.93Å; C510-K521 HydrophobicContact CB-CG 3.92Å
522	A	98.4	Very high	97.4	Very high	25 Å²	25	52.4 Å²	52.4	21%	0.207	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-55.1	128.9	176.4	0	0	0	0	0	110.7	L508 Y563 D568 W570	L508-A522 WeakPolarHBondContact CB-O 3.33Å; A522-Y563 HydrophobicContact CB-CE2 4.42Å; A522-D568 WeakPolarHBondContact CB-O 3.39Å; A522-D568 VanDerWaalsContact CB-OD1 3.26Å; A522-D568 WeakPolarHBondContact CB-OD1 3.3Å; A522-D568 PolarHBondContact N-OD1 2.82Å; A522-W570 PolarHBondContact O-NE1 2.8Å
523	P	98.4	Very high	97.4	Very high	58 Å²	58	51.2 Å²	51.2	38%	0.377	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-73.3	155.4	-178.7	31.2	-35.3	0	0	0	111.2	K506 W570	K506-P523 HydrophobicContact CD-CB 4.39Å; K506-P523 HydrophobicContact CG-CB 4.12Å; K506-P523 WeakPolarHBondContact O-CA 3.34Å; P523-W570 PolarHBondContact O-NE1 3Å
524	M	98.1	Very high	97.4	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.015	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-59.7	162.6	170.7	-65.3	-179.4	-62.7	0	0	111.6	K506 R528 V542 W570	K506-M524 HydrophobicContact CB-CB 4.3Å; K506-M524 HydrophobicContact CB-CE 4.49Å; K506-M524 PolarHBondContact O-N 2.98Å; M524-R528 HydrophobicContact CE-CG 3.66Å; M524-R528 HydrophobicContact SD-CG 4.18Å; M524-V542 HydrophobicContact SD-CB 4.19Å; M524-V542 HydrophobicContact SD-CG1 3.65Å; M524-V542 HydrophobicContact SD-CG2 4Å; M524-W570 HydrophobicContact CG-CD2 4.11Å; M524-W570 HydrophobicContact CG-CE3 4.38Å; M524-W570 HydrophobicContact CG-CH2 3.71Å; M524-W570 HydrophobicContact CG-CZ2 3.36Å; M524-W570 HydrophobicContact CG-CZ3 4.2Å; M524-W570 HydrophobicContact SD-CH2 4.23Å; M524-W570 HydrophobicContact SD-CZ2 4.37Å
525	T	96.3	Very high	97.5	Very high	107 Å²	107	46 Å²	46	66%	0.656	25%	0.247	S	C	*	.	S	Bend	trans	-74.5	-37.8	176.9	-45.2	0	0	0	0	111.7	E561	T525-E561 PolarHBondContact N-OE2 2.95Å; T525-E561 PolarHBondContact OG1-OE2 3.12Å; T525-E561 VanDerWaalsContact OG1-OE2 3.07Å
526	T	94.5	Very high	97.5	Very high	34 Å²	34	43.3 Å²	43.3	21%	0.209	23%	0.23	C	C	.	.	S	Bend	trans	-116.1	134.5	-175.3	-49.9	0	0	0	0	110.6	V557	T526-V557 HydrophobicContact CG2-CG1 4.02Å
527	V	96	Very high	97.4	Very high	55 Å²	55	43 Å²	43	33%	0.333	24%	0.243	S	C	.	.			trans	-66.9	138.8	169.4	-64.8	0	0	0	0	109.8	F504 Q505 K506 H547	F504-V527 HydrophobicContact CB-CB 3.9Å; F504-V527 HydrophobicContact CB-CG2 4.05Å; Q505-V527 WeakPolarHBondContact O-CA 3.31Å; K506-V527 HydrophobicContact CB-CG1 3.87Å; K506-V527 HydrophobicContact CD-CG1 4.27Å; K506-V527 HydrophobicContact CG-CG1 4.13Å; V527-H547 HydrophobicContact CG2-CB 4.1Å; V527-H547 PolarHBondContact O-CD2 2.81Å
528	R	96.6	Very high	97.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.243	C	C	.	.			trans	-158.2	147.4	-179.1	56.3	177.6	88.1	-134	6.3	112.1	G498 Q505 M524 H531 G544 N546 V557 S559 E561	G498-R528 PolarHBondContact N-O 3.13Å; Q505-R528 PolarHBondContact O-N 2.91Å; Q505-R528 VanDerWaalsContact O-N 3.14Å; M524-R528 HydrophobicContact CE-CG 3.66Å; M524-R528 HydrophobicContact SD-CG 4.18Å; R528-H531 VanDerWaalsContact CD-CG 3.48Å; R528-H531 HydrophobicContact CG-CB 4.25Å; R528-G544 PolarHBondContact NH1-O 2.75Å; R528-N546 WeakPolarHBondContact CA-O 3.13Å; R528-V557 HydrophobicContact CB-CG2 4.28Å; R528-S559 PolarHBondContact NH1-O 2.88Å; R528-S559 PolarHBondContact NH2-O 3.4Å; R528-E561 IonicContact CZ-OE1 3.86Å; R528-E561 IonicContact NH2-OE1 3.59Å; R528-E561 PolarHBondContact NH2-OE1 2.94Å
529	G	96.3	Very high	97.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-129.6	164.1	168.6	0	0	0	0	0	110.2	H531 G545 N546	G529-H531 PolarHBondContact O-N 3.38Å; G529-G545 CarbonylContact O-C 3.43Å; G529-G545 WeakPolarHBondContact O-CA 3.3Å; G529-N546 PolarHBondContact N-O 3.08Å; G529-N546 PolarHBondContact O-N 3.29Å; G529-N546 PolarHBondContact O-OD1 3.19Å
530	L	96	Very high	97.4	Very high	25 Å²	25	41 Å²	41	13%	0.131	23%	0.231	C	C	.	.	S	Bend	trans	53.4	22.4	-177.7	-52.4	177.5	0	0	0	113.8	F436 G483 S581 D582 W600	F436-L530 HydrophobicContact CD1-CD2 3.59Å; F436-L530 HydrophobicContact CE1-CD2 3.73Å; G483-L530 PolarHBondContact O-N 2.85Å; L530-S581 WeakPolarHBondContact O-CA 3.37Å; L530-D582 PolarHBondContact O-N 3.37Å; L530-W600 HydrophobicContact CD1-CZ2 4.32Å
531	H	97.6	Very high	97.4	Very high	13 Å²	13	35.2 Å²	35.2	6%	0.06	20%	0.204	C	C	.	.			trans	-79.5	177.7	172.8	63.4	-75.2	0	0	0	110.7	A485 S496 R528 G529 I543 G544	A485-H531 VanDerWaalsContact CB-CD2 3.45Å; A485-H531 WeakPolarHBondContact CB-CD2 3.46Å; A485-H531 WeakPolarHBondContact CB-NE2 3.44Å; A485-H531 WeakPolarHBondContact CB-O 3.41Å; S496-H531 PolarHBondContact O-CE1 2.77Å; S496-H531 PolarHBondContact O-NE2 3.07Å; S496-H531 VanDerWaalsContact O-NE2 3.13Å; S496-H531 PolarHBondContact OG-NE2 2.88Å; R528-H531 VanDerWaalsContact CD-CG 3.48Å; R528-H531 HydrophobicContact CG-CB 4.25Å; G529-H531 PolarHBondContact O-N 3.38Å; H531-I543 WeakPolarHBondContact CB-O 3.49Å; H531-G544 VanDerWaalsContact CB-O 3.22Å; H531-G544 WeakPolarHBondContact CB-O 3.33Å
532	C	97.3	Very high	97.4	Very high	7 Å²	7	32.5 Å²	32.5	5%	0.047	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	159.2	170.6	68.6	0	0	0	0	111.4	I543 V583 V585	C532-I543 PolarHBondContact N-O 2.87Å; C532-I543 PolarHBondContact O-N 2.93Å; C532-V583 HydrophobicContact CB-CG2 3.61Å; C532-V585 HydrophobicContact CB-CB 3.88Å; C532-V585 HydrophobicContact CB-CG1 3.77Å; C532-V585 HydrophobicContact CB-CG2 4.48Å
533	M	97.9	Very high	97.4	Very high	9 Å²	9	31.3 Å²	31.3	4%	0.044	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139.6	178.6	-170	176.6	-171.8	0	0	109.5	A485 T487 S496 L508 L540 Y541 V542 W570	A485-M533 HydrophobicContact CB-CB 3.71Å; T487-M533 HydrophobicContact CG2-CE 3.92Å; T487-M533 HydrophobicContact CG2-CG 3.81Å; T487-M533 HydrophobicContact CG2-SD 4.1Å; S496-M533 PolarHBondContact OG-SD 2.92Å; S496-M533 VanDerWaalsContact OG-SD 3.37Å; L508-M533 HydrophobicContact CD1-CE 4.08Å; M533-L540 HydrophobicContact CE-CB 3.66Å; M533-L540 HydrophobicContact CE-CD2 3.85Å; M533-L540 HydrophobicContact CE-CG 4.37Å; M533-Y541 WeakPolarHBondContact CA-O 3.5Å; M533-Y541 VanDerWaalsContact CG-O 3.3Å; M533-Y541 WeakPolarHBondContact CG-O 3.45Å; M533-V542 HydrophobicContact CB-CG2 4.22Å; M533-V542 HydrophobicContact CE-CG2 4.23Å; M533-V542 HydrophobicContact CG-CG2 3.8Å; M533-V542 HydrophobicContact SD-CG2 4.04Å; M533-W570 HydrophobicContact CE-CH2 4.26Å
534	C	98.3	Very high	97.3	Very high	8 Å²	8	28.6 Å²	28.6	5%	0.054	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	158	175.9	63.6	0	0	0	0	111.9	L540 Y541 V585 V587 I592	C534-L540 CarbonylContact O-C 3.52Å; C534-Y541 PolarHBondContact N-O 2.82Å; C534-Y541 VanDerWaalsContact N-O 3.07Å; C534-Y541 PolarHBondContact O-N 2.84Å; C534-V585 HydrophobicContact CB-CG2 4.1Å; C534-V587 HydrophobicContact CB-CG2 3.96Å; C534-I592 VanDerWaalsContact SG-CG2 3.57Å
535	T	98.3	Very high	97.2	Very high	31 Å²	31	28.5 Å²	28.5	19%	0.19	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.8	177.5	-59	0	0	0	0	110.1	T487 V488 Y489 R539	T487-T535 WeakPolarHBondContact CG2-OG1 3.49Å; T487-T535 PolarHBondContact OG1-N 2.85Å; T487-T535 PolarHBondContact OG1-OG1 3.37Å; T487-T535 VanDerWaalsContact OG1-OG1 3.06Å; V488-T535 PolarHBondContact O-OG1 3.36Å; Y489-T535 HydrophobicContact CD2-CG2 3.81Å; Y489-T535 HydrophobicContact CG-CG2 4.37Å; T535-R539 WeakPolarHBondContact CA-O 3.49Å
536	V	98.1	Very high	97.2	Very high	16 Å²	16	23.4 Å²	23.4	10%	0.097	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	120.4	166.3	-173.3	0	0	0	0	108.7	E538 R539 Y541 V587 N590 I592 P614	V536-E538 PolarHBondContact O-N 3.15Å; V536-R539 PolarHBondContact N-O 2.86Å; V536-R539 PolarHBondContact O-N 2.82Å; V536-Y541 HydrophobicContact CB-CD2 4.26Å; V536-Y541 HydrophobicContact CB-CE2 3.83Å; V536-Y541 HydrophobicContact CG2-CD2 4.28Å; V536-Y541 HydrophobicContact CG2-CE2 4.28Å; V536-V587 HydrophobicContact CG2-CB 4.49Å; V536-V587 HydrophobicContact CG2-CG1 3.84Å; V536-V587 HydrophobicContact CG2-CG2 3.77Å; V536-N590 HydrophobicContact CG1-CB 4.4Å; V536-I592 HydrophobicContact CG2-CD1 3.83Å; V536-I592 HydrophobicContact CG2-CG1 3.55Å; V536-P614 HydrophobicContact CG1-CG 4.26Å
537	G	96.2	Very high	97.2	Very high	63 Å²	63	23.6 Å²	23.6	65%	0.649	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	-120.7	-171	0	0	0	0	0	111.1	Y489	Y489-G537 WeakPolarHBondContact CE2-O 3.23Å
538	E	96.6	Very high	97	Very high	123 Å²	123	24.2 Å²	24.2	58%	0.575	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	10.7	-178.5	-55.8	-175.2	160	0	0	113.7	Y489 V536 P565	Y489-E538 HydrophobicContact CE2-CB 4.21Å; Y489-E538 HydrophobicContact CE2-CG 4.3Å; Y489-E538 WeakPolarHBondContact OH-CG 3.27Å; V536-E538 PolarHBondContact O-N 3.15Å; E538-P565 WeakPolarHBondContact O-CD 3.41Å
539	R	98.4	Very high	96.3	Very high	103 Å²	103	32.6 Å²	32.6	39%	0.389	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.8	-173	-66.3	174.3	-178.2	168.7	-0.9	110.9	T535 V536 Y541 Y562	T535-R539 WeakPolarHBondContact CA-O 3.49Å; V536-R539 PolarHBondContact N-O 2.86Å; V536-R539 PolarHBondContact O-N 2.82Å; R539-Y541 HydrophobicContact CB-CD2 4.24Å; R539-Y541 HydrophobicContact CB-CE2 3.46Å; R539-Y541 VanDerWaalsContact CB-CE2 3.46Å; R539-Y541 VanDerWaalsContact CD-OH 3.25Å; R539-Y541 WeakPolarHBondContact CD-OH 3.36Å; R539-Y541 WeakPolarHBondContact O-CD2 3.5Å; R539-Y562 HydrophobicContact CB-CD2 3.9Å; R539-Y562 HydrophobicContact CB-CG 4.17Å; R539-Y562 HydrophobicContact CG-CD2 3.65Å; R539-Y562 HydrophobicContact CG-CE2 3.88Å; R539-Y562 HydrophobicContact CG-CG 4.25Å
540	L	98.7	Very high	95.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	107.2	-179.4	-63	74.8	0	0	0	108.3	T487 Y489 Y494 M533 C534 Y562 Y563 P565	T487-L540 HydrophobicContact CG2-CB 4.09Å; T487-L540 HydrophobicContact CG2-CD2 3.69Å; T487-L540 HydrophobicContact CG2-CG 3.86Å; Y489-L540 HydrophobicContact CD1-CD1 4.41Å; Y489-L540 HydrophobicContact CG-CD1 4.29Å; Y494-L540 HydrophobicContact CD1-CD2 4.11Å; Y494-L540 HydrophobicContact CD2-CD2 3.32Å; Y494-L540 HydrophobicContact CE2-CD2 3.83Å; Y494-L540 HydrophobicContact CG-CD2 3.47Å; Y494-L540 VanDerWaalsContact CG-CD2 3.47Å; M533-L540 HydrophobicContact CE-CB 3.66Å; M533-L540 HydrophobicContact CE-CD2 3.85Å; M533-L540 HydrophobicContact CE-CG 4.37Å; C534-L540 CarbonylContact O-C 3.52Å; L540-Y562 CarbonylContact O-C 3.59Å; L540-Y562 VanDerWaalsContact O-CA 3.25Å; L540-Y562 WeakPolarHBondContact O-CA 3.39Å; L540-Y563 HydrophobicContact CD1-CD1 4.2Å; L540-Y563 HydrophobicContact CD2-CD1 4.33Å; L540-Y563 PolarHBondContact N-O 2.86Å; L540-Y563 PolarHBondContact O-N 3.15Å; L540-P565 VanDerWaalsContact CD1-CD 3.47Å; L540-P565 HydrophobicContact CD1-CG 3.15Å; L540-P565 HydrophobicContact CG-CG 4.5Å
541	Y	98.8	Very high	94.3	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	137.3	-173.5	-67.4	-95.8	0	0	0	110.5	M533 C534 V536 R539 Y562 I573 I592 Y612	M533-Y541 WeakPolarHBondContact CA-O 3.5Å; M533-Y541 VanDerWaalsContact CG-O 3.3Å; M533-Y541 WeakPolarHBondContact CG-O 3.45Å; C534-Y541 PolarHBondContact N-O 2.82Å; C534-Y541 VanDerWaalsContact N-O 3.07Å; C534-Y541 PolarHBondContact O-N 2.84Å; V536-Y541 HydrophobicContact CB-CD2 4.26Å; V536-Y541 HydrophobicContact CB-CE2 3.83Å; V536-Y541 HydrophobicContact CG2-CD2 4.28Å; V536-Y541 HydrophobicContact CG2-CE2 4.28Å; R539-Y541 HydrophobicContact CB-CD2 4.24Å; R539-Y541 HydrophobicContact CB-CE2 3.46Å; R539-Y541 VanDerWaalsContact CB-CE2 3.46Å; R539-Y541 VanDerWaalsContact CD-OH 3.25Å; R539-Y541 WeakPolarHBondContact CD-OH 3.36Å; R539-Y541 WeakPolarHBondContact O-CD2 3.5Å; Y541-Y562 HydrophobicContact CE1-CD1 4.13Å; Y541-Y562 HydrophobicContact CE1-CG 4.26Å; Y541-I573 HydrophobicContact CD1-CD1 3.63Å; Y541-I573 HydrophobicContact CE1-CD1 3.92Å; Y541-I592 HydrophobicContact CD1-CD1 3.9Å; Y541-I592 HydrophobicContact CD2-CD1 3.74Å; Y541-I592 HydrophobicContact CE1-CD1 4.49Å; Y541-I592 HydrophobicContact CE2-CD1 4.35Å; Y541-I592 HydrophobicContact CG-CD1 3.5Å; Y541-I592 VanDerWaalsContact CG-CD1 3.5Å; Y541-Y612 HydrophobicContact CD1-CE1 4.1Å; Y541-Y612 AromaticContact CE1-CE1 3.68Å; Y541-Y612 HydrophobicContact CE1-CE1 3.68Å
542	V	98.4	Very high	93.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.2	170.7	165.7	0	0	0	0	109.5	M524 M533 E561 W570	M524-V542 HydrophobicContact SD-CB 4.19Å; M524-V542 HydrophobicContact SD-CG1 3.65Å; M524-V542 HydrophobicContact SD-CG2 4Å; M533-V542 HydrophobicContact CB-CG2 4.22Å; M533-V542 HydrophobicContact CE-CG2 4.23Å; M533-V542 HydrophobicContact CG-CG2 3.8Å; M533-V542 HydrophobicContact SD-CG2 4.04Å; V542-E561 HydrophobicContact CB-CG 4.43Å; V542-E561 PolarHBondContact N-O 3.16Å; V542-E561 PolarHBondContact O-N 3.19Å; V542-W570 HydrophobicContact CB-CH2 4.17Å; V542-W570 HydrophobicContact CB-CZ3 3.89Å; V542-W570 HydrophobicContact CG2-CH2 3.43Å; V542-W570 VanDerWaalsContact CG2-CH2 3.43Å; V542-W570 HydrophobicContact CG2-CZ3 3.63Å
543	I	98	Very high	92.7	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	134.1	-164.8	-60.8	168.9	0	0	0	109.7	H531 C532 C560 M576 I592 V594 W619	H531-I543 WeakPolarHBondContact CB-O 3.49Å; C532-I543 PolarHBondContact N-O 2.87Å; C532-I543 PolarHBondContact O-N 2.93Å; I543-C560 HydrophobicContact CG1-CB 4.5Å; I543-M576 HydrophobicContact CG2-CE 3.82Å; I543-M576 HydrophobicContact CG2-CG 4.03Å; I543-M576 HydrophobicContact CG2-SD 3.48Å; I543-M576 WeakPolarHBondContact CG2-SD 3.41Å; I543-I592 HydrophobicContact CD1-CB 4.47Å; I543-I592 HydrophobicContact CD1-CD1 4Å; I543-I592 HydrophobicContact CD1-CG2 3.73Å; I543-V594 HydrophobicContact CG2-CG2 3.87Å; I543-W619 HydrophobicContact CD1-CH2 4.01Å; I543-W619 HydrophobicContact CD1-CZ2 4.25Å; I543-W619 HydrophobicContact CG1-CH2 4.45Å; I543-W619 HydrophobicContact CG1-CZ2 4.37Å; I543-W619 HydrophobicContact CG2-CH2 3.64Å; I543-W619 HydrophobicContact CG2-CZ2 3.92Å
544	G	96.7	Very high	92.3	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.01	29%	0.294	C	S	.	.			trans	68.5	-150.8	171	0	0	0	0	0	114.3	R528 H531 V557 M576	R528-G544 PolarHBondContact NH1-O 2.75Å; H531-G544 VanDerWaalsContact CB-O 3.22Å; H531-G544 WeakPolarHBondContact CB-O 3.33Å; G544-V557 WeakPolarHBondContact CA-O 3.2Å; G544-M576 WeakPolarHBondContact CA-SD 3.48Å; G544-M576 PolarHBondContact N-SD 3.02Å
545	G	96.7	Very high	92.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.299	C	S	.	.			trans	87.7	-166.3	-172.9	0	0	0	0	0	113.1	G529 V557 Q580 S581	G529-G545 CarbonylContact O-C 3.43Å; G529-G545 WeakPolarHBondContact O-CA 3.3Å; G545-V557 PolarHBondContact O-N 3.11Å; G545-Q580 PolarHBondContact N-O 3.26Å; G545-S581 WeakPolarHBondContact CA-OG 3.48Å; G545-S581 PolarHBondContact O-OG 3Å
546	N	95.6	Very high	92	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	163.1	-178.6	66.5	-18.8	0	0	0	112.2	F504 R528 G529 Y554 D555 S581 W600	F504-N546 WeakPolarHBondContact CD1-O 3.02Å; F504-N546 WeakPolarHBondContact CE1-O 3.45Å; R528-N546 WeakPolarHBondContact CA-O 3.13Å; G529-N546 PolarHBondContact N-O 3.08Å; G529-N546 PolarHBondContact O-N 3.29Å; G529-N546 PolarHBondContact O-OD1 3.19Å; N546-Y554 WeakPolarHBondContact ND2-CD1 3.34Å; N546-D555 VanDerWaalsContact CA-O 3.23Å; N546-D555 WeakPolarHBondContact CA-O 3.41Å; N546-D555 WeakPolarHBondContact CB-O 3.48Å; N546-S581 PolarHBondContact N-OG 2.96Å; N546-W600 VanDerWaalsContact CB-CD1 3.48Å; N546-W600 HydrophobicContact CB-CG 4.17Å; N546-W600 WeakPolarHBondContact ND2-CZ2 3.44Å; N546-W600 PolarHBondContact ND2-NE1 3.11Å
547	H	94.5	Very high	91.9	Very high	37 Å²	37	52.5 Å²	52.5	17%	0.171	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	-175.5	164.7	61.4	55.8	0	0	0	109.8	F504 V527 Y554 D555 V557	F504-H547 HydrophobicContact CD2-CB 4.27Å; F504-H547 HydrophobicContact CE2-CB 4.5Å; F504-H547 HydrophobicContact CG-CB 4.26Å; V527-H547 HydrophobicContact CG2-CB 4.1Å; V527-H547 PolarHBondContact O-CD2 2.81Å; H547-Y554 WeakPolarHBondContact O-CA 3.14Å; H547-D555 PolarHBondContact N-O 3.37Å; H547-D555 VanDerWaalsContact N-O 3.12Å; H547-D555 PolarHBondContact O-N 2.88Å; H547-V557 WeakPolarHBondContact CD2-CG2 3.36Å
548	F	91.4	Very high	91.9	Very high	69 Å²	69	52.9 Å²	52.9	30%	0.303	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136.3	169.2	-64.3	-51.5	0	0	0	111.6	F504 D553 Y554	F504-F548 AromaticContact CD2-CD2 3.77Å; F504-F548 HydrophobicContact CD2-CD2 3.77Å; F504-F548 AromaticContact CD2-CE2 3.96Å; F504-F548 HydrophobicContact CD2-CE2 3.96Å; F504-F548 HydrophobicContact CD2-CG 4.3Å; F504-F548 HydrophobicContact CE2-CD1 4.08Å; F504-F548 AromaticContact CE2-CD2 3.57Å; F504-F548 HydrophobicContact CE2-CD2 3.57Å; F504-F548 HydrophobicContact CE2-CE1 4.09Å; F504-F548 AromaticContact CE2-CE2 3.58Å; F504-F548 HydrophobicContact CE2-CE2 3.58Å; F504-F548 AromaticContact CE2-CG 3.82Å; F504-F548 HydrophobicContact CE2-CG 3.82Å; F504-F548 AromaticContact CE2-CZ 3.84Å; F504-F548 HydrophobicContact CE2-CZ 3.84Å; F548-D553 CarbonylContact C-O 3.51Å; F548-D553 WeakPolarHBondContact CA-O 3.12Å; F548-Y554 HydrophobicContact CD1-CD1 4.18Å; F548-Y554 HydrophobicContact CD1-CE1 4.28Å; F548-Y554 HydrophobicContact CD1-CG 4.43Å; F548-Y554 AromaticContact CE1-CD1 3.91Å; F548-Y554 HydrophobicContact CE1-CD1 3.91Å; F548-Y554 HydrophobicContact CE1-CD2 4.24Å; F548-Y554 AromaticContact CE1-CE1 3.58Å; F548-Y554 HydrophobicContact CE1-CE1 3.58Å; F548-Y554 AromaticContact CE1-CE2 3.9Å; F548-Y554 HydrophobicContact CE1-CE2 3.9Å; F548-Y554 HydrophobicContact CE1-CG 4.26Å; F548-Y554 AromaticContact CE1-CZ 3.56Å; F548-Y554 HydrophobicContact CZ-CE1 4.16Å
549	R	82.7	Confident	91.9	Very high	176 Å²	176	49.5 Å²	49.5	66%	0.664	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	115.1	159.5	179.7	175.2	-179.2	179.9	1.1	107.7	D553 D555	R549-D553 PolarHBondContact N-O 2.87Å; R549-D555 HydrophobicContact CB-CB 3.79Å
550	G	78.9	Confident	91.9	Very high	73 Å²	73	44.7 Å²	44.7	75%	0.753	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.8	-132.5	-171.1	0	0	0	0	0	111.4
551	T	71.9	Confident	91.9	Very high	138 Å²	138	45 Å²	45	85%	0.847	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-20	-171.3	49	0	0	0	0	115.4
552	S	75.5	Confident	91.9	Very high	74 Å²	74	46.6 Å²	46.6	52%	0.517	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.1	-9.6	-172.6	55.8	0	0	0	0	116.8
553	D	85.3	Confident	91.9	Very high	103 Å²	103	46.6 Å²	46.6	55%	0.551	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	120	-177.7	-72.1	-30.8	0	0	0	109.9	F548 R549	F548-D553 CarbonylContact C-O 3.51Å; F548-D553 WeakPolarHBondContact CA-O 3.12Å; R549-D553 PolarHBondContact N-O 2.87Å
554	Y	89.8	Confident	91.9	Very high	96 Å²	96	47.5 Å²	47.5	38%	0.376	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	136.4	175.6	-70.2	-83.6	0	0	0	111.1	F504 N546 H547 F548 W600	F504-Y554 HydrophobicContact CE2-CE1 4.32Å; F504-Y554 HydrophobicContact CZ-CD1 4.12Å; F504-Y554 AromaticContact CZ-CE1 3.83Å; F504-Y554 HydrophobicContact CZ-CE1 3.83Å; N546-Y554 WeakPolarHBondContact ND2-CD1 3.34Å; H547-Y554 WeakPolarHBondContact O-CA 3.14Å; F548-Y554 HydrophobicContact CD1-CD1 4.18Å; F548-Y554 HydrophobicContact CD1-CE1 4.28Å; F548-Y554 HydrophobicContact CD1-CG 4.43Å; F548-Y554 AromaticContact CE1-CD1 3.91Å; F548-Y554 HydrophobicContact CE1-CD1 3.91Å; F548-Y554 HydrophobicContact CE1-CD2 4.24Å; F548-Y554 AromaticContact CE1-CE1 3.58Å; F548-Y554 HydrophobicContact CE1-CE1 3.58Å; F548-Y554 AromaticContact CE1-CE2 3.9Å; F548-Y554 HydrophobicContact CE1-CE2 3.9Å; F548-Y554 HydrophobicContact CE1-CG 4.26Å; F548-Y554 AromaticContact CE1-CZ 3.56Å; F548-Y554 HydrophobicContact CZ-CE1 4.16Å; Y554-W600 HydrophobicContact CD1-CD2 4.41Å; Y554-W600 HydrophobicContact CD1-CE3 4.28Å; Y554-W600 HydrophobicContact CD1-CH2 4.21Å; Y554-W600 HydrophobicContact CD1-CZ2 4.39Å; Y554-W600 HydrophobicContact CD1-CZ3 4.17Å; Y554-W600 AromaticContact CD2-CE3 3.83Å; Y554-W600 HydrophobicContact CD2-CE3 3.83Å; Y554-W600 HydrophobicContact CD2-CH2 4.07Å; Y554-W600 AromaticContact CD2-CZ3 3.44Å; Y554-W600 HydrophobicContact CD2-CZ3 3.44Å; Y554-W600 VanDerWaalsContact CD2-CZ3 3.44Å; Y554-W600 HydrophobicContact CE1-CH2 4.31Å; Y554-W600 HydrophobicContact CE2-CH2 4.22Å; Y554-W600 AromaticContact CE2-CZ3 3.96Å; Y554-W600 HydrophobicContact CE2-CZ3 3.96Å; Y554-W600 HydrophobicContact CG-CD2 4.03Å; Y554-W600 AromaticContact CG-CE3 3.55Å; Y554-W600 HydrophobicContact CG-CE3 3.55Å; Y554-W600 HydrophobicContact CG-CH2 4.05Å; Y554-W600 AromaticContact CG-CZ3 3.55Å; Y554-W600 HydrophobicContact CG-CZ3 3.55Å
555	D	93.8	Very high	91.9	Very high	31 Å²	31	48.5 Å²	48.5	17%	0.166	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	144.7	178.3	-168.7	17.2	0	0	0	110	N546 H547 R549 N601	N546-D555 VanDerWaalsContact CA-O 3.23Å; N546-D555 WeakPolarHBondContact CA-O 3.41Å; N546-D555 WeakPolarHBondContact CB-O 3.48Å; H547-D555 PolarHBondContact N-O 3.37Å; H547-D555 VanDerWaalsContact N-O 3.12Å; H547-D555 PolarHBondContact O-N 2.88Å; R549-D555 HydrophobicContact CB-CB 3.79Å; D555-N601 PolarHBondContact OD1-ND2 2.9Å; D555-N601 PolarHBondContact OD1-OD1 2.93Å
556	D	95.3	Very high	92	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.043	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	132.8	-179.9	-73.9	-43.8	0	0	0	110.6	L558 S599 W600 N601	D556-L558 PolarHBondContact O-N 3.25Å; D556-S599 PolarHBondContact OD2-OG 3.46Å; D556-W600 VanDerWaalsContact CG-N 3.33Å; D556-W600 WeakPolarHBondContact OD1-CB 3.24Å; D556-W600 PolarHBondContact OD1-N 2.87Å; D556-W600 PolarHBondContact OD2-N 2.91Å; D556-W600 VanDerWaalsContact OD2-N 3.12Å; D556-N601 WeakPolarHBondContact OD2-CB 3.23Å; D556-N601 PolarHBondContact OD2-N 2.98Å
557	V	96.6	Very high	92.1	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.024	33%	0.328	C	S	.	.			trans	-89.3	103.1	174.6	-169.4	0	0	0	0	110.1	T526 R528 G544 G545 H547 S559	T526-V557 HydrophobicContact CG2-CG1 4.02Å; R528-V557 HydrophobicContact CB-CG2 4.28Å; G544-V557 WeakPolarHBondContact CA-O 3.2Å; G545-V557 PolarHBondContact O-N 3.11Å; H547-V557 WeakPolarHBondContact CD2-CG2 3.36Å; V557-S559 WeakPolarHBondContact CG1-OG 3.23Å
558	L	96.2	Very high	92.3	Very high	70 Å²	70	61.6 Å²	61.6	37%	0.366	34%	0.337	S	S	.	.			trans	-82.9	-28.4	177.4	-57.4	-178.2	0	0	0	113.1	D556 C560 A575 M576 G579	D556-L558 PolarHBondContact O-N 3.25Å; L558-C560 PolarHBondContact O-N 2.87Å; L558-C560 PolarHBondContact O-SG 2.84Å; L558-A575 HydrophobicContact CB-CB 4.32Å; L558-A575 CarbonylContact O-C 3.57Å; L558-A575 VanDerWaalsContact O-CA 3.28Å; L558-A575 WeakPolarHBondContact O-CA 3.34Å; L558-A575 WeakPolarHBondContact O-CB 3.19Å; L558-M576 HydrophobicContact CD2-CB 4.46Å; L558-M576 PolarHBondContact O-N 2.81Å; L558-G579 VanDerWaalsContact CD2-CA 3.46Å
559	S	97	Very high	92.6	Very high	52 Å²	52	63.7 Å²	63.7	36%	0.364	35%	0.348	S	S	.	.			trans	-65.9	129.4	-179.1	55.5	0	0	0	0	110.6	R528 V557	R528-S559 PolarHBondContact NH1-O 2.88Å; R528-S559 PolarHBondContact NH2-O 3.4Å; V557-S559 WeakPolarHBondContact CG1-OG 3.23Å
560	C	98	Very high	93.3	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	152	177.3	-64.1	0	0	0	0	109.1	I543 L558 I573 M576	I543-C560 HydrophobicContact CG1-CB 4.5Å; L558-C560 PolarHBondContact O-N 2.87Å; L558-C560 PolarHBondContact O-SG 2.84Å; C560-I573 VanDerWaalsContact C-CG1 3.45Å; C560-I573 HydrophobicContact CB-CD1 3.76Å; C560-I573 HydrophobicContact CB-CG1 3.52Å; C560-I573 WeakPolarHBondContact O-CG1 3.47Å; C560-I573 PolarHBondContact O-N 2.87Å; C560-M576 WeakPolarHBondContact SG-CG 3.48Å
561	E	98.3	Very high	94.3	Very high	5 Å²	5	55 Å²	55	2%	0.023	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	150.4	-179.9	51.6	-165.1	124.5	0	0	109.1	T525 R528 V542 W570 T571	T525-E561 PolarHBondContact N-OE2 2.95Å; T525-E561 PolarHBondContact OG1-OE2 3.12Å; T525-E561 VanDerWaalsContact OG1-OE2 3.07Å; R528-E561 IonicContact CZ-OE1 3.86Å; R528-E561 IonicContact NH2-OE1 3.59Å; R528-E561 PolarHBondContact NH2-OE1 2.94Å; V542-E561 HydrophobicContact CB-CG 4.43Å; V542-E561 PolarHBondContact N-O 3.16Å; V542-E561 PolarHBondContact O-N 3.19Å; E561-W570 HydrophobicContact CB-CE3 3.93Å; E561-W570 HydrophobicContact CG-CD2 4.35Å; E561-W570 HydrophobicContact CG-CE3 3.51Å; E561-W570 HydrophobicContact CG-CZ3 3.9Å; E561-T571 CarbonylContact C-O 3.55Å; E561-T571 VanDerWaalsContact CA-O 3.25Å; E561-T571 WeakPolarHBondContact CA-O 3.48Å
562	Y	98.5	Very high	95.5	Very high	37 Å²	37	53.4 Å²	53.4	15%	0.145	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	147.4	165.8	73.8	-99.1	0	0	0	110.8	R539 L540 Y541 W570 T571 I573	R539-Y562 HydrophobicContact CB-CD2 3.9Å; R539-Y562 HydrophobicContact CB-CG 4.17Å; R539-Y562 HydrophobicContact CG-CD2 3.65Å; R539-Y562 HydrophobicContact CG-CE2 3.88Å; R539-Y562 HydrophobicContact CG-CG 4.25Å; L540-Y562 CarbonylContact O-C 3.59Å; L540-Y562 VanDerWaalsContact O-CA 3.25Å; L540-Y562 WeakPolarHBondContact O-CA 3.39Å; Y541-Y562 HydrophobicContact CE1-CD1 4.13Å; Y541-Y562 HydrophobicContact CE1-CG 4.26Å; Y562-W570 VanDerWaalsContact C-CE3 3.48Å; Y562-W570 CarbonylContact O-C 3.54Å; Y562-W570 WeakPolarHBondContact O-CA 3.41Å; Y562-T571 HydrophobicContact CE1-CG2 3.79Å; Y562-T571 VanDerWaalsContact CZ-CB 3.5Å; Y562-T571 PolarHBondContact N-O 2.85Å; Y562-T571 PolarHBondContact O-N 3.24Å; Y562-I573 HydrophobicContact CD1-CG2 3.46Å; Y562-I573 VanDerWaalsContact CD1-CG2 3.46Å; Y562-I573 HydrophobicContact CE1-CG2 3.78Å
563	Y	98.8	Very high	96.6	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	135.6	173.5	175.5	-104.8	0	0	0	110.4	Y494 L508 A522 L540 P565 D568 Q569 W570	Y494-Y563 HydrophobicContact CD1-CE1 4.31Å; Y494-Y563 AromaticContact CE1-CE1 3.93Å; Y494-Y563 HydrophobicContact CE1-CE1 3.93Å; L508-Y563 HydrophobicContact CD2-CD1 3.78Å; L508-Y563 HydrophobicContact CD2-CD2 3.71Å; L508-Y563 HydrophobicContact CD2-CE1 3.71Å; L508-Y563 HydrophobicContact CD2-CE2 3.63Å; L508-Y563 HydrophobicContact CD2-CG 3.78Å; A522-Y563 HydrophobicContact CB-CE2 4.42Å; L540-Y563 HydrophobicContact CD1-CD1 4.2Å; L540-Y563 HydrophobicContact CD2-CD1 4.33Å; L540-Y563 PolarHBondContact N-O 2.86Å; L540-Y563 PolarHBondContact O-N 3.15Å; Y563-P565 HydrophobicContact CD1-CG 4.08Å; Y563-P565 VanDerWaalsContact CE1-CA 3.46Å; Y563-P565 HydrophobicContact CE1-CB 4.06Å; Y563-P565 HydrophobicContact CE1-CG 3.95Å; Y563-D568 WeakPolarHBondContact CE2-OD1 3.42Å; Y563-D568 WeakPolarHBondContact OH-CA 3.44Å; Y563-D568 PolarHBondContact OH-OD1 2.67Å; Y563-Q569 WeakPolarHBondContact CA-O 3.48Å; Y563-W570 AromaticContact CD2-CD1 3.97Å; Y563-W570 HydrophobicContact CD2-CD2 4.14Å; Y563-W570 AromaticContact CD2-CE2 3.79Å; Y563-W570 HydrophobicContact CD2-CG 4.27Å; Y563-W570 HydrophobicContact CD2-CZ2 4.27Å; Y563-W570 AromaticContact CD2-NE1 3.65Å; Y563-W570 HydrophobicContact CG-CD2 4.4Å; Y563-W570 HydrophobicContact CG-CZ2 4.19Å
564	S	98.3	Very high	97.2	Very high	20 Å²	20	47.4 Å²	47.4	14%	0.14	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	111.9	169.2	177.9	0	0	0	0	109.5	I566 L567 D568 Q569	S564-I566 PolarHBondContact O-N 3.17Å; S564-L567 PolarHBondContact O-N 2.93Å; S564-D568 WeakPolarHBondContact O-CA 3.24Å; S564-D568 PolarHBondContact O-N 3.02Å; S564-Q569 PolarHBondContact N-O 2.79Å
565	P	97.9	Very high	97.6	Very high	22 Å²	22	45.4 Å²	45.4	14%	0.143	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.5	179	-26.1	37.1	0	0	0	114.2	Y489 E538 L540 Y563	Y489-P565 HydrophobicContact CD1-CB 4.13Å; Y489-P565 HydrophobicContact CD1-CG 3.61Å; Y489-P565 HydrophobicContact CE1-CB 4.11Å; Y489-P565 HydrophobicContact CE1-CG 3.81Å; Y489-P565 HydrophobicContact CG-CG 4.49Å; E538-P565 WeakPolarHBondContact O-CD 3.41Å; L540-P565 VanDerWaalsContact CD1-CD 3.47Å; L540-P565 HydrophobicContact CD1-CG 3.15Å; L540-P565 HydrophobicContact CG-CG 4.5Å; Y563-P565 HydrophobicContact CD1-CG 4.08Å; Y563-P565 VanDerWaalsContact CE1-CA 3.46Å; Y563-P565 HydrophobicContact CE1-CB 4.06Å; Y563-P565 HydrophobicContact CE1-CG 3.95Å
566	I	97.1	Very high	97.7	Very high	127 Å²	127	44.3 Å²	44.3	65%	0.651	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-41.2	179.6	-64.7	171.5	0	0	0	110.4	S564	S564-I566 PolarHBondContact O-N 3.17Å
567	L	97.9	Very high	97.6	Very high	119 Å²	119	49 Å²	49	62%	0.623	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-12.2	-176.2	-59.4	177.2	0	0	0	113.5	S564 Q569	S564-L567 PolarHBondContact O-N 2.93Å; L567-Q569 VanDerWaalsContact C-N 3.27Å; L567-Q569 HydrophobicContact CB-CB 4.16Å; L567-Q569 PolarHBondContact O-N 2.89Å
568	D	98.3	Very high	97.4	Very high	66 Å²	66	52.1 Å²	52.1	35%	0.353	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	48.6	-171	-162.8	10.9	0	0	0	111.6	A522 Y563 S564	A522-D568 WeakPolarHBondContact CB-O 3.39Å; A522-D568 VanDerWaalsContact CB-OD1 3.26Å; A522-D568 WeakPolarHBondContact CB-OD1 3.3Å; A522-D568 PolarHBondContact N-OD1 2.82Å; Y563-D568 WeakPolarHBondContact CE2-OD1 3.42Å; Y563-D568 WeakPolarHBondContact OH-CA 3.44Å; Y563-D568 PolarHBondContact OH-OD1 2.67Å; S564-D568 WeakPolarHBondContact O-CA 3.24Å; S564-D568 PolarHBondContact O-N 3.02Å
569	Q	98.3	Very high	97.1	Very high	114 Å²	114	49 Å²	49	53%	0.533	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	142.1	-172.8	-172.8	177.7	11.6	0	0	112.1	Y563 S564 L567	Y563-Q569 WeakPolarHBondContact CA-O 3.48Å; S564-Q569 PolarHBondContact N-O 2.79Å; L567-Q569 VanDerWaalsContact C-N 3.27Å; L567-Q569 HydrophobicContact CB-CB 4.16Å; L567-Q569 PolarHBondContact O-N 2.89Å
570	W	98.6	Very high	97	Very high	20 Å²	20	46.5 Å²	46.5	8%	0.076	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.3	170.4	-67.1	91	0	0	0	111.8	L508 A522 P523 M524 M533 V542 E561 Y562 Y563	L508-W570 HydrophobicContact CB-CZ2 4.33Å; L508-W570 HydrophobicContact CD1-CZ2 4.14Å; L508-W570 HydrophobicContact CD2-CZ2 3.8Å; L508-W570 HydrophobicContact CG-CZ2 4.31Å; A522-W570 PolarHBondContact O-NE1 2.8Å; P523-W570 PolarHBondContact O-NE1 3Å; M524-W570 HydrophobicContact CG-CD2 4.11Å; M524-W570 HydrophobicContact CG-CE3 4.38Å; M524-W570 HydrophobicContact CG-CH2 3.71Å; M524-W570 HydrophobicContact CG-CZ2 3.36Å; M524-W570 HydrophobicContact CG-CZ3 4.2Å; M524-W570 HydrophobicContact SD-CH2 4.23Å; M524-W570 HydrophobicContact SD-CZ2 4.37Å; M533-W570 HydrophobicContact CE-CH2 4.26Å; V542-W570 HydrophobicContact CB-CH2 4.17Å; V542-W570 HydrophobicContact CB-CZ3 3.89Å; V542-W570 HydrophobicContact CG2-CH2 3.43Å; V542-W570 VanDerWaalsContact CG2-CH2 3.43Å; V542-W570 HydrophobicContact CG2-CZ3 3.63Å; E561-W570 HydrophobicContact CB-CE3 3.93Å; E561-W570 HydrophobicContact CG-CD2 4.35Å; E561-W570 HydrophobicContact CG-CE3 3.51Å; E561-W570 HydrophobicContact CG-CZ3 3.9Å; Y562-W570 VanDerWaalsContact C-CE3 3.48Å; Y562-W570 CarbonylContact O-C 3.54Å; Y562-W570 WeakPolarHBondContact O-CA 3.41Å; Y563-W570 AromaticContact CD2-CD1 3.97Å; Y563-W570 HydrophobicContact CD2-CD2 4.14Å; Y563-W570 AromaticContact CD2-CE2 3.79Å; Y563-W570 HydrophobicContact CD2-CG 4.27Å; Y563-W570 HydrophobicContact CD2-CZ2 4.27Å; Y563-W570 AromaticContact CD2-NE1 3.65Å; Y563-W570 HydrophobicContact CG-CD2 4.4Å; Y563-W570 HydrophobicContact CG-CZ2 4.19Å
571	T	98.4	Very high	96.8	Very high	47 Å²	47	46.4 Å²	46.4	29%	0.288	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.6	176	-56.2	0	0	0	0	109.2	E561 Y562	E561-T571 CarbonylContact C-O 3.55Å; E561-T571 VanDerWaalsContact CA-O 3.25Å; E561-T571 WeakPolarHBondContact CA-O 3.48Å; Y562-T571 HydrophobicContact CE1-CG2 3.79Å; Y562-T571 VanDerWaalsContact CZ-CB 3.5Å; Y562-T571 PolarHBondContact N-O 2.85Å; Y562-T571 PolarHBondContact O-N 3.24Å
572	P	98.3	Very high	96.4	Very high	103 Å²	103	47.1 Å²	47.1	67%	0.669	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	149.5	174.5	28.7	-35.1	0	0	0	111.2
573	I	98.4	Very high	96.2	Very high	23 Å²	23	45.8 Å²	45.8	12%	0.118	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	177.4	176.9	57.1	174.3	0	0	0	110.1	Y541 C560 Y562 A575 Y612 D617	Y541-I573 HydrophobicContact CD1-CD1 3.63Å; Y541-I573 HydrophobicContact CE1-CD1 3.92Å; C560-I573 VanDerWaalsContact C-CG1 3.45Å; C560-I573 HydrophobicContact CB-CD1 3.76Å; C560-I573 HydrophobicContact CB-CG1 3.52Å; C560-I573 WeakPolarHBondContact O-CG1 3.47Å; C560-I573 PolarHBondContact O-N 2.87Å; Y562-I573 HydrophobicContact CD1-CG2 3.46Å; Y562-I573 VanDerWaalsContact CD1-CG2 3.46Å; Y562-I573 HydrophobicContact CE1-CG2 3.78Å; I573-A575 PolarHBondContact O-N 3.24Å; I573-Y612 HydrophobicContact CD1-CE1 4Å; I573-Y612 HydrophobicContact CD1-CE2 4.26Å; I573-D617 VanDerWaalsContact CB-OD1 3.31Å; I573-D617 WeakPolarHBondContact CB-OD1 3.21Å
574	A	98.3	Very high	96	Very high	28 Å²	28	45.8 Å²	45.8	23%	0.231	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-51.8	134.7	177.4	0	0	0	0	0	112.3	Y612 D617 W619	A574-Y612 HydrophobicContact CB-CE2 4.39Å; A574-D617 WeakPolarHBondContact CB-O 3.24Å; A574-D617 WeakPolarHBondContact CB-OD1 3.26Å; A574-D617 PolarHBondContact N-OD1 3.21Å; A574-D617 PolarHBondContact N-OD2 3.33Å; A574-W619 PolarHBondContact O-NE1 3.03Å
575	A	97.6	Very high	96	Very high	55 Å²	55	46.4 Å²	46.4	46%	0.455	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-72.7	150.3	179.1	0	0	0	0	0	111.4	L558 I573	L558-A575 HydrophobicContact CB-CB 4.32Å; L558-A575 CarbonylContact O-C 3.57Å; L558-A575 VanDerWaalsContact O-CA 3.28Å; L558-A575 WeakPolarHBondContact O-CA 3.34Å; L558-A575 WeakPolarHBondContact O-CB 3.19Å; I573-A575 PolarHBondContact O-N 3.24Å
576	M	96.2	Very high	96	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.039	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-59.8	149.2	176.1	-58.3	-178.3	73.7	0	0	111.2	I543 G544 L558 C560 R578 Q580 V594 W619	I543-M576 HydrophobicContact CG2-CE 3.82Å; I543-M576 HydrophobicContact CG2-CG 4.03Å; I543-M576 HydrophobicContact CG2-SD 3.48Å; I543-M576 WeakPolarHBondContact CG2-SD 3.41Å; G544-M576 WeakPolarHBondContact CA-SD 3.48Å; G544-M576 PolarHBondContact N-SD 3.02Å; L558-M576 HydrophobicContact CD2-CB 4.46Å; L558-M576 PolarHBondContact O-N 2.81Å; C560-M576 WeakPolarHBondContact SG-CG 3.48Å; M576-R578 VanDerWaalsContact C-N 3.29Å; M576-R578 PolarHBondContact O-N 3.15Å; M576-Q580 HydrophobicContact CE-CB 4.23Å; M576-Q580 HydrophobicContact CE-CG 4.29Å; M576-V594 HydrophobicContact CE-CB 4.37Å; M576-V594 HydrophobicContact CE-CG1 3.99Å; M576-V594 HydrophobicContact CE-CG2 4.34Å; M576-W619 HydrophobicContact CE-CH2 4.43Å; M576-W619 HydrophobicContact CG-CH2 4.21Å; M576-W619 HydrophobicContact CG-CZ2 3.85Å
577	L	93.8	Very high	96	Very high	105 Å²	105	41.6 Å²	41.6	55%	0.55	23%	0.233	S	C	.	.	S	Bend	trans	-69.1	-33.1	175.1	-51.5	172.7	0	0	0	111.4	Q610 W619	L577-Q610 VanDerWaalsContact CB-OE1 3.23Å; L577-W619 HydrophobicContact CD1-CB 4.19Å; L577-W619 HydrophobicContact CD2-CB 3.99Å; L577-W619 HydrophobicContact CG-CB 3.74Å
578	R	91.2	Very high	95.8	Very high	71 Å²	71	36.5 Å²	36.5	27%	0.268	21%	0.206	S	C	.	.	S	Bend	trans	-142.9	142.8	178.4	-168.2	169.4	-179.9	-177.6	-4.5	110.8	M576 N602 V606 Q610	M576-R578 VanDerWaalsContact C-N 3.29Å; M576-R578 PolarHBondContact O-N 3.15Å; R578-N602 PolarHBondContact NH2-ND2 2.83Å; R578-N602 VanDerWaalsContact NH2-ND2 3.13Å; R578-V606 VanDerWaalsContact CZ-CG1 3.48Å; R578-V606 VanDerWaalsContact NH2-CG1 3.33Å; R578-Q610 PolarHBondContact O-NE2 2.94Å
579	G	90.4	Very high	95.5	Very high	3 Å²	3	40 Å²	40	3%	0.031	22%	0.22	C	C	.	.			trans	-65.9	129.6	175.8	0	0	0	0	0	112	L558 S599	L558-G579 VanDerWaalsContact CD2-CA 3.46Å; G579-S599 WeakPolarHBondContact O-CB 3.29Å
580	Q	93.6	Very high	95.4	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.224	C	C	.	.			trans	-139.2	125.3	175.5	-56.3	178.1	-82.5	0	0	110.1	G545 M576 V583 V594 G596 V606 I608 Q610	G545-Q580 PolarHBondContact N-O 3.26Å; M576-Q580 HydrophobicContact CE-CB 4.23Å; M576-Q580 HydrophobicContact CE-CG 4.29Å; Q580-V583 HydrophobicContact CB-CG1 3.28Å; Q580-V583 HydrophobicContact CG-CG1 4.39Å; Q580-V594 HydrophobicContact CB-CG1 4.44Å; Q580-G596 PolarHBondContact NE2-O 3.14Å; Q580-V606 HydrophobicContact CG-CG2 4.06Å; Q580-I608 HydrophobicContact CG-CG2 4.49Å; Q580-I608 VanDerWaalsContact NE2-CG2 3.32Å; Q580-I608 PolarHBondContact NE2-O 2.82Å; Q580-I608 VanDerWaalsContact NE2-O 3.13Å; Q580-Q610 VanDerWaalsContact CD-NE2 3.34Å
581	S	93.9	Very high	95.3	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.007	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-112	157.1	168	-66.1	0	0	0	0	110.7	L530 G545 N546 V583 G597 Y598 W600	L530-S581 WeakPolarHBondContact O-CA 3.37Å; G545-S581 WeakPolarHBondContact CA-OG 3.48Å; G545-S581 PolarHBondContact O-OG 3Å; N546-S581 PolarHBondContact N-OG 2.96Å; S581-V583 VanDerWaalsContact C-N 3.32Å; S581-V583 PolarHBondContact O-N 3.37Å; S581-G597 CarbonylContact O-C 3.58Å; S581-G597 VanDerWaalsContact O-CA 3.24Å; S581-G597 WeakPolarHBondContact O-CA 3.13Å; S581-Y598 PolarHBondContact N-O 3.06Å; S581-Y598 PolarHBondContact O-N 2.92Å; S581-W600 VanDerWaalsContact OG-CD1 3.28Å; S581-W600 PolarHBondContact OG-NE1 2.81Å; S581-W600 VanDerWaalsContact OG-NE1 3.11Å
582	D	91	Very high	95.3	Very high	19 Å²	19	38.2 Å²	38.2	10%	0.102	21%	0.213	C	C	.	.	S	Bend	trans	52.8	50	177.9	-158.1	13.8	0	0	0	112.4	Q384 L530 G631 R633	Q384-D582 VanDerWaalsContact CG-OD2 3.29Å; Q384-D582 WeakPolarHBondContact CG-OD2 3.4Å; Q384-D582 PolarHBondContact NE2-OD2 2.96Å; L530-D582 PolarHBondContact O-N 3.37Å; D582-G631 VanDerWaalsContact O-CA 3.27Å; D582-G631 WeakPolarHBondContact O-CA 3.48Å; D582-G631 PolarHBondContact O-N 2.97Å; D582-G631 WeakPolarHBondContact OD1-CA 3.37Å; D582-G631 WeakPolarHBondContact OD2-CA 3.2Å; D582-G631 PolarHBondContact OD2-N 3.5Å; D582-R633 IonicContact OD1-CZ 2.75Å; D582-R633 IonicContact OD1-NH1 2.66Å; D582-R633 PolarHBondContact OD1-NH1 3.18Å; D582-R633 IonicContact OD1-NH2 3.11Å; D582-R633 PolarHBondContact OD1-NH2 3.23Å
583	V	94.1	Very high	95.3	Very high	9 Å²	9	34 Å²	34	6%	0.055	18%	0.184	C	C	.	.			trans	-91.3	162.5	-173.8	-61	0	0	0	0	112.6	C532 Q580 S581 V594 I632 R633	C532-V583 HydrophobicContact CB-CG2 3.61Å; Q580-V583 HydrophobicContact CB-CG1 3.28Å; Q580-V583 HydrophobicContact CG-CG1 4.39Å; S581-V583 VanDerWaalsContact C-N 3.32Å; S581-V583 PolarHBondContact O-N 3.37Å; V583-V594 HydrophobicContact CB-CG1 3.75Å; V583-V594 HydrophobicContact CG1-CG1 3.71Å; V583-V594 HydrophobicContact CG2-CG1 3.82Å; V583-I632 CarbonylContact C-O 3.58Å; V583-I632 VanDerWaalsContact C-O 3.24Å; V583-R633 PolarHBondContact O-NH1 3.01Å
584	G	95.5	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	138.1	155	0	0	0	0	0	110	V594 V595 I632	G584-V594 WeakPolarHBondContact O-CA 3.29Å; G584-V595 PolarHBondContact N-O 2.92Å; G584-V595 PolarHBondContact O-N 3.18Å; G584-I632 WeakPolarHBondContact CA-O 3.38Å; G584-I632 PolarHBondContact N-O 2.94Å; G584-I632 VanDerWaalsContact N-O 3.11Å
585	V	97.1	Very high	95.1	Very high	33 Å²	33	31.6 Å²	31.6	20%	0.2	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.9	172.7	64.8	0	0	0	0	110.2	C532 C534 I592 Y593	C532-V585 HydrophobicContact CB-CB 3.88Å; C532-V585 HydrophobicContact CB-CG1 3.77Å; C532-V585 HydrophobicContact CB-CG2 4.48Å; C534-V585 HydrophobicContact CB-CG2 4.1Å; V585-I592 HydrophobicContact CG2-CG2 3.82Å; V585-Y593 WeakPolarHBondContact CA-O 3.33Å
586	A	97.5	Very high	94.9	Very high	4 Å²	4	29 Å²	29	3%	0.033	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.5	175.2	0	0	0	0	0	110.3	L345 Y593 A634 T636	L345-A586 HydrophobicContact CD1-CB 3.36Å; A586-Y593 PolarHBondContact N-O 3.09Å; A586-Y593 PolarHBondContact O-N 3.05Å; A586-A634 HydrophobicContact CB-CB 4.13Å; A586-T636 HydrophobicContact CB-CG2 4.38Å
587	V	97.1	Very high	94.8	Very high	44 Å²	44	28.6 Å²	28.6	27%	0.267	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	117.4	171.1	178.2	0	0	0	0	107.5	C534 V536 K591 T636	C534-V587 HydrophobicContact CB-CG2 3.96Å; V536-V587 HydrophobicContact CG2-CB 4.49Å; V536-V587 HydrophobicContact CG2-CG1 3.84Å; V536-V587 HydrophobicContact CG2-CG2 3.77Å; V587-K591 WeakPolarHBondContact CA-O 3.47Å; V587-T636 WeakPolarHBondContact O-CG2 3.26Å
588	F	95	Very high	94.7	Very high	12 Å²	12	24.7 Å²	24.7	5%	0.053	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	126.8	-177.8	-177.9	-99.6	0	0	0	109	T343 E367 N590 K591 Y593 T636	T343-F588 HydrophobicContact CG2-CD2 4.37Å; T343-F588 HydrophobicContact CG2-CE2 4.18Å; T343-F588 VanDerWaalsContact O-CE2 3.23Å; T343-F588 WeakPolarHBondContact O-CE2 3.38Å; E367-F588 WeakPolarHBondContact OE1-CE1 3.47Å; E367-F588 WeakPolarHBondContact OE1-CZ 3.47Å; F588-N590 VanDerWaalsContact C-N 3.26Å; F588-N590 PolarHBondContact O-N 3.32Å; F588-K591 PolarHBondContact N-O 3.29Å; F588-K591 PolarHBondContact O-N 3.46Å; F588-Y593 HydrophobicContact CB-CD2 3.92Å; F588-Y593 HydrophobicContact CB-CE2 3.81Å; F588-Y593 HydrophobicContact CD1-CE2 4.08Å; F588-Y593 HydrophobicContact CG-CE2 4.45Å; F588-T636 HydrophobicContact CB-CG2 3.86Å; F588-T636 HydrophobicContact CD2-CG2 3.77Å; F588-T636 HydrophobicContact CG-CG2 4.29Å
589	E	91.9	Very high	94.8	Very high	139 Å²	139	21.4 Å²	21.4	65%	0.65	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	43.8	-175.2	-62.4	-172.3	156.4	0	0	113.9	K591	E589-K591 PolarHBondContact O-N 3.38Å; E589-K591 VanDerWaalsContact O-N 3.17Å
590	N	94.8	Very high	94.9	Very high	114 Å²	114	23.7 Å²	23.7	61%	0.61	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	17.5	-176	-61.4	-15.3	0	0	0	115.1	V536 F588 P614	V536-N590 HydrophobicContact CG1-CB 4.4Å; F588-N590 VanDerWaalsContact C-N 3.26Å; F588-N590 PolarHBondContact O-N 3.32Å; N590-P614 WeakPolarHBondContact O-CD 3.46Å
591	K	97.6	Very high	94.7	Very high	30 Å²	30	27.8 Å²	27.8	13%	0.13	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	150.4	172.6	-50.6	-61.5	163	-162.9	0	109.6	V587 F588 E589 Y593 K611 D613 D615	V587-K591 WeakPolarHBondContact CA-O 3.47Å; F588-K591 PolarHBondContact N-O 3.29Å; F588-K591 PolarHBondContact O-N 3.46Å; E589-K591 PolarHBondContact O-N 3.38Å; E589-K591 VanDerWaalsContact O-N 3.17Å; K591-Y593 HydrophobicContact CB-CE2 3.93Å; K591-K611 HydrophobicContact CB-CD 3.99Å; K591-K611 HydrophobicContact CB-CG 3.85Å; K591-K611 HydrophobicContact CG-CD 4.27Å; K591-D613 HydrophobicContact CD-CB 3.97Å; K591-D613 WeakPolarHBondContact CE-OD2 3.49Å; K591-D613 IonicContact NZ-OD1 3.24Å; K591-D613 PolarHBondContact NZ-OD1 3.13Å; K591-D613 IonicContact NZ-OD2 3.96Å; K591-D613 PolarHBondContact NZ-OD2 2.87Å; K591-D613 VanDerWaalsContact NZ-OD2 3.11Å; K591-D615 IonicContact NZ-OD2 3.91Å; K591-D615 PolarHBondContact NZ-OD2 3.21Å
592	I	98.4	Very high	94.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123	-178.4	-54.3	171.4	0	0	0	108.4	C534 V536 Y541 I543 V585 K611 Y612	C534-I592 VanDerWaalsContact SG-CG2 3.57Å; V536-I592 HydrophobicContact CG2-CD1 3.83Å; V536-I592 HydrophobicContact CG2-CG1 3.55Å; Y541-I592 HydrophobicContact CD1-CD1 3.9Å; Y541-I592 HydrophobicContact CD2-CD1 3.74Å; Y541-I592 HydrophobicContact CE1-CD1 4.49Å; Y541-I592 HydrophobicContact CE2-CD1 4.35Å; Y541-I592 HydrophobicContact CG-CD1 3.5Å; Y541-I592 VanDerWaalsContact CG-CD1 3.5Å; I543-I592 HydrophobicContact CD1-CB 4.47Å; I543-I592 HydrophobicContact CD1-CD1 4Å; I543-I592 HydrophobicContact CD1-CG2 3.73Å; V585-I592 HydrophobicContact CG2-CG2 3.82Å; I592-K611 CarbonylContact O-C 3.57Å; I592-K611 VanDerWaalsContact O-CA 3.27Å; I592-K611 WeakPolarHBondContact O-CA 3.2Å; I592-Y612 HydrophobicContact CD1-CD1 3.97Å; I592-Y612 PolarHBondContact N-O 3.04Å; I592-Y612 PolarHBondContact O-N 3.38Å
593	Y	97.8	Very high	94.3	Very high	15 Å²	15	40.6 Å²	40.6	6%	0.059	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.5	176.5	-70.8	-106.8	0	0	0	109.4	L345 V585 A586 F588 K591 V609 Q610 K611 V622 F623	L345-Y593 HydrophobicContact CD2-CD1 4.32Å; V585-Y593 WeakPolarHBondContact CA-O 3.33Å; A586-Y593 PolarHBondContact N-O 3.09Å; A586-Y593 PolarHBondContact O-N 3.05Å; F588-Y593 HydrophobicContact CB-CD2 3.92Å; F588-Y593 HydrophobicContact CB-CE2 3.81Å; F588-Y593 HydrophobicContact CD1-CE2 4.08Å; F588-Y593 HydrophobicContact CG-CE2 4.45Å; K591-Y593 HydrophobicContact CB-CE2 3.93Å; Y593-V609 HydrophobicContact CD1-CG1 3.95Å; Y593-Q610 CarbonylContact C-O 3.59Å; Y593-Q610 WeakPolarHBondContact CA-O 3.27Å; Y593-K611 HydrophobicContact CD1-CB 4.27Å; Y593-K611 HydrophobicContact CD2-CG 4.42Å; Y593-K611 HydrophobicContact CE1-CB 4.14Å; Y593-K611 HydrophobicContact CE1-CD 3.99Å; Y593-K611 HydrophobicContact CE1-CG 4.16Å; Y593-K611 HydrophobicContact CE2-CD 3.99Å; Y593-K611 HydrophobicContact CE2-CG 4.02Å; Y593-K611 WeakPolarHBondContact OH-CD 3.5Å; Y593-V622 HydrophobicContact CE1-CG2 4.33Å; Y593-F623 HydrophobicContact CE1-CE1 4.5Å; Y593-F623 HydrophobicContact CE1-CZ 4.33Å
594	V	97.3	Very high	94	Very high	1 Å²	1	42 Å²	42	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.2	173.6	-174.4	0	0	0	0	108.4	I543 M576 Q580 V583 G584 V609 Q610 W619	I543-V594 HydrophobicContact CG2-CG2 3.87Å; M576-V594 HydrophobicContact CE-CB 4.37Å; M576-V594 HydrophobicContact CE-CG1 3.99Å; M576-V594 HydrophobicContact CE-CG2 4.34Å; Q580-V594 HydrophobicContact CB-CG1 4.44Å; V583-V594 HydrophobicContact CB-CG1 3.75Å; V583-V594 HydrophobicContact CG1-CG1 3.71Å; V583-V594 HydrophobicContact CG2-CG1 3.82Å; G584-V594 WeakPolarHBondContact O-CA 3.29Å; V594-V609 WeakPolarHBondContact O-CA 3.17Å; V594-Q610 PolarHBondContact N-O 3.45Å; V594-Q610 PolarHBondContact O-N 3.12Å; V594-W619 HydrophobicContact CG2-CH2 3.8Å; V594-W619 HydrophobicContact CG2-CZ3 3.9Å
595	V	95.3	Very high	93.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.4	-163.5	-179.9	0	0	0	0	110	L345 T347 G584 V609 L625 I632 A634	L345-V595 HydrophobicContact CD2-CG2 4.28Å; T347-V595 HydrophobicContact CG2-CG1 3.74Å; G584-V595 PolarHBondContact N-O 2.92Å; G584-V595 PolarHBondContact O-N 3.18Å; V595-V609 HydrophobicContact CB-CG2 4.48Å; V595-V609 HydrophobicContact CG1-CG2 4.1Å; V595-V609 HydrophobicContact CG2-CG1 3.96Å; V595-V609 HydrophobicContact CG2-CG2 4.27Å; V595-L625 HydrophobicContact CG1-CD1 3.72Å; V595-L625 HydrophobicContact CG1-CD2 3.68Å; V595-L625 HydrophobicContact CG1-CG 3.9Å; V595-I632 HydrophobicContact CG1-CD1 4.42Å; V595-I632 VanDerWaalsContact O-CG2 3.23Å; V595-I632 WeakPolarHBondContact O-CG2 3.46Å; V595-A634 HydrophobicContact CB-CB 4.32Å; V595-A634 HydrophobicContact CG2-CB 4.13Å
596	G	93.8	Very high	93.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.			trans	65.9	-143	171.6	0	0	0	0	0	114.5	Q580 V606 I608	Q580-G596 PolarHBondContact NE2-O 3.14Å; G596-V606 CarbonylContact C-O 3.57Å; G596-V606 WeakPolarHBondContact CA-O 3.45Å; G596-V606 WeakPolarHBondContact O-CG2 3.28Å; G596-I608 PolarHBondContact N-O 3.01Å; G596-I608 VanDerWaalsContact N-O 3.16Å
597	G	93.6	Very high	93.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.214	C	C	.	.			trans	95.2	-162.8	177.1	0	0	0	0	0	114	S581 M605 V606 L629	S581-G597 CarbonylContact O-C 3.58Å; S581-G597 VanDerWaalsContact O-CA 3.24Å; S581-G597 WeakPolarHBondContact O-CA 3.13Å; G597-M605 WeakPolarHBondContact O-CA 3.37Å; G597-V606 PolarHBondContact O-N 3.1Å; G597-L629 PolarHBondContact N-O 3.43Å
598	Y	92.4	Very high	93	Very high	23 Å²	23	43.3 Å²	43.3	9%	0.09	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134	-176.2	-171.2	-102.8	0	0	0	110.8	R353 S581 W600 R603 C604 M605	R353-Y598 PolarHBondContact NH1-OH 2.91Å; R353-Y598 VanDerWaalsContact NH1-OH 3.08Å; S581-Y598 PolarHBondContact N-O 3.06Å; S581-Y598 PolarHBondContact O-N 2.92Å; Y598-W600 AromaticContact CD1-CD2 3.76Å; Y598-W600 HydrophobicContact CD1-CD2 3.76Å; Y598-W600 AromaticContact CD1-CE2 3.76Å; Y598-W600 HydrophobicContact CD1-CE3 4.25Å; Y598-W600 AromaticContact CD1-CG 4Å; Y598-W600 HydrophobicContact CD1-CG 4Å; Y598-W600 HydrophobicContact CD1-CZ2 4.3Å; Y598-W600 AromaticContact CD1-NE1 3.92Å; Y598-W600 AromaticContact CE1-CD2 3.66Å; Y598-W600 HydrophobicContact CE1-CD2 3.66Å; Y598-W600 AromaticContact CE1-CE3 3.69Å; Y598-W600 HydrophobicContact CE1-CE3 3.69Å; Y598-W600 HydrophobicContact CE1-CG 4.1Å; Y598-W600 HydrophobicContact CE1-CZ2 4.48Å; Y598-W600 HydrophobicContact CE1-CZ3 4.16Å; Y598-R603 VanDerWaalsContact CZ-C 3.43Å; Y598-R603 WeakPolarHBondContact OH-CA 3.23Å; Y598-R603 PolarHBondContact OH-O 3.25Å; Y598-C604 VanDerWaalsContact CD2-C 3.43Å; Y598-C604 VanDerWaalsContact CD2-O 3.28Å; Y598-C604 WeakPolarHBondContact CD2-O 3.32Å; Y598-M605 HydrophobicContact CD2-CE 3.83Å; Y598-M605 HydrophobicContact CD2-CG 4.31Å; Y598-M605 HydrophobicContact CD2-SD 3.57Å; Y598-M605 VanDerWaalsContact CD2-SD 3.57Å; Y598-M605 HydrophobicContact CG-SD 4.22Å
599	S	93.3	Very high	92.9	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.014	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121	167.5	170.2	0	0	0	0	108.9	D556 G579 N602 R603 C604	D556-S599 PolarHBondContact OD2-OG 3.46Å; G579-S599 WeakPolarHBondContact O-CB 3.29Å; S599-N602 PolarHBondContact OG-N 2.79Å; S599-R603 VanDerWaalsContact O-CA 3.25Å; S599-R603 WeakPolarHBondContact O-CA 3.31Å; S599-R603 PolarHBondContact O-N 3.42Å; S599-C604 PolarHBondContact N-O 3.34Å; S599-C604 PolarHBondContact O-N 2.85Å
600	W	91.2	Very high	93.2	Very high	51 Å²	51	36.1 Å²	36.1	19%	0.193	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-36.2	178	-70.4	93.4	0	0	0	112.2	L530 N546 Y554 D556 S581 Y598 N602 R603	L530-W600 HydrophobicContact CD1-CZ2 4.32Å; N546-W600 VanDerWaalsContact CB-CD1 3.48Å; N546-W600 HydrophobicContact CB-CG 4.17Å; N546-W600 WeakPolarHBondContact ND2-CZ2 3.44Å; N546-W600 PolarHBondContact ND2-NE1 3.11Å; Y554-W600 HydrophobicContact CD1-CD2 4.41Å; Y554-W600 HydrophobicContact CD1-CE3 4.28Å; Y554-W600 HydrophobicContact CD1-CH2 4.21Å; Y554-W600 HydrophobicContact CD1-CZ2 4.39Å; Y554-W600 HydrophobicContact CD1-CZ3 4.17Å; Y554-W600 AromaticContact CD2-CE3 3.83Å; Y554-W600 HydrophobicContact CD2-CE3 3.83Å; Y554-W600 HydrophobicContact CD2-CH2 4.07Å; Y554-W600 AromaticContact CD2-CZ3 3.44Å; Y554-W600 HydrophobicContact CD2-CZ3 3.44Å; Y554-W600 VanDerWaalsContact CD2-CZ3 3.44Å; Y554-W600 HydrophobicContact CE1-CH2 4.31Å; Y554-W600 HydrophobicContact CE2-CH2 4.22Å; Y554-W600 AromaticContact CE2-CZ3 3.96Å; Y554-W600 HydrophobicContact CE2-CZ3 3.96Å; Y554-W600 HydrophobicContact CG-CD2 4.03Å; Y554-W600 AromaticContact CG-CE3 3.55Å; Y554-W600 HydrophobicContact CG-CE3 3.55Å; Y554-W600 HydrophobicContact CG-CH2 4.05Å; Y554-W600 AromaticContact CG-CZ3 3.55Å; Y554-W600 HydrophobicContact CG-CZ3 3.55Å; D556-W600 VanDerWaalsContact CG-N 3.33Å; D556-W600 WeakPolarHBondContact OD1-CB 3.24Å; D556-W600 PolarHBondContact OD1-N 2.87Å; D556-W600 PolarHBondContact OD2-N 2.91Å; D556-W600 VanDerWaalsContact OD2-N 3.12Å; S581-W600 VanDerWaalsContact OG-CD1 3.28Å; S581-W600 PolarHBondContact OG-NE1 2.81Å; S581-W600 VanDerWaalsContact OG-NE1 3.11Å; Y598-W600 AromaticContact CD1-CD2 3.76Å; Y598-W600 HydrophobicContact CD1-CD2 3.76Å; Y598-W600 AromaticContact CD1-CE2 3.76Å; Y598-W600 HydrophobicContact CD1-CE3 4.25Å; Y598-W600 AromaticContact CD1-CG 4Å; Y598-W600 HydrophobicContact CD1-CG 4Å; Y598-W600 HydrophobicContact CD1-CZ2 4.3Å; Y598-W600 AromaticContact CD1-NE1 3.92Å; Y598-W600 AromaticContact CE1-CD2 3.66Å; Y598-W600 HydrophobicContact CE1-CD2 3.66Å; Y598-W600 AromaticContact CE1-CE3 3.69Å; Y598-W600 HydrophobicContact CE1-CE3 3.69Å; Y598-W600 HydrophobicContact CE1-CG 4.1Å; Y598-W600 HydrophobicContact CE1-CZ2 4.48Å; Y598-W600 HydrophobicContact CE1-CZ3 4.16Å; W600-N602 PolarHBondContact O-N 2.81Å; W600-R603 WeakPolarHBondContact O-CG 3.26Å; W600-R603 PolarHBondContact O-N 3.05Å
601	N	90.3	Very high	93.3	Very high	87 Å²	87	33.3 Å²	33.3	47%	0.465	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-39.7	178.7	-73.8	-16.4	0	0	0	111.8	D555 D556	D555-N601 PolarHBondContact OD1-ND2 2.9Å; D555-N601 PolarHBondContact OD1-OD1 2.93Å; D556-N601 WeakPolarHBondContact OD2-CB 3.23Å; D556-N601 PolarHBondContact OD2-N 2.98Å
602	N	88.1	Confident	93.3	Very high	97 Å²	97	32 Å²	32	52%	0.519	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-6.1	177.4	-63.1	-7.3	0	0	0	113.1	R578 S599 W600 C604	R578-N602 PolarHBondContact NH2-ND2 2.83Å; R578-N602 VanDerWaalsContact NH2-ND2 3.13Å; S599-N602 PolarHBondContact OG-N 2.79Å; W600-N602 PolarHBondContact O-N 2.81Å; N602-C604 PolarHBondContact O-N 3.03Å; N602-C604 VanDerWaalsContact O-N 3.15Å
603	R	88.3	Confident	93.3	Very high	191 Å²	191	32.9 Å²	32.9	72%	0.721	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	30.4	-178.6	-58.3	-178.3	178	-175.2	-2	114.4	Y598 S599 W600	Y598-R603 VanDerWaalsContact CZ-C 3.43Å; Y598-R603 WeakPolarHBondContact OH-CA 3.23Å; Y598-R603 PolarHBondContact OH-O 3.25Å; S599-R603 VanDerWaalsContact O-CA 3.25Å; S599-R603 WeakPolarHBondContact O-CA 3.31Å; S599-R603 PolarHBondContact O-N 3.42Å; W600-R603 WeakPolarHBondContact O-CG 3.26Å; W600-R603 PolarHBondContact O-N 3.05Å
604	C	88.6	Confident	93.3	Very high	39 Å²	39	32.9 Å²	32.9	26%	0.264	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.5	-176.3	66.3	0	0	0	0	112.8	Y598 S599 N602	Y598-C604 VanDerWaalsContact CD2-C 3.43Å; Y598-C604 VanDerWaalsContact CD2-O 3.28Å; Y598-C604 WeakPolarHBondContact CD2-O 3.32Å; S599-C604 PolarHBondContact N-O 3.34Å; S599-C604 PolarHBondContact O-N 2.85Å; N602-C604 PolarHBondContact O-N 3.03Å; N602-C604 VanDerWaalsContact O-N 3.15Å
605	M	90	Very high	93.3	Very high	31 Å²	31	39.3 Å²	39.3	15%	0.153	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	147.7	164.1	-64.3	-58.3	176	0	0	109	V351 R353 G597 Y598 S628 G630	V351-M605 HydrophobicContact CG1-CE 4.28Å; R353-M605 HydrophobicContact CB-CE 3.55Å; R353-M605 HydrophobicContact CB-CG 4.15Å; R353-M605 HydrophobicContact CG-CE 4.3Å; G597-M605 WeakPolarHBondContact O-CA 3.37Å; Y598-M605 HydrophobicContact CD2-CE 3.83Å; Y598-M605 HydrophobicContact CD2-CG 4.31Å; Y598-M605 HydrophobicContact CD2-SD 3.57Å; Y598-M605 VanDerWaalsContact CD2-SD 3.57Å; Y598-M605 HydrophobicContact CG-SD 4.22Å; M605-S628 VanDerWaalsContact CB-O 3.26Å; M605-S628 WeakPolarHBondContact CB-O 3.45Å; M605-G630 WeakPolarHBondContact SD-CA 3.4Å; M605-G630 PolarHBondContact SD-N 3.08Å
606	V	90.7	Very high	93.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.216	C	C	.	.			trans	-123.7	142.5	-180	-59.1	0	0	0	0	110.2	R578 Q580 G596 G597 I608	R578-V606 VanDerWaalsContact CZ-CG1 3.48Å; R578-V606 VanDerWaalsContact NH2-CG1 3.33Å; Q580-V606 HydrophobicContact CG-CG2 4.06Å; G596-V606 CarbonylContact C-O 3.57Å; G596-V606 WeakPolarHBondContact CA-O 3.45Å; G596-V606 WeakPolarHBondContact O-CG2 3.28Å; G597-V606 PolarHBondContact O-N 3.1Å; V606-I608 HydrophobicContact CB-CG2 4.04Å; V606-I608 HydrophobicContact CG2-CG2 3.86Å
607	E	91.3	Very high	93.6	Very high	63 Å²	63	48.8 Å²	48.8	29%	0.294	23%	0.233	S	C	.	.			trans	-92.5	-10.3	176.8	61.3	-75.7	170.9	0	0	112.5	V609 D624 L625 S628	E607-V609 PolarHBondContact O-N 2.72Å; E607-D624 HydrophobicContact CB-CB 4.35Å; E607-D624 HydrophobicContact CG-CB 3.86Å; E607-D624 CarbonylContact O-C 3.53Å; E607-D624 WeakPolarHBondContact O-CA 3.29Å; E607-L625 HydrophobicContact CB-CB 4.16Å; E607-L625 PolarHBondContact O-N 2.89Å; E607-S628 WeakPolarHBondContact OE2-CB 3.26Å; E607-S628 PolarHBondContact OE2-OG 2.72Å
608	I	92.7	Very high	93.8	Very high	15 Å²	15	53.2 Å²	53.2	8%	0.077	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	135.8	-172.2	-168.7	174.6	0	0	0	112.6	Q580 G596 V606 Q610 K621	Q580-I608 HydrophobicContact CG-CG2 4.49Å; Q580-I608 VanDerWaalsContact NE2-CG2 3.32Å; Q580-I608 PolarHBondContact NE2-O 2.82Å; Q580-I608 VanDerWaalsContact NE2-O 3.13Å; G596-I608 PolarHBondContact N-O 3.01Å; G596-I608 VanDerWaalsContact N-O 3.16Å; V606-I608 HydrophobicContact CB-CG2 4.04Å; V606-I608 HydrophobicContact CG2-CG2 3.86Å; I608-Q610 HydrophobicContact CD1-CG 3.85Å; I608-Q610 HydrophobicContact CG1-CG 4.01Å; I608-K621 HydrophobicContact CD1-CB 4.43Å; I608-K621 HydrophobicContact CD1-CD 4.07Å; I608-K621 HydrophobicContact CD1-CG 4.1Å; I608-K621 HydrophobicContact CG1-CD 4.17Å; I608-K621 HydrophobicContact CG1-CG 4.02Å
609	V	94.8	Very high	94.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118	163.6	-175.5	0	0	0	0	109.6	Y593 V594 V595 E607 V622 F623 L625	Y593-V609 HydrophobicContact CD1-CG1 3.95Å; V594-V609 WeakPolarHBondContact O-CA 3.17Å; V595-V609 HydrophobicContact CB-CG2 4.48Å; V595-V609 HydrophobicContact CG1-CG2 4.1Å; V595-V609 HydrophobicContact CG2-CG1 3.96Å; V595-V609 HydrophobicContact CG2-CG2 4.27Å; E607-V609 PolarHBondContact O-N 2.72Å; V609-V622 PolarHBondContact O-N 2.87Å; V609-F623 HydrophobicContact CB-CD2 3.91Å; V609-F623 HydrophobicContact CB-CE2 3.96Å; V609-F623 WeakPolarHBondContact CB-O 3.34Å; V609-F623 HydrophobicContact CG1-CD2 4.31Å; V609-F623 HydrophobicContact CG1-CE2 3.86Å; V609-F623 HydrophobicContact CG1-CZ 4.31Å; V609-F623 HydrophobicContact CG2-CD2 3.78Å; V609-F623 HydrophobicContact CG2-CE2 3.83Å; V609-F623 WeakPolarHBondContact CG2-O 3.45Å; V609-F623 PolarHBondContact N-O 3.31Å; V609-L625 HydrophobicContact CG2-CG 4.34Å
610	Q	96.2	Very high	94.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135.9	176.1	-62	-173.7	77	0	0	109.7	L577 R578 Q580 Y593 V594 I608 W619 H620	L577-Q610 VanDerWaalsContact CB-OE1 3.23Å; R578-Q610 PolarHBondContact O-NE2 2.94Å; Q580-Q610 VanDerWaalsContact CD-NE2 3.34Å; Y593-Q610 CarbonylContact C-O 3.59Å; Y593-Q610 WeakPolarHBondContact CA-O 3.27Å; V594-Q610 PolarHBondContact N-O 3.45Å; V594-Q610 PolarHBondContact O-N 3.12Å; I608-Q610 HydrophobicContact CD1-CG 3.85Å; I608-Q610 HydrophobicContact CG1-CG 4.01Å; Q610-W619 HydrophobicContact CB-CE3 3.82Å; Q610-W619 HydrophobicContact CB-CZ3 3.86Å; Q610-H620 CarbonylContact C-O 3.5Å; Q610-H620 WeakPolarHBondContact CA-O 3.25Å
611	K	97.3	Very high	94.4	Very high	55 Å²	55	59.7 Å²	59.7	24%	0.239	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126	175	178.9	-175.6	75.1	177	0	110	K591 I592 Y593 W619 H620 V622	K591-K611 HydrophobicContact CB-CD 3.99Å; K591-K611 HydrophobicContact CB-CG 3.85Å; K591-K611 HydrophobicContact CG-CD 4.27Å; I592-K611 CarbonylContact O-C 3.57Å; I592-K611 VanDerWaalsContact O-CA 3.27Å; I592-K611 WeakPolarHBondContact O-CA 3.2Å; Y593-K611 HydrophobicContact CD1-CB 4.27Å; Y593-K611 HydrophobicContact CD2-CG 4.42Å; Y593-K611 HydrophobicContact CE1-CB 4.14Å; Y593-K611 HydrophobicContact CE1-CD 3.99Å; Y593-K611 HydrophobicContact CE1-CG 4.16Å; Y593-K611 HydrophobicContact CE2-CD 3.99Å; Y593-K611 HydrophobicContact CE2-CG 4.02Å; Y593-K611 WeakPolarHBondContact OH-CD 3.5Å; K611-W619 CarbonylContact O-C 3.55Å; K611-W619 WeakPolarHBondContact O-CA 3.4Å; K611-H620 PolarHBondContact N-O 3.24Å; K611-H620 PolarHBondContact O-N 2.87Å; K611-V622 HydrophobicContact CB-CG2 3.3Å; K611-V622 HydrophobicContact CD-CG2 4.27Å; K611-V622 HydrophobicContact CG-CG2 4.39Å
612	Y	98.6	Very high	94.5	Very high	3 Å²	3	58.4 Å²	58.4	1%	0.012	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	134.3	169.7	178.5	-107.5	0	0	0	110.5	Y541 I573 A574 I592 P614 D617 E618 W619	Y541-Y612 HydrophobicContact CD1-CE1 4.1Å; Y541-Y612 AromaticContact CE1-CE1 3.68Å; Y541-Y612 HydrophobicContact CE1-CE1 3.68Å; I573-Y612 HydrophobicContact CD1-CE1 4Å; I573-Y612 HydrophobicContact CD1-CE2 4.26Å; A574-Y612 HydrophobicContact CB-CE2 4.39Å; I592-Y612 HydrophobicContact CD1-CD1 3.97Å; I592-Y612 PolarHBondContact N-O 3.04Å; I592-Y612 PolarHBondContact O-N 3.38Å; Y612-P614 HydrophobicContact CD1-CG 3.92Å; Y612-P614 HydrophobicContact CE1-CB 4.08Å; Y612-P614 HydrophobicContact CE1-CG 3.9Å; Y612-P614 WeakPolarHBondContact O-CD 3.42Å; Y612-D617 VanDerWaalsContact CE2-OD1 3.3Å; Y612-D617 WeakPolarHBondContact CE2-OD1 3.32Å; Y612-D617 PolarHBondContact OH-OD1 2.94Å; Y612-E618 WeakPolarHBondContact CA-O 3.21Å; Y612-W619 AromaticContact CD2-CD1 3.75Å; Y612-W619 AromaticContact CD2-CD2 3.9Å; Y612-W619 HydrophobicContact CD2-CD2 3.9Å; Y612-W619 AromaticContact CD2-CE2 3.55Å; Y612-W619 HydrophobicContact CD2-CG 4.04Å; Y612-W619 HydrophobicContact CD2-CZ2 4.06Å; Y612-W619 AromaticContact CD2-NE1 3.43Å; Y612-W619 AromaticContact CE2-NE1 3.98Å; Y612-W619 HydrophobicContact CG-CD2 4.3Å; Y612-W619 AromaticContact CG-CE2 3.96Å; Y612-W619 HydrophobicContact CG-CH2 4.43Å; Y612-W619 HydrophobicContact CG-CZ2 4.04Å
613	D	98.1	Very high	94.5	Very high	17 Å²	17	55.2 Å²	55.2	9%	0.091	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	105.2	173.1	-171.5	-33.9	0	0	0	110.4	K591 D615 K616 D617 E618	K591-D613 HydrophobicContact CD-CB 3.97Å; K591-D613 WeakPolarHBondContact CE-OD2 3.49Å; K591-D613 IonicContact NZ-OD1 3.24Å; K591-D613 PolarHBondContact NZ-OD1 3.13Å; K591-D613 IonicContact NZ-OD2 3.96Å; K591-D613 PolarHBondContact NZ-OD2 2.87Å; K591-D613 VanDerWaalsContact NZ-OD2 3.11Å; D613-D615 PolarHBondContact O-N 2.91Å; D613-D615 WeakPolarHBondContact OD1-CB 3.37Å; D613-D615 PolarHBondContact OD1-N 3.15Å; D613-K616 HydrophobicContact CB-CB 4.27Å; D613-K616 PolarHBondContact O-N 3.28Å; D613-K616 PolarHBondContact OD1-N 3.48Å; D613-D617 WeakPolarHBondContact O-CA 3.35Å; D613-D617 PolarHBondContact O-N 3.49Å; D613-E618 PolarHBondContact N-O 2.63Å; D613-E618 PolarHBondContact O-N 3.26Å
614	P	97.7	Very high	94.7	Very high	15 Å²	15	49.1 Å²	49.1	10%	0.097	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.5	179.4	-26.1	37.2	0	0	0	115.7	V536 N590 Y612	V536-P614 HydrophobicContact CG1-CG 4.26Å; N590-P614 WeakPolarHBondContact O-CD 3.46Å; Y612-P614 HydrophobicContact CD1-CG 3.92Å; Y612-P614 HydrophobicContact CE1-CB 4.08Å; Y612-P614 HydrophobicContact CE1-CG 3.9Å; Y612-P614 WeakPolarHBondContact O-CD 3.42Å
615	D	97.3	Very high	94.8	Very high	136 Å²	136	47.7 Å²	47.7	73%	0.727	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-30.6	-178.7	-58.1	-46.5	0	0	0	111	K591 D613	K591-D615 IonicContact NZ-OD2 3.91Å; K591-D615 PolarHBondContact NZ-OD2 3.21Å; D613-D615 PolarHBondContact O-N 2.91Å; D613-D615 WeakPolarHBondContact OD1-CB 3.37Å; D613-D615 PolarHBondContact OD1-N 3.15Å
616	K	97.7	Very high	94.6	Very high	133 Å²	133	49.8 Å²	49.8	58%	0.578	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-16.5	-179.1	-62.1	-176.7	-178.7	-179.3	0	114	D613 E618	D613-K616 HydrophobicContact CB-CB 4.27Å; D613-K616 PolarHBondContact O-N 3.28Å; D613-K616 PolarHBondContact OD1-N 3.48Å; K616-E618 HydrophobicContact CB-CB 4.25Å; K616-E618 HydrophobicContact CB-CG 4.17Å
617	D	98.1	Very high	94.5	Very high	67 Å²	67	52.8 Å²	52.8	36%	0.358	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	50.3	-169.3	-168	27.6	0	0	0	112.6	I573 A574 Y612 D613	I573-D617 VanDerWaalsContact CB-OD1 3.31Å; I573-D617 WeakPolarHBondContact CB-OD1 3.21Å; A574-D617 WeakPolarHBondContact CB-O 3.24Å; A574-D617 WeakPolarHBondContact CB-OD1 3.26Å; A574-D617 PolarHBondContact N-OD1 3.21Å; A574-D617 PolarHBondContact N-OD2 3.33Å; Y612-D617 VanDerWaalsContact CE2-OD1 3.3Å; Y612-D617 WeakPolarHBondContact CE2-OD1 3.32Å; Y612-D617 PolarHBondContact OH-OD1 2.94Å; D613-D617 WeakPolarHBondContact O-CA 3.35Å; D613-D617 PolarHBondContact O-N 3.49Å
618	E	98	Very high	94.4	Very high	93 Å²	93	51.7 Å²	51.7	44%	0.435	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	143.9	-174.3	-72.5	176.7	169.5	0	0	112.8	Y612 D613 K616 H620	Y612-E618 WeakPolarHBondContact CA-O 3.21Å; D613-E618 PolarHBondContact N-O 2.63Å; D613-E618 PolarHBondContact O-N 3.26Å; K616-E618 HydrophobicContact CB-CB 4.25Å; K616-E618 HydrophobicContact CB-CG 4.17Å; E618-H620 IonicContact OE2-CE1 2.72Å
619	W	98.3	Very high	94.3	Very high	20 Å²	20	51.2 Å²	51.2	8%	0.076	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	141.1	174.4	-72.8	93.6	0	0	0	112.1	I543 A574 M576 L577 V594 Q610 K611 Y612	I543-W619 HydrophobicContact CD1-CH2 4.01Å; I543-W619 HydrophobicContact CD1-CZ2 4.25Å; I543-W619 HydrophobicContact CG1-CH2 4.45Å; I543-W619 HydrophobicContact CG1-CZ2 4.37Å; I543-W619 HydrophobicContact CG2-CH2 3.64Å; I543-W619 HydrophobicContact CG2-CZ2 3.92Å; A574-W619 PolarHBondContact O-NE1 3.03Å; M576-W619 HydrophobicContact CE-CH2 4.43Å; M576-W619 HydrophobicContact CG-CH2 4.21Å; M576-W619 HydrophobicContact CG-CZ2 3.85Å; L577-W619 HydrophobicContact CD1-CB 4.19Å; L577-W619 HydrophobicContact CD2-CB 3.99Å; L577-W619 HydrophobicContact CG-CB 3.74Å; V594-W619 HydrophobicContact CG2-CH2 3.8Å; V594-W619 HydrophobicContact CG2-CZ3 3.9Å; Q610-W619 HydrophobicContact CB-CE3 3.82Å; Q610-W619 HydrophobicContact CB-CZ3 3.86Å; K611-W619 CarbonylContact O-C 3.55Å; K611-W619 WeakPolarHBondContact O-CA 3.4Å; Y612-W619 AromaticContact CD2-CD1 3.75Å; Y612-W619 AromaticContact CD2-CD2 3.9Å; Y612-W619 HydrophobicContact CD2-CD2 3.9Å; Y612-W619 AromaticContact CD2-CE2 3.55Å; Y612-W619 HydrophobicContact CD2-CG 4.04Å; Y612-W619 HydrophobicContact CD2-CZ2 4.06Å; Y612-W619 AromaticContact CD2-NE1 3.43Å; Y612-W619 AromaticContact CE2-NE1 3.98Å; Y612-W619 HydrophobicContact CG-CD2 4.3Å; Y612-W619 AromaticContact CG-CE2 3.96Å; Y612-W619 HydrophobicContact CG-CH2 4.43Å; Y612-W619 HydrophobicContact CG-CZ2 4.04Å
620	H	96.9	Very high	94	Very high	77 Å²	77	51.2 Å²	51.2	36%	0.356	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	136.4	177.5	-62.1	77	0	0	0	110.1	Q610 K611 E618	Q610-H620 CarbonylContact C-O 3.5Å; Q610-H620 WeakPolarHBondContact CA-O 3.25Å; K611-H620 PolarHBondContact N-O 3.24Å; K611-H620 PolarHBondContact O-N 2.87Å; E618-H620 IonicContact OE2-CE1 2.72Å
621	K	94.6	Very high	93.7	Very high	115 Å²	115	51.2 Å²	51.2	50%	0.5	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	132.6	160	178.6	178	176.4	178.1	0	107.7	I608 D624	I608-K621 HydrophobicContact CD1-CB 4.43Å; I608-K621 HydrophobicContact CD1-CD 4.07Å; I608-K621 HydrophobicContact CD1-CG 4.1Å; I608-K621 HydrophobicContact CG1-CD 4.17Å; I608-K621 HydrophobicContact CG1-CG 4.02Å; K621-D624 WeakPolarHBondContact CE-OD1 3.35Å; K621-D624 WeakPolarHBondContact CE-OD2 3.48Å; K621-D624 VanDerWaalsContact NZ-CG 3.32Å; K621-D624 IonicContact NZ-OD1 3.37Å; K621-D624 PolarHBondContact NZ-OD1 2.98Å; K621-D624 IonicContact NZ-OD2 3.94Å; K621-D624 PolarHBondContact NZ-OD2 2.77Å
622	V	91.3	Very high	93.5	Very high	60 Å²	60	48.8 Å²	48.8	36%	0.364	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-66.3	-178.6	-157.6	0	0	0	0	111.6	Y593 V609 K611	Y593-V622 HydrophobicContact CE1-CG2 4.33Å; V609-V622 PolarHBondContact O-N 2.87Å; K611-V622 HydrophobicContact CB-CG2 3.3Å; K611-V622 HydrophobicContact CD-CG2 4.27Å; K611-V622 HydrophobicContact CG-CG2 4.39Å
623	F	89.2	Confident	93.4	Very high	29 Å²	29	50.5 Å²	50.5	13%	0.127	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	173	179.8	41.4	-102.3	0	0	0	109.4	L345 Y365 W372 Y593 V609	L345-F623 HydrophobicContact CD2-CE2 4.11Å; L345-F623 HydrophobicContact CD2-CZ 3.99Å; Y365-F623 AromaticContact CD1-CE1 3.82Å; Y365-F623 HydrophobicContact CD1-CE1 3.82Å; Y365-F623 HydrophobicContact CD1-CE2 4.4Å; Y365-F623 AromaticContact CD1-CZ 3.7Å; Y365-F623 HydrophobicContact CD1-CZ 3.7Å; Y365-F623 HydrophobicContact CD2-CD2 4.36Å; Y365-F623 HydrophobicContact CD2-CE2 4.08Å; Y365-F623 HydrophobicContact CD2-CZ 4.18Å; Y365-F623 AromaticContact CE1-CD1 3.79Å; Y365-F623 HydrophobicContact CE1-CD1 3.79Å; Y365-F623 AromaticContact CE1-CE1 3.28Å; Y365-F623 HydrophobicContact CE1-CE1 3.28Å; Y365-F623 HydrophobicContact CE1-CE2 4.45Å; Y365-F623 AromaticContact CE1-CZ 3.67Å; Y365-F623 HydrophobicContact CE1-CZ 3.67Å; Y365-F623 AromaticContact CE2-CD1 3.97Å; Y365-F623 HydrophobicContact CE2-CD1 3.97Å; Y365-F623 HydrophobicContact CE2-CD2 4.05Å; Y365-F623 HydrophobicContact CE2-CE1 4.08Å; Y365-F623 HydrophobicContact CE2-CE2 4.13Å; Y365-F623 AromaticContact CE2-CG 3.97Å; Y365-F623 HydrophobicContact CE2-CG 3.97Å; Y365-F623 HydrophobicContact CE2-CZ 4.16Å; Y365-F623 HydrophobicContact CG-CE1 4.41Å; Y365-F623 HydrophobicContact CG-CE2 4.23Å; Y365-F623 AromaticContact CG-CZ 3.96Å; Y365-F623 HydrophobicContact CG-CZ 3.96Å; Y365-F623 AromaticContact CZ-CD1 3.41Å; Y365-F623 VanDerWaalsContact CZ-CD1 3.41Å; Y365-F623 AromaticContact CZ-CE1 3.43Å; Y365-F623 VanDerWaalsContact CZ-CE1 3.43Å; Y365-F623 AromaticContact CZ-CG 3.89Å; Y365-F623 AromaticContact CZ-CZ 3.91Å; Y365-F623 VanDerWaalsContact OH-CD1 3.28Å; Y365-F623 WeakPolarHBondContact OH-CD1 3.49Å; W372-F623 HydrophobicContact CZ2-CD2 4.25Å; W372-F623 AromaticContact CZ2-CE2 3.74Å; W372-F623 HydrophobicContact CZ2-CE2 3.74Å; Y593-F623 HydrophobicContact CE1-CE1 4.5Å; Y593-F623 HydrophobicContact CE1-CZ 4.33Å; V609-F623 HydrophobicContact CB-CD2 3.91Å; V609-F623 HydrophobicContact CB-CE2 3.96Å; V609-F623 WeakPolarHBondContact CB-O 3.34Å; V609-F623 HydrophobicContact CG1-CD2 4.31Å; V609-F623 HydrophobicContact CG1-CE2 3.86Å; V609-F623 HydrophobicContact CG1-CZ 4.31Å; V609-F623 HydrophobicContact CG2-CD2 3.78Å; V609-F623 HydrophobicContact CG2-CE2 3.83Å; V609-F623 WeakPolarHBondContact CG2-O 3.45Å; V609-F623 PolarHBondContact N-O 3.31Å
624	D	91.3	Very high	93.4	Very high	63 Å²	63	50 Å²	50	34%	0.337	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	150	178	-64.9	-38.9	0	0	0	110.1	W372 E607 K621	W372-D624 PolarHBondContact NE1-O 2.84Å; E607-D624 HydrophobicContact CB-CB 4.35Å; E607-D624 HydrophobicContact CG-CB 3.86Å; E607-D624 CarbonylContact O-C 3.53Å; E607-D624 WeakPolarHBondContact O-CA 3.29Å; K621-D624 WeakPolarHBondContact CE-OD1 3.35Å; K621-D624 WeakPolarHBondContact CE-OD2 3.48Å; K621-D624 VanDerWaalsContact NZ-CG 3.32Å; K621-D624 IonicContact NZ-OD1 3.37Å; K621-D624 PolarHBondContact NZ-OD1 2.98Å; K621-D624 IonicContact NZ-OD2 3.94Å; K621-D624 PolarHBondContact NZ-OD2 2.77Å
625	L	90.1	Very high	93.4	Very high	9 Å²	9	50 Å²	50	5%	0.047	25%	0.254	C	S	.	.			trans	-67.2	153.4	166.5	-72.2	171.8	0	0	0	109.8	T347 W372 V595 E607 V609 E627 I632	T347-L625 HydrophobicContact CG2-CD2 4.31Å; W372-L625 HydrophobicContact CH2-CD2 4.14Å; W372-L625 HydrophobicContact CZ2-CD2 3.6Å; V595-L625 HydrophobicContact CG1-CD1 3.72Å; V595-L625 HydrophobicContact CG1-CD2 3.68Å; V595-L625 HydrophobicContact CG1-CG 3.9Å; E607-L625 HydrophobicContact CB-CB 4.16Å; E607-L625 PolarHBondContact O-N 2.89Å; V609-L625 HydrophobicContact CG2-CG 4.34Å; L625-E627 WeakPolarHBondContact CB-O 3.2Å; L625-E627 PolarHBondContact O-N 3.36Å; L625-E627 VanDerWaalsContact O-N 3.17Å; L625-I632 HydrophobicContact CD1-CD1 3.79Å; L625-I632 HydrophobicContact CD2-CD1 4.21Å
626	P	87.3	Confident	93.3	Very high	75 Å²	75	45.7 Å²	45.7	49%	0.487	23%	0.232	S	C	.	.	S	Bend	trans	-61.4	-25.1	173.8	-21.2	33.2	0	0	0	112.9	W372	W372-P626 HydrophobicContact CB-CG 3.91Å; W372-P626 HydrophobicContact CG-CG 3.97Å
627	E	87.8	Confident	93.3	Very high	63 Å²	63	39.4 Å²	39.4	29%	0.294	21%	0.205	S	C	.	.	S	Bend	trans	-141.3	143	-177.8	-70.1	161.2	-135.6	0	0	110.3	L352 R363 L625 L629	L352-E627 WeakPolarHBondContact CD1-OE2 3.37Å; L352-E627 HydrophobicContact CD2-CB 4.34Å; L352-E627 HydrophobicContact CD2-CG 4.44Å; R363-E627 IonicContact CZ-OE1 3.69Å; R363-E627 IonicContact NH1-OE1 3.61Å; R363-E627 IonicContact NH2-OE1 2.82Å; R363-E627 PolarHBondContact NH2-OE1 2.9Å; L625-E627 WeakPolarHBondContact CB-O 3.2Å; L625-E627 PolarHBondContact O-N 3.36Å; L625-E627 VanDerWaalsContact O-N 3.17Å; E627-L629 HydrophobicContact CB-CD1 4.23Å; E627-L629 HydrophobicContact CB-CG 4.07Å; E627-L629 PolarHBondContact O-N 3Å; E627-L629 VanDerWaalsContact O-N 3.1Å
628	S	89.4	Confident	93.2	Very high	41 Å²	41	37.6 Å²	37.6	29%	0.287	20%	0.197	S	C	.	.			trans	-77.1	93	175.6	-38.6	0	0	0	0	110.4	M605 E607	M605-S628 VanDerWaalsContact CB-O 3.26Å; M605-S628 WeakPolarHBondContact CB-O 3.45Å; E607-S628 WeakPolarHBondContact OE2-CB 3.26Å; E607-S628 PolarHBondContact OE2-OG 2.72Å
629	L	90	Very high	92.9	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	18%	0.177	C	C	.	.			trans	-108.9	130.1	-173.8	-69.6	164.2	0	0	0	112	L352 G597 E627 I632	L352-L629 HydrophobicContact CD1-CD2 3.56Å; L352-L629 HydrophobicContact CG-CD2 3.67Å; G597-L629 PolarHBondContact N-O 3.43Å; E627-L629 HydrophobicContact CB-CD1 4.23Å; E627-L629 HydrophobicContact CB-CG 4.07Å; E627-L629 PolarHBondContact O-N 3Å; E627-L629 VanDerWaalsContact O-N 3.1Å; L629-I632 HydrophobicContact CB-CB 4.29Å; L629-I632 HydrophobicContact CB-CD1 4.33Å; L629-I632 HydrophobicContact CD1-CD1 4.09Å
630	G	89.3	Confident	92.4	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.01	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-94.1	150	168.5	0	0	0	0	0	112.3	G350 V351 M605 I632	G350-G630 CarbonylContact C-O 3.59Å; G350-G630 WeakPolarHBondContact CA-O 3.23Å; V351-G630 PolarHBondContact N-O 2.95Å; V351-G630 PolarHBondContact O-N 3.42Å; V351-G630 VanDerWaalsContact O-N 3.08Å; M605-G630 WeakPolarHBondContact SD-CA 3.4Å; M605-G630 PolarHBondContact SD-N 3.08Å; G630-I632 PolarHBondContact O-N 2.99Å
631	G	90.1	Very high	91.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	64	21.6	-179.6	0	0	0	0	0	114	Q384 D582	Q384-G631 PolarHBondContact N-O 3.28Å; D582-G631 VanDerWaalsContact O-CA 3.27Å; D582-G631 WeakPolarHBondContact O-CA 3.48Å; D582-G631 PolarHBondContact O-N 2.97Å; D582-G631 WeakPolarHBondContact OD1-CA 3.37Å; D582-G631 WeakPolarHBondContact OD2-CA 3.2Å; D582-G631 PolarHBondContact OD2-N 3.5Å
632	I	93.4	Very high	91.1	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.015	18%	0.182	C	C	.	.			trans	-66.3	151.1	168.4	-165.8	169.5	0	0	0	108.9	T347 V583 G584 V595 L625 L629 G630	T347-I632 HydrophobicContact CG2-CD1 4.19Å; V583-I632 CarbonylContact C-O 3.58Å; V583-I632 VanDerWaalsContact C-O 3.24Å; G584-I632 WeakPolarHBondContact CA-O 3.38Å; G584-I632 PolarHBondContact N-O 2.94Å; G584-I632 VanDerWaalsContact N-O 3.11Å; V595-I632 HydrophobicContact CG1-CD1 4.42Å; V595-I632 VanDerWaalsContact O-CG2 3.23Å; V595-I632 WeakPolarHBondContact O-CG2 3.46Å; L625-I632 HydrophobicContact CD1-CD1 3.79Å; L625-I632 HydrophobicContact CD2-CD1 4.21Å; L629-I632 HydrophobicContact CB-CB 4.29Å; L629-I632 HydrophobicContact CB-CD1 4.33Å; L629-I632 HydrophobicContact CD1-CD1 4.09Å; G630-I632 PolarHBondContact O-N 2.99Å
633	R	95.9	Very high	90.1	Very high	39 Å²	39	36 Å²	36	15%	0.147	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.8	173.5	-61.9	-62.7	179.9	-118.5	2.9	110.1	T347 L348 H385 I387 D582 V583	T347-R633 CarbonylContact C-O 3.55Å; T347-R633 VanDerWaalsContact CA-O 3.23Å; T347-R633 WeakPolarHBondContact CA-O 3.26Å; L348-R633 PolarHBondContact N-O 2.72Å; L348-R633 PolarHBondContact O-N 2.91Å; L348-R633 VanDerWaalsContact O-N 3.08Å; H385-R633 WeakPolarHBondContact NE2-CG 3.43Å; H385-R633 PolarHBondContact O-NE 2.89Å; I387-R633 HydrophobicContact CB-CB 4.43Å; I387-R633 HydrophobicContact CD1-CB 3.54Å; I387-R633 HydrophobicContact CG1-CB 3.79Å; I387-R633 HydrophobicContact CG1-CG 4.38Å; I387-R633 HydrophobicContact CG2-CB 3.8Å; I387-R633 HydrophobicContact CG2-CG 4.16Å; D582-R633 IonicContact OD1-CZ 2.75Å; D582-R633 IonicContact OD1-NH1 2.66Å; D582-R633 PolarHBondContact OD1-NH1 3.18Å; D582-R633 IonicContact OD1-NH2 3.11Å; D582-R633 PolarHBondContact OD1-NH2 3.23Å; V583-R633 PolarHBondContact O-NH1 3.01Å
634	A	96.9	Very high	88.3	Confident	7 Å²	7	43.3 Å²	43.3	6%	0.058	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144.8	-178.3	0	0	0	0	0	111	L345 V346 T347 I387 A586 V595	L345-A634 HydrophobicContact CD1-CB 4.42Å; V346-A634 CarbonylContact O-C 3.5Å; V346-A634 WeakPolarHBondContact O-CA 3.46Å; T347-A634 HydrophobicContact CG2-CB 4.18Å; I387-A634 VanDerWaalsContact CD1-O 3.26Å; I387-A634 WeakPolarHBondContact CD1-O 3.43Å; A586-A634 HydrophobicContact CB-CB 4.13Å; V595-A634 HydrophobicContact CB-CB 4.32Å; V595-A634 HydrophobicContact CG2-CB 4.13Å
635	C	97.6	Very high	85.7	Confident	15 Å²	15	46.1 Å²	46.1	10%	0.101	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	-176.7	173.4	62.5	0	0	0	0	109.7	V346 I387 V389	V346-C635 PolarHBondContact N-O 3.08Å; V346-C635 PolarHBondContact O-N 3.34Å; I387-C635 HydrophobicContact CD1-CB 3.87Å; V389-C635 HydrophobicContact CG2-CB 4.17Å
636	T	97	Very high	82.7	Confident	46 Å²	46	51.7 Å²	51.7	28%	0.282	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136	170.4	53.9	0	0	0	0	110.4	T343 H344 A586 V587 F588	T343-T636 HydrophobicContact CG2-CG2 4.46Å; H344-T636 VanDerWaalsContact O-CA 3.29Å; H344-T636 WeakPolarHBondContact O-CA 3.47Å; A586-T636 HydrophobicContact CB-CG2 4.38Å; V587-T636 WeakPolarHBondContact O-CG2 3.26Å; F588-T636 HydrophobicContact CB-CG2 3.86Å; F588-T636 HydrophobicContact CD2-CG2 3.77Å; F588-T636 HydrophobicContact CG-CG2 4.29Å
637	L	96.8	Very high	80	Confident	1 Å²	1	54 Å²	54	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.5	175.4	-67.4	174.3	0	0	0	110.9	H344 V346 V389 L394 F417	H344-L637 PolarHBondContact N-O 3.15Å; H344-L637 PolarHBondContact O-N 2.99Å; V346-L637 HydrophobicContact CB-CD1 4.36Å; V346-L637 HydrophobicContact CG1-CD1 4.17Å; V346-L637 HydrophobicContact CG2-CB 4Å; V346-L637 HydrophobicContact CG2-CD1 4.18Å; V346-L637 HydrophobicContact CG2-CG 4.31Å; V389-L637 HydrophobicContact CB-CD2 4.49Å; V389-L637 HydrophobicContact CG1-CD2 3.8Å; V389-L637 HydrophobicContact CG2-CD2 3.79Å; L394-L637 HydrophobicContact CB-CD1 3.82Å; L394-L637 HydrophobicContact CB-CD2 4.21Å; L394-L637 HydrophobicContact CD2-CD1 4.11Å; F417-L637 HydrophobicContact CD1-CD1 4.34Å
638	T	95.1	Very high	77.2	Confident	29 Å²	29	55.9 Å²	55.9	18%	0.178	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	113.5	162.4	-54.2	0	0	0	0	107.4	I338 S340 T342 T343 N392	I338-T638 HydrophobicContact CB-CG2 4.39Å; I338-T638 WeakPolarHBondContact CD1-O 3.2Å; S340-T638 WeakPolarHBondContact O-CG2 3.43Å; T342-T638 WeakPolarHBondContact O-CG2 3.34Å; T343-T638 PolarHBondContact OG1-OG1 3.14Å; N392-T638 PolarHBondContact ND2-O 2.77Å; N392-T638 PolarHBondContact OD1-N 3.1Å
639	V	92.8	Very high	74.3	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.018	34%	0.342	C	S	.	.			trans	-147.3	146.7	-178.9	61.4	0	0	0	0	108.2	H344 M364 L375 P419	H344-V639 PolarHBondContact CD2-O 3.23Å; M364-V639 HydrophobicContact SD-CG1 4.08Å; L375-V639 HydrophobicContact CD1-CG1 4.21Å; L375-V639 HydrophobicContact CD1-CG2 4.26Å; L375-V639 HydrophobicContact CD2-CG2 4.08Å; P419-V639 HydrophobicContact CB-CB 3.86Å; P419-V639 HydrophobicContact CB-CG2 3.81Å
640	F	87.1	Confident	71.6	Confident	99 Å²	99	64.5 Å²	64.5	43%	0.434	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-71.4	131.6	171.8	-69.2	-61.7	0	0	0	109.3	I338	I338-F640 HydrophobicContact CG2-CD2 3.95Å; I338-F640 HydrophobicContact CG2-CE1 4.02Å; I338-F640 HydrophobicContact CG2-CE2 3.36Å; I338-F640 HydrophobicContact CG2-CZ 3.39Å
641	P	82.9	Confident	69	Low	50 Å²	50	76.1 Å²	76.1	33%	0.325	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-54.2	135.1	167.8	-22.9	32.8	0	0	0	109	M364 E643	M364-P641 HydrophobicContact CE-CB 4.5Å; M364-P641 HydrophobicContact CE-CG 4.33Å; M364-P641 HydrophobicContact SD-CB 4.26Å; M364-P641 HydrophobicContact SD-CG 4.49Å; P641-E643 PolarHBondContact O-N 3.19Å
642	P	81.3	Confident	66.1	Low	43 Å²	43	84.8 Å²	84.8	28%	0.279	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-56.6	131.8	172.6	22.5	-29.8	0	0	0	108.2	K373	K373-P642 HydrophobicContact CB-CG 3.99Å; K373-P642 HydrophobicContact CD-CG 4.45Å
643	E	70.3	Confident	63	Low	135 Å²	135	90.1 Å²	90.1	63%	0.631	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-58.4	147.1	171.7	-62.6	-168.6	154.6	0	0	108.2	H254 P641 T645	H254-E643 IonicContact CE1-OE1 2.85Å; H254-E643 IonicContact ND1-OE1 3.66Å; H254-E643 PolarHBondContact ND1-OE1 3.45Å; H254-E643 VanDerWaalsContact ND1-OE1 3.11Å; P641-E643 PolarHBondContact O-N 3.19Å; E643-T645 PolarHBondContact O-N 3.43Å
644	E	51	Low	60.1	Low	184 Å²	184	93.8 Å²	93.8	86%	0.86	53%	0.527	S	S	*	.			trans	-63.3	77.8	177.3	-71.4	178.3	-173	0	0	109.9	T646	E644-T646 PolarHBondContact O-N 2.87Å
645	T	37.3	Very low	57.3	Low	121 Å²	121	101.7 Å²	101.7	74%	0.742	57%	0.567	S	S	*	*			trans	-66.8	122.9	156.7	47.9	0	0	0	0	105.6	E643	E643-T645 PolarHBondContact O-N 3.43Å
646	T	27.2	Very low	54.5	Low	127 Å²	127	106.7 Å²	106.7	78%	0.779	60%	0.602	S	S	*	*			trans	-33.7	133.7	171.1	33	0	0	0	0	110.9	E644 S648	E644-T646 PolarHBondContact O-N 2.87Å; T646-S648 PolarHBondContact O-N 3.45Å
647	P	30.3	Very low	51.3	Low	122 Å²	122	109.2 Å²	109.2	79%	0.792	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-54.9	122.8	-174.2	21.3	-31.1	0	0	0	109
648	S	28.7	Very low	48.5	Very low	103 Å²	103	118.9 Å²	118.9	72%	0.72	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-49.9	134.2	161.1	53.2	0	0	0	0	107.4	T646 S650	T646-S648 PolarHBondContact O-N 3.45Å; S648-S650 PolarHBondContact O-N 3.02Å
649	P	29.9	Very low	46.1	Very low	122 Å²	122	123.4 Å²	123.4	79%	0.792	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-54.8	121.1	-172.7	21.5	-30.6	0	0	0	108.5	R651	P649-R651 PolarHBondContact O-N 3.15Å
650	S	32.1	Very low	43.7	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	75%	0.753	S	S	*	*			trans	-43.3	124.1	171.2	46.7	0	0	0	0	108.4	S648 E652	S648-S650 PolarHBondContact O-N 3.02Å; S650-E652 PolarHBondContact O-N 3.28Å
651	R	35.3	Very low	41.3	Very low	245 Å²	245	131.4 Å²	131.4	93%	0.925	77%	0.771	S	S	*	*			trans	-50.2	106.9	166.5	-93.2	174.2	150.5	-177.2	-7.3	107.6	P649 S653	P649-R651 PolarHBondContact O-N 3.15Å; R651-S653 PolarHBondContact O-N 2.88Å
652	E	29	Very low	38.8	Very low	181 Å²	181	136.2 Å²	136.2	85%	0.846	80%	0.797	S	S	*	*			trans	-53.7	126.3	162.1	-72.6	-178.7	157.7	0	0	107.7	S650 P654	S650-E652 PolarHBondContact O-N 3.28Å; E652-P654 WeakPolarHBondContact O-CD 3.39Å
653	S	29.6	Very low	36.2	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	83%	0.83	S	S	*	*			trans	-53.9	119.1	167	-58.2	0	0	0	0	108.7	R651 L655	R651-S653 PolarHBondContact O-N 2.88Å; S653-L655 PolarHBondContact O-N 3.17Å; S653-L655 VanDerWaalsContact O-N 3.17Å
654	P	34.9	Very low	33.9	Very low	117 Å²	117	142.5 Å²	142.5	76%	0.76	84%	0.843	S	S	*	*			trans	-79.5	104.8	168.8	30.5	-24.7	0	0	0	105.7	E652	E652-P654 WeakPolarHBondContact O-CD 3.39Å
655	L	37.7	Very low	32.7	Very low	173 Å²	173	139.6 Å²	139.6	91%	0.906	84%	0.842	S	S	*	*			trans	174.5	84.7	148.5	-92.4	158.1	0	0	0	109.7	S653	S653-L655 PolarHBondContact O-N 3.17Å; S653-L655 VanDerWaalsContact O-N 3.17Å
656	S	37.3	Very low	32.3	Very low	120 Å²	120	141 Å²	141	84%	0.839	85%	0.849	S	S	*	*			trans	-164.3	101	144.6	51.9	0	0	0	0	109.3
657	A	29.9	Very low	32.7	Very low	99 Å²	99	142.2 Å²	142.2	82%	0.818	86%	0.855	S	S	*	*			trans	-171.5	150.6	150.5	0	0	0	0	0	110.5
658	P	38.2	Very low	33	Very low	204 Å²	204	144 Å²	144	100%	1.325	86%	0.861	S	S	*	*			cis	-96.9	0	-43.9	16.7	3.1	0	0	0	112.5

Retrieved 658 of 658 residues in 451.6 ms (Link to these results)

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