A0A096MHW0_POEFO Loading...

adenylate cyclase

AlphaFold DB , UniProt , Accession A0A096MHW0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 772 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	27.5	Very low	244 Å²	244	142.6 Å²	142.6	100%	1.202	80%	0.802	S	S	*	*				0	96.6	0	-68.5	166.5	167.9	0	0	104.7
2	A	27.6	Very low	27.4	Very low	108 Å²	108	143.8 Å²	143.8	89%	0.893	82%	0.815	S	S	*	*			cis	73.4	131.5	49.1	0	0	0	0	0	112
3	G	27.9	Very low	27.3	Very low	60 Å²	60	142 Å²	142	62%	0.619	81%	0.809	S	S	*	*			trans	102.1	99.7	-165	0	0	0	0	0	109.9
4	E	29	Very low	27.2	Very low	193 Å²	193	145.4 Å²	145.4	90%	0.902	81%	0.813	S	S	*	*				63.6	147.5	51.6	-56.3	175.7	123.5	0	0	113.3
5	D	29.9	Very low	27.1	Very low	122 Å²	122	146.1 Å²	146.1	65%	0.652	82%	0.815	S	S	*	*			cis	-173.5	170.3	-30.7	-161.2	11.5	0	0	0	106.1
6	Q	29	Very low	27	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	82%	0.817	S	S	*	*			trans	66.9	158	153.6	-76.4	165.3	54.4	0	0	120.6
7	V	27.3	Very low	26.7	Very low	115 Å²	115	140.5 Å²	140.5	70%	0.697	82%	0.815	S	S	*	*			cis	-176.8	172.9	-33.7	120.8	0	0	0	0	109.1
8	L	26	Very low	26.7	Very low	145 Å²	145	143.1 Å²	143.1	76%	0.759	82%	0.818	S	S	*	*			trans	71.8	126	175.3	-68	143.3	0	0	0	115.9
9	E	24.9	Very low	26.8	Very low	168 Å²	168	142.8 Å²	142.8	79%	0.785	81%	0.813	S	S	*	*			cis	101.3	153.2	25.4	-165.6	171.4	-135.1	0	0	113.9
10	E	24.9	Very low	26.8	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	81%	0.807	S	S	*	*			trans	69.5	133	-174	-54.3	-167.7	138.3	0	0	116.4
11	G	23.8	Very low	26.7	Very low	67 Å²	67	145.2 Å²	145.2	69%	0.691	81%	0.806	S	S	*	*			cis	136.9	112.8	-4.9	0	0	0	0	0	112.2
12	T	26.5	Very low	26.3	Very low	156 Å²	156	138.1 Å²	138.1	96%	0.957	78%	0.78	S	S	*	*			trans	-166.6	137.1	151.7	1.3	0	0	0	0	112.4
13	V	24.9	Very low	26.1	Very low	121 Å²	121	139.7 Å²	139.7	73%	0.733	77%	0.774	S	S	*	*			trans	-98.3	136.4	177.1	171.7	0	0	0	0	109.5
14	H	26	Very low	25.9	Very low	189 Å²	189	144 Å²	144	88%	0.875	78%	0.783	S	S	*	*			trans	-144.5	131.5	152	-121.8	52.9	0	0	0	113.6
15	N	25.5	Very low	25.7	Very low	156 Å²	156	139.5 Å²	139.5	83%	0.834	77%	0.772	S	S	*	*			trans	-74.3	148	176.1	-76.8	-30.1	0	0	0	111.1
16	G	25.6	Very low	25.5	Very low	82 Å²	82	142.5 Å²	142.5	85%	0.845	78%	0.78	S	S	*	*			trans	-151.9	86.6	169.5	0	0	0	0	0	110.5
17	C	23.4	Very low	25.2	Very low	116 Å²	116	142.2 Å²	142.2	78%	0.784	78%	0.783	S	S	*	*			trans	-89.9	133.3	173.1	-168.5	0	0	0	0	109.4
18	H	26.3	Very low	25	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.866	79%	0.786	S	S	*	*			trans	-155.9	109.3	163.7	-117.5	-58.3	0	0	0	111.8
19	D	27.3	Very low	25	Very low	138 Å²	138	140 Å²	140	74%	0.738	79%	0.785	S	S	*	*			trans	-70.9	143.9	154.5	-69.4	-58.9	0	0	0	109.6
20	D	26.9	Very low	24.9	Very low	130 Å²	130	139.1 Å²	139.1	70%	0.695	79%	0.785	S	S	*	*				-176.2	143.1	112	-124.6	-20.1	0	0	0	115.4
21	R	25.4	Very low	25	Very low	206 Å²	206	137.9 Å²	137.9	78%	0.777	78%	0.784	S	S	*	*			trans	55.8	106.2	141.7	-78.9	162.4	-177	-161.3	-4.5	125.2
22	S	24.6	Very low	24.9	Very low	94 Å²	94	143.6 Å²	143.6	66%	0.657	79%	0.79	S	S	*	*				80.4	147.9	107.2	83	0	0	0	0	124
23	N	23.3	Very low	24.7	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	78%	0.781	S	S	*	*			trans	86.2	93.8	148.2	-71.4	-19.1	0	0	0	122.9
24	N	23.7	Very low	24.4	Very low	151 Å²	151	141.2 Å²	141.2	81%	0.807	78%	0.784	S	S	*	*				75.2	147.8	109.3	-116.2	-11.9	0	0	0	123.7
25	S	24.5	Very low	25.1	Very low	98 Å²	98	138 Å²	138	69%	0.685	78%	0.78	S	S	*	*			trans	78.6	113.7	165.5	75.4	0	0	0	0	117.6
26	K	25.1	Very low	24.9	Very low	185 Å²	185	134.9 Å²	134.9	80%	0.804	78%	0.775	S	S	*	*				71.8	127	95.2	-73.2	-172.3	178.1	-174.8	0	112.6
27	D	23.8	Very low	24.8	Very low	151 Å²	151	137 Å²	137	81%	0.807	77%	0.772	S	S	*	*			cis	-159.7	-175.2	48.8	-105.9	-35.7	0	0	0	113.8
28	S	23.6	Very low	24.8	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	77%	0.769	S	S	*	*			trans	-100.6	152.7	-171.2	57.9	0	0	0	0	115.3
29	S	24.6	Very low	24.7	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	77%	0.769	S	S	*	*			trans	-172.5	113.9	136.9	59.7	0	0	0	0	115.6
30	N	24.1	Very low	24.5	Very low	149 Å²	149	130.8 Å²	130.8	80%	0.797	77%	0.765	S	S	*	*			trans	24.9	127.8	133.9	-55.6	-42	0	0	0	122.2
31	L	25.9	Very low	24.4	Very low	165 Å²	165	136.6 Å²	136.6	86%	0.864	78%	0.777	S	S	*	*				-169.1	107.7	122.9	-120	76	0	0	0	108
32	K	22.1	Very low	24.3	Very low	187 Å²	187	131.8 Å²	131.8	81%	0.813	78%	0.776	S	S	*	*				73.7	120.4	92.1	-99.9	-174	175.8	-179.3	0	117.7
33	C	21.4	Very low	24.6	Very low	115 Å²	115	132.4 Å²	132.4	78%	0.777	78%	0.777	S	S	*	*			trans	65.1	112.3	145	-66.2	0	0	0	0	122
34	S	20.2	Very low	24.7	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	78%	0.779	S	S	*	*			trans	-47.1	-173.6	139	48.7	0	0	0	0	115.4
35	P	39.7	Very low	25.2	Very low	121 Å²	121	134 Å²	134	79%	0.786	78%	0.782	S	S	*	*			cis	-129.6	-179.9	-18.1	34.9	-17.2	0	0	0	113.7
36	A	22.3	Very low	25.4	Very low	90 Å²	90	135.4 Å²	135.4	74%	0.744	79%	0.787	S	S	*	*			trans	172.1	139.8	141	0	0	0	0	0	116.2
37	V	23.2	Very low	25.7	Very low	128 Å²	128	134.9 Å²	134.9	78%	0.776	79%	0.792	S	S	*	*			trans	52	103.5	135.9	-179	0	0	0	0	117.9
38	S	22.6	Very low	25.9	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	78%	0.784	S	S	*	*				86	164.1	64.9	92.3	0	0	0	0	115.7
39	V	25.3	Very low	26.1	Very low	143 Å²	143	133.9 Å²	133.9	87%	0.867	79%	0.792	S	S	*	*			trans	73.1	130.5	-165.6	-166.8	0	0	0	0	113
40	G	22.6	Very low	26.2	Very low	65 Å²	65	137 Å²	137	67%	0.67	80%	0.8	S	S	*	*			cis	140.9	90.4	0.2	0	0	0	0	0	111.4
41	R	23.9	Very low	26.3	Very low	251 Å²	251	134.9 Å²	134.9	95%	0.947	80%	0.797	S	S	*	*			trans	-164.9	120.1	169.2	-110.7	175.6	-175.2	-176.4	1.1	111.5
42	S	23.3	Very low	26.3	Very low	106 Å²	106	133 Å²	133	74%	0.741	79%	0.794	S	S	*	*			trans	-75.8	167.1	143.4	61.5	0	0	0	0	107.7
43	P	31.4	Very low	26.4	Very low	106 Å²	106	133.4 Å²	133.4	69%	0.688	80%	0.799	S	S	*	*			cis	-143.1	-163.2	29	35	-10	0	0	0	115.5
44	K	26	Very low	26.7	Very low	184 Å²	184	136.1 Å²	136.1	80%	0.8	81%	0.805	S	S	*	*			trans	97.2	108.1	161.6	-56.9	-176.8	179.5	-175.5	0	117.6
45	T	34.1	Very low	26.9	Very low	142 Å²	142	139.1 Å²	139.1	87%	0.871	81%	0.806	S	S	*	*			trans	-51.7	130	151.3	44.4	0	0	0	0	112.1
46	V	27.5	Very low	26.3	Very low	129 Å²	129	137.8 Å²	137.8	78%	0.782	81%	0.806	S	S	*	*			trans	-141.6	115.3	159.3	179.3	0	0	0	0	108.2
47	N	32	Very low	26.5	Very low	173 Å²	173	141.2 Å²	141.2	93%	0.925	81%	0.811	S	S	*	*			trans	-71.8	127.5	163.1	-75	-24.4	0	0	0	108.1
48	G	28.3	Very low	26.8	Very low	61 Å²	61	142.1 Å²	142.1	63%	0.629	81%	0.811	S	S	*	*			trans	-149.1	110	178.6	0	0	0	0	0	110.6	L50	G48-L50 PolarHBondContact O-N 3.24Å
49	L	26.7	Very low	27.1	Very low	177 Å²	177	144 Å²	144	93%	0.927	81%	0.814	S	S	*	*			trans	-59	117.9	172.3	-79.3	150.2	0	0	0	109.3	S51	L49-S51 PolarHBondContact O-N 3.31Å; L49-S51 VanDerWaalsContact O-N 3.08Å
50	L	27.2	Very low	27.6	Very low	170 Å²	170	142.6 Å²	142.6	89%	0.89	81%	0.81	S	S	*	*			trans	-72.7	99.3	173.9	-75	168.2	0	0	0	109.7	G48	G48-L50 PolarHBondContact O-N 3.24Å
51	S	26	Very low	28.2	Very low	106 Å²	106	148.8 Å²	148.8	74%	0.741	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-66.9	127.3	163.3	-44.5	0	0	0	0	109.4	L49	L49-S51 PolarHBondContact O-N 3.31Å; L49-S51 VanDerWaalsContact O-N 3.08Å
52	P	27.4	Very low	28.8	Very low	124 Å²	124	142 Å²	142	81%	0.805	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-66.4	137.1	168.2	-15.9	30.1	0	0	0	110
53	Q	24.3	Very low	29.5	Very low	196 Å²	196	139.6 Å²	139.6	92%	0.916	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-64.3	135.5	167.4	-76.2	178.9	-84	0	0	109.8
54	L	26.7	Very low	29.8	Very low	172 Å²	172	140.3 Å²	140.3	90%	0.901	79%	0.789	S	S	*	*			trans	-86.2	108.4	175	-169.7	72.4	0	0	0	109.1
55	E	24.8	Very low	30.5	Very low	175 Å²	175	134.7 Å²	134.7	82%	0.818	77%	0.772	S	S	*	*			trans	-70.2	136	168.8	-78.5	-175.4	131	0	0	110.7	L57	E55-L57 PolarHBondContact O-N 2.66Å
56	A	26.6	Very low	30.8	Very low	94 Å²	94	133.9 Å²	133.9	78%	0.777	76%	0.758	S	S	*	*			trans	-79.2	87.4	-174.7	0	0	0	0	0	111.8	N58	A56-N58 PolarHBondContact O-N 3.15Å
57	L	26.6	Very low	31.5	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	75%	0.748	S	S	*	*			trans	-76.4	87.4	170.6	-103.2	156.7	0	0	0	111.1	E55 N59	E55-L57 PolarHBondContact O-N 2.66Å; L57-N59 PolarHBondContact O-N 3.23Å; L57-N59 VanDerWaalsContact O-N 3.12Å
58	N	30.2	Very low	31.8	Very low	146 Å²	146	129.7 Å²	129.7	78%	0.781	73%	0.729	S	S	*	*			trans	-68.9	98.2	165.8	-81	-23.5	0	0	0	110.1	A56	A56-N58 PolarHBondContact O-N 3.15Å
59	N	28.6	Very low	32.5	Very low	143 Å²	143	131.8 Å²	131.8	77%	0.765	72%	0.722	S	S	*	*	S	Bend	trans	-160.1	116.7	152.4	-94	-35.9	0	0	0	111.5	L57 Q61	L57-N59 PolarHBondContact O-N 3.23Å; L57-N59 VanDerWaalsContact O-N 3.12Å; N59-Q61 PolarHBondContact O-N 2.9Å
60	S	35.3	Very low	33.1	Very low	112 Å²	112	129.4 Å²	129.4	78%	0.783	71%	0.706	S	S	*	*			trans	22.2	82.7	165.1	62	0	0	0	0	118.5	T62	S60-T62 PolarHBondContact O-N 3.15Å
61	Q	34.8	Very low	33.8	Very low	195 Å²	195	128.9 Å²	128.9	91%	0.911	70%	0.697	S	S	*	*			trans	-77.2	95.5	156.9	-69.8	-171.5	0.2	0	0	109.9	N59 S63	N59-Q61 PolarHBondContact O-N 2.9Å; Q61-S63 PolarHBondContact O-N 2.93Å
62	T	37.8	Very low	34.5	Very low	108 Å²	108	130.2 Å²	130.2	66%	0.663	69%	0.691	S	S	*	*			trans	-73.5	119.5	155.1	45.4	0	0	0	0	107.5	S60 L64	S60-T62 PolarHBondContact O-N 3.15Å; T62-L64 PolarHBondContact O-N 3.39Å
63	S	37.1	Very low	35.1	Very low	57 Å²	57	132.4 Å²	132.4	40%	0.399	69%	0.688	S	S	.	*			trans	-64.8	130	-171.8	177.4	0	0	0	0	110.2	Q61 C65 E66	Q61-S63 PolarHBondContact O-N 2.93Å; S63-C65 PolarHBondContact O-N 3.06Å; S63-C65 WeakPolarHBondContact OG-CB 3.25Å; S63-C65 PolarHBondContact OG-N 3.03Å; S63-E66 PolarHBondContact N-OE2 3.11Å; S63-E66 PolarHBondContact O-N 3.43Å
64	L	38.5	Very low	35.8	Very low	121 Å²	121	130.5 Å²	130.5	63%	0.634	68%	0.677	S	S	*	*	H	α-helix	trans	-57.6	-21.8	175.4	-143.7	157.3	0	0	0	111.1	T62 M67 L68	T62-L64 PolarHBondContact O-N 3.39Å; L64-M67 HydrophobicContact CG-CE 4.44Å; L64-L68 HydrophobicContact CD2-CD1 4.01Å; L64-L68 HydrophobicContact CD2-CG 4.39Å; L64-L68 WeakPolarHBondContact O-CD1 3.32Å; L64-L68 VanDerWaalsContact O-CG 3.26Å; L64-L68 WeakPolarHBondContact O-CG 3.08Å; L64-L68 PolarHBondContact O-N 3.31Å
65	C	40.2	Very low	36.3	Very low	66 Å²	66	127.3 Å²	127.3	45%	0.446	67%	0.669	S	S	.	*	H	α-helix	trans	-69.6	-37.6	172.3	-161.2	0	0	0	0	113.5	S63 L68 Q69	S63-C65 PolarHBondContact O-N 3.06Å; S63-C65 WeakPolarHBondContact OG-CB 3.25Å; S63-C65 PolarHBondContact OG-N 3.03Å; C65-L68 PolarHBondContact O-N 3.4Å; C65-Q69 WeakPolarHBondContact O-CG 3.49Å; C65-Q69 PolarHBondContact O-N 3.29Å
66	E	40.6	Very low	36.8	Very low	124 Å²	124	130.1 Å²	130.1	58%	0.579	67%	0.672	S	S	*	*	H	α-helix	trans	-66.7	-43.9	179.7	-71.2	177.4	123.8	0	0	111.4	S63 L68 Q69 E70	S63-E66 PolarHBondContact N-OE2 3.11Å; S63-E66 PolarHBondContact O-N 3.43Å; E66-L68 PolarHBondContact O-N 3.12Å; E66-Q69 PolarHBondContact O-N 3.29Å; E66-E70 PolarHBondContact O-N 3.45Å
67	M	41.3	Very low	37	Very low	114 Å²	114	131.1 Å²	131.1	56%	0.562	67%	0.673	S	S	*	*	H	α-helix	trans	-62.4	-28.7	174.8	-69.2	-159.1	-60.2	0	0	113.3	L64	L64-M67 HydrophobicContact CG-CE 4.44Å
68	L	38.9	Very low	37.2	Very low	101 Å²	101	126.4 Å²	126.4	53%	0.529	66%	0.664	S	S	.	*	H	α-helix	trans	-75.2	-46.4	175.9	-71.3	167.9	0	0	0	110.7	L64 C65 E66 E70 K71 E72	L64-L68 HydrophobicContact CD2-CD1 4.01Å; L64-L68 HydrophobicContact CD2-CG 4.39Å; L64-L68 WeakPolarHBondContact O-CD1 3.32Å; L64-L68 VanDerWaalsContact O-CG 3.26Å; L64-L68 WeakPolarHBondContact O-CG 3.08Å; L64-L68 PolarHBondContact O-N 3.31Å; C65-L68 PolarHBondContact O-N 3.4Å; E66-L68 PolarHBondContact O-N 3.12Å; L68-E70 PolarHBondContact O-N 2.98Å; L68-K71 PolarHBondContact O-N 3.34Å; L68-E72 PolarHBondContact O-N 3.15Å
69	Q	42.8	Very low	37.2	Very low	104 Å²	104	123.4 Å²	123.4	49%	0.486	67%	0.667	S	S	.	*	H	α-helix	trans	-67	-35.6	178.9	-68.8	-174.1	19.7	0	0	113.4	C65 E66 K71 K73	C65-Q69 WeakPolarHBondContact O-CG 3.49Å; C65-Q69 PolarHBondContact O-N 3.29Å; E66-Q69 PolarHBondContact O-N 3.29Å; Q69-K71 VanDerWaalsContact C-N 3.27Å; Q69-K71 PolarHBondContact O-N 3.48Å; Q69-K73 PolarHBondContact O-N 3.18Å
70	E	40.3	Very low	37.7	Very low	127 Å²	127	121.8 Å²	121.8	59%	0.593	67%	0.674	S	S	*	*	H	α-helix	trans	-63.9	-30.6	175	-90.7	-145.9	112.8	0	0	113.3	E66 L68	E66-E70 PolarHBondContact O-N 3.45Å; L68-E70 PolarHBondContact O-N 2.98Å
71	K	41.4	Very low	37.5	Very low	160 Å²	160	125 Å²	125	70%	0.696	68%	0.679	S	S	*	*	H	α-helix	trans	-88	-32.4	178.8	-100.3	-172.4	172	-177.2	0	113.7	L68 Q69 K74 S75	L68-K71 PolarHBondContact O-N 3.34Å; Q69-K71 VanDerWaalsContact C-N 3.27Å; Q69-K71 PolarHBondContact O-N 3.48Å; K71-K74 PolarHBondContact O-N 3.32Å; K71-S75 PolarHBondContact O-N 3.49Å
72	E	39.3	Very low	37.7	Very low	133 Å²	133	119.9 Å²	119.9	62%	0.621	68%	0.678	S	S	*	*	H	α-helix	trans	-61.9	-43	171.2	-74.9	-175	150.3	0	0	111.5	L68 K74 S75	L68-E72 PolarHBondContact O-N 3.15Å; E72-K74 PolarHBondContact O-N 3.36Å; E72-S75 PolarHBondContact O-N 3.07Å
73	K	40.6	Very low	37.7	Very low	170 Å²	170	121.1 Å²	121.1	74%	0.739	68%	0.678	S	S	*	*	H	α-helix	trans	-60.6	-25.8	175.3	-76.3	179	-177.3	172.7	0	114.2	Q69	Q69-K73 PolarHBondContact O-N 3.18Å
74	K	39.8	Very low	37.7	Very low	157 Å²	157	125.1 Å²	125.1	68%	0.683	70%	0.695	S	S	*	*	H	α-helix	trans	-87.6	-13.7	176.7	-74.7	172.7	-179.5	159.9	0	113.6	K71 E72	K71-K74 PolarHBondContact O-N 3.32Å; E72-K74 PolarHBondContact O-N 3.36Å
75	S	36.2	Very low	37.9	Very low	104 Å²	104	126.5 Å²	126.5	73%	0.727	70%	0.698	S	S	*	*	H	α-helix	trans	-95.7	-14.8	-177.6	-163.8	0	0	0	0	114.6	K71 E72	K71-S75 PolarHBondContact O-N 3.49Å; E72-S75 PolarHBondContact O-N 3.07Å
76	W	35	Very low	38	Very low	234 Å²	234	128.1 Å²	128.1	89%	0.886	71%	0.709	S	S	*	*			trans	-99.2	15.1	-174.6	-136.1	-39.3	0	0	0	114.6	G78	W76-G78 PolarHBondContact O-N 3.37Å
77	S	32.2	Very low	38	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	71%	0.707	S	S	*	*			trans	-94.7	62.8	175.4	176.5	0	0	0	0	111.4
78	G	30.8	Very low	38.1	Very low	64 Å²	64	123.8 Å²	123.8	66%	0.66	70%	0.701	S	S	*	*	S	Bend	trans	-173.6	135.5	179.3	0	0	0	0	0	112.3	W76	W76-G78 PolarHBondContact O-N 3.37Å
79	G	29.9	Very low	38.5	Very low	82 Å²	82	123.7 Å²	123.7	85%	0.845	70%	0.7	S	S	*	*			trans	-73.2	167.2	-172.1	0	0	0	0	0	115.5
80	A	37.9	Very low	38.5	Very low	109 Å²	109	122.4 Å²	122.4	90%	0.901	70%	0.7	S	S	*	*			trans	-52.7	130.8	-172.2	0	0	0	0	0	116.1
81	M	31.2	Very low	38.5	Very low	181 Å²	181	121.4 Å²	121.4	89%	0.892	70%	0.699	S	S	*	*			trans	-155.1	139.2	147.8	-135	165.4	172.2	0	0	109	M83	M81-M83 PolarHBondContact O-N 3.41Å
82	G	39.2	Very low	38.8	Very low	86 Å²	86	122.4 Å²	122.4	89%	0.887	70%	0.698	S	S	*	*			trans	-67.1	130.2	-179.8	0	0	0	0	0	111.4
83	M	39.3	Very low	39.4	Very low	134 Å²	134	117.9 Å²	117.9	66%	0.66	68%	0.682	S	S	*	*			trans	-116.7	133.7	176	-81.5	171.5	54.7	0	0	110.2	M81 H85 L88	M81-M83 PolarHBondContact O-N 3.41Å; M83-H85 PolarHBondContact O-N 2.86Å; M83-L88 HydrophobicContact CE-CD1 4.43Å
84	D	36.3	Very low	39.7	Very low	142 Å²	142	115.6 Å²	115.6	76%	0.759	67%	0.672	S	S	*	*			trans	-63	108.6	176	-69.7	-46.9	0	0	0	111	S86 A87	D84-S86 PolarHBondContact O-N 3.29Å; D84-A87 PolarHBondContact O-N 3.12Å
85	H	42.3	Very low	40	Very low	150 Å²	150	112.3 Å²	112.3	69%	0.694	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-59.7	-18.8	-177	-71.5	-82	0	0	0	113.9	M83 A87 L88	M83-H85 PolarHBondContact O-N 2.86Å; H85-A87 VanDerWaalsContact C-N 3.27Å; H85-A87 PolarHBondContact O-N 3.38Å; H85-L88 PolarHBondContact O-N 3.41Å
86	S	42.4	Very low	40.8	Very low	99 Å²	99	113.1 Å²	113.1	69%	0.692	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-58.7	-31	177.3	-46.6	0	0	0	0	114	D84 P90	D84-S86 PolarHBondContact O-N 3.29Å; S86-P90 VanDerWaalsContact O-CD 3.25Å; S86-P90 WeakPolarHBondContact O-CD 3.5Å
87	A	39.9	Very low	41.6	Very low	64 Å²	64	110.3 Å²	110.3	53%	0.529	64%	0.641	S	S	.	*	G	3₁₀ helix	trans	-85.2	-17.4	-177.2	0	0	0	0	0	114	D84 H85	D84-A87 PolarHBondContact O-N 3.12Å; H85-A87 VanDerWaalsContact C-N 3.27Å; H85-A87 PolarHBondContact O-N 3.38Å
88	L	43.4	Very low	42.7	Very low	83 Å²	83	109.7 Å²	109.7	44%	0.435	63%	0.625	S	S	.	*	H	α-helix	trans	-81.3	-31.2	-177.4	-76.5	162.7	0	0	0	112.8	M83 H85 L91 R92	M83-L88 HydrophobicContact CE-CD1 4.43Å; H85-L88 PolarHBondContact O-N 3.41Å; L88-L91 PolarHBondContact O-N 2.91Å; L88-R92 WeakPolarHBondContact O-CB 3.41Å; L88-R92 PolarHBondContact O-N 3.38Å
89	I	49	Very low	43.9	Very low	100 Å²	100	115.1 Å²	115.1	51%	0.513	63%	0.626	S	S	.	*	H	α-helix	trans	-64.6	-47	-178.5	-56.6	171.3	0	0	0	111.5	L91 R92 S93	I89-L91 VanDerWaalsContact C-N 3.33Å; I89-L91 PolarHBondContact O-N 3.45Å; I89-R92 PolarHBondContact O-N 3.48Å; I89-S93 WeakPolarHBondContact O-CB 3.46Å; I89-S93 PolarHBondContact O-N 3.27Å
90	P	42.9	Very low	45.3	Very low	76 Å²	76	114.8 Å²	114.8	49%	0.494	61%	0.611	S	S	.	*	H	α-helix	trans	-64.9	-31.5	176.8	-22.6	34.8	0	0	0	114.2	S86 S93 K94	S86-P90 VanDerWaalsContact O-CD 3.25Å; S86-P90 WeakPolarHBondContact O-CD 3.5Å; P90-S93 WeakPolarHBondContact CA-OG 3.23Å; P90-S93 PolarHBondContact O-OG 3.36Å; P90-K94 WeakPolarHBondContact O-CB 3.49Å; P90-K94 PolarHBondContact O-N 2.79Å; P90-K94 VanDerWaalsContact O-N 3.11Å
91	L	38.8	Very low	45.9	Very low	107 Å²	107	113.5 Å²	113.5	56%	0.56	59%	0.589	S	S	*	*	H	α-helix	trans	-74.4	-37.5	176.5	-69.1	173.9	0	0	0	111.4	L88 I89 N95	L88-L91 PolarHBondContact O-N 2.91Å; I89-L91 VanDerWaalsContact C-N 3.33Å; I89-L91 PolarHBondContact O-N 3.45Å; L91-N95 PolarHBondContact O-N 3.22Å; L91-N95 PolarHBondContact O-ND2 2.71Å
92	R	48.7	Very low	47.4	Very low	180 Å²	180	107.1 Å²	107.1	68%	0.679	57%	0.565	S	S	*	*	H	α-helix	trans	-67.1	-41.4	173.4	-158.3	171.2	-170.8	161	3	110.9	L88 I89 N95 F96	L88-R92 WeakPolarHBondContact O-CB 3.41Å; L88-R92 PolarHBondContact O-N 3.38Å; I89-R92 PolarHBondContact O-N 3.48Å; R92-N95 PolarHBondContact O-N 3.42Å; R92-F96 HydrophobicContact CG-CD2 4.16Å; R92-F96 HydrophobicContact CG-CE2 4.21Å; R92-F96 WeakPolarHBondContact O-CD2 3.33Å; R92-F96 PolarHBondContact O-N 3.01Å
93	S	51	Low	48.2	Very low	39 Å²	39	109.3 Å²	109.3	27%	0.273	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-45.7	178.1	79.1	0	0	0	0	112.5	I89 P90 N95 F96 R97	I89-S93 WeakPolarHBondContact O-CB 3.46Å; I89-S93 PolarHBondContact O-N 3.27Å; P90-S93 WeakPolarHBondContact CA-OG 3.23Å; P90-S93 PolarHBondContact O-OG 3.36Å; S93-N95 PolarHBondContact O-N 3.3Å; S93-F96 PolarHBondContact O-N 2.88Å; S93-R97 PolarHBondContact O-N 3.24Å
94	K	47.5	Very low	48.8	Very low	122 Å²	122	109.4 Å²	109.4	53%	0.53	55%	0.549	S	S	.	.	H	α-helix	trans	-59	-47.5	177.6	-175.2	174.5	173.8	179.2	0	112.1	P90 F96 R97 E98	P90-K94 WeakPolarHBondContact O-CB 3.49Å; P90-K94 PolarHBondContact O-N 2.79Å; P90-K94 VanDerWaalsContact O-N 3.11Å; K94-F96 VanDerWaalsContact C-N 3.34Å; K94-F96 PolarHBondContact O-N 2.86Å; K94-R97 PolarHBondContact O-N 2.96Å; K94-E98 WeakPolarHBondContact CE-OE1 3.47Å; K94-E98 IonicContact NZ-OE1 2.65Å; K94-E98 WeakPolarHBondContact O-CB 3.48Å; K94-E98 WeakPolarHBondContact O-CG 3.4Å; K94-E98 PolarHBondContact O-N 3.38Å
95	N	46.9	Very low	49.8	Very low	87 Å²	87	106 Å²	106	47%	0.465	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-32.9	178.4	-80.3	-82.4	0	0	0	113.3	L91 R92 S93 R99	L91-N95 PolarHBondContact O-N 3.22Å; L91-N95 PolarHBondContact O-ND2 2.71Å; R92-N95 PolarHBondContact O-N 3.42Å; S93-N95 PolarHBondContact O-N 3.3Å; N95-R99 VanDerWaalsContact O-CG 3.29Å; N95-R99 WeakPolarHBondContact O-CG 3.47Å; N95-R99 PolarHBondContact O-N 2.79Å
96	F	51.4	Low	50.7	Low	121 Å²	121	102.5 Å²	102.5	53%	0.531	52%	0.519	S	S	.	.	H	α-helix	trans	-71.5	-42.1	173.9	-96.5	-83.5	0	0	0	111.8	R92 S93 K94 R99 S100	R92-F96 HydrophobicContact CG-CD2 4.16Å; R92-F96 HydrophobicContact CG-CE2 4.21Å; R92-F96 WeakPolarHBondContact O-CD2 3.33Å; R92-F96 PolarHBondContact O-N 3.01Å; S93-F96 PolarHBondContact O-N 2.88Å; K94-F96 VanDerWaalsContact C-N 3.34Å; K94-F96 PolarHBondContact O-N 2.86Å; F96-R99 PolarHBondContact O-N 2.79Å; F96-S100 WeakPolarHBondContact O-CB 3.27Å; F96-S100 PolarHBondContact O-N 3.3Å
97	R	53.4	Low	51.5	Low	176 Å²	176	100.9 Å²	100.9	66%	0.664	51%	0.505	S	S	*	.	H	α-helix	trans	-66.6	-46.2	178.9	-159.3	170.3	72.4	-172.6	3.5	111.6	S93 K94 R99 S100 D101	S93-R97 PolarHBondContact O-N 3.24Å; K94-R97 PolarHBondContact O-N 2.96Å; R97-R99 PolarHBondContact O-N 2.69Å; R97-S100 PolarHBondContact O-N 3.11Å; R97-S100 VanDerWaalsContact O-N 3.1Å; R97-D101 WeakPolarHBondContact O-CB 3.46Å; R97-D101 PolarHBondContact O-N 3.15Å
98	E	53.8	Low	52.3	Low	101 Å²	101	102.3 Å²	102.3	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-57.7	-34.3	175.2	-74.1	172.4	178.8	0	0	112.9	K94 A102	K94-E98 WeakPolarHBondContact CE-OE1 3.47Å; K94-E98 IonicContact NZ-OE1 2.65Å; K94-E98 WeakPolarHBondContact O-CB 3.48Å; K94-E98 WeakPolarHBondContact O-CG 3.4Å; K94-E98 PolarHBondContact O-N 3.38Å; E98-A102 VanDerWaalsContact O-CB 3.22Å; E98-A102 WeakPolarHBondContact O-CB 3.07Å; E98-A102 PolarHBondContact O-N 3.15Å
99	R	56.9	Low	53	Low	178 Å²	178	104 Å²	104	67%	0.672	51%	0.507	S	S	*	.	H	α-helix	trans	-76.4	-37.7	174.7	-73.5	175.5	178.4	-166.3	-3.6	113.6	N95 F96 R97 H103	N95-R99 VanDerWaalsContact O-CG 3.29Å; N95-R99 WeakPolarHBondContact O-CG 3.47Å; N95-R99 PolarHBondContact O-N 2.79Å; F96-R99 PolarHBondContact O-N 2.79Å; R97-R99 PolarHBondContact O-N 2.69Å; R99-H103 WeakPolarHBondContact O-CB 3.28Å; R99-H103 PolarHBondContact O-N 3Å
100	S	58.2	Low	53.3	Low	75 Å²	75	106.1 Å²	106.1	52%	0.524	51%	0.514	S	S	.	.	H	α-helix	trans	-66.5	-42.9	174.8	-169.4	0	0	0	0	111.1	F96 R97 H103 F104	F96-S100 WeakPolarHBondContact O-CB 3.27Å; F96-S100 PolarHBondContact O-N 3.3Å; R97-S100 PolarHBondContact O-N 3.11Å; R97-S100 VanDerWaalsContact O-N 3.1Å; S100-H103 PolarHBondContact O-N 3.16Å; S100-F104 VanDerWaalsContact O-CB 3.25Å; S100-F104 WeakPolarHBondContact O-CB 3.48Å; S100-F104 PolarHBondContact O-N 2.83Å
101	D	50.9	Low	53.7	Low	83 Å²	83	106.6 Å²	106.6	44%	0.444	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-42.8	177.4	-62.9	-15.5	0	0	0	110.2	R97 F104 V105	R97-D101 WeakPolarHBondContact O-CB 3.46Å; R97-D101 PolarHBondContact O-N 3.15Å; D101-F104 PolarHBondContact O-N 3.45Å; D101-V105 WeakPolarHBondContact O-CB 3.4Å; D101-V105 VanDerWaalsContact O-CG2 3.25Å; D101-V105 WeakPolarHBondContact O-CG2 3.47Å; D101-V105 PolarHBondContact O-N 2.68Å
102	A	63.8	Low	54.2	Low	47 Å²	47	104.1 Å²	104.1	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-47.3	173.6	0	0	0	0	0	112.3	E98 F104 V105 D106	E98-A102 VanDerWaalsContact O-CB 3.22Å; E98-A102 WeakPolarHBondContact O-CB 3.07Å; E98-A102 PolarHBondContact O-N 3.15Å; A102-F104 VanDerWaalsContact C-N 3.35Å; A102-F104 PolarHBondContact O-N 3.25Å; A102-V105 PolarHBondContact O-N 3.29Å; A102-D106 WeakPolarHBondContact O-CB 3.34Å; A102-D106 PolarHBondContact O-N 2.74Å
103	H	56.2	Low	54.3	Low	131 Å²	131	101.3 Å²	101.3	61%	0.606	50%	0.502	S	S	*	.	H	α-helix	trans	-63.4	-39.2	176.8	-175.3	-78	0	0	0	112.1	R99 S100 D106 V107	R99-H103 WeakPolarHBondContact O-CB 3.28Å; R99-H103 PolarHBondContact O-N 3Å; S100-H103 PolarHBondContact O-N 3.16Å; H103-D106 PolarHBondContact O-N 3.15Å; H103-V107 WeakPolarHBondContact O-CG2 3.42Å; H103-V107 PolarHBondContact O-N 3.46Å
104	F	50.6	Low	54.3	Low	136 Å²	136	102.5 Å²	102.5	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-66.1	-40.8	175.5	-173.1	-110	0	0	0	111.7	S100 D101 A102 D106 V107 I108	S100-F104 VanDerWaalsContact O-CB 3.25Å; S100-F104 WeakPolarHBondContact O-CB 3.48Å; S100-F104 PolarHBondContact O-N 2.83Å; D101-F104 PolarHBondContact O-N 3.45Å; A102-F104 VanDerWaalsContact C-N 3.35Å; A102-F104 PolarHBondContact O-N 3.25Å; F104-D106 VanDerWaalsContact C-N 3.34Å; F104-V107 PolarHBondContact O-N 3.03Å; F104-I108 HydrophobicContact CD1-CD1 3.69Å; F104-I108 HydrophobicContact CE1-CD1 3.43Å; F104-I108 VanDerWaalsContact CE1-CD1 3.43Å; F104-I108 HydrophobicContact CG-CD1 4.36Å; F104-I108 HydrophobicContact CZ-CD1 3.89Å; F104-I108 WeakPolarHBondContact O-CB 3.35Å; F104-I108 VanDerWaalsContact O-CG1 3.28Å; F104-I108 WeakPolarHBondContact O-CG1 3.39Å; F104-I108 PolarHBondContact O-N 3.44Å
105	V	58.3	Low	54.4	Low	71 Å²	71	103.8 Å²	103.8	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-38.4	172.2	164.4	0	0	0	0	111.6	D101 A102 I108 K109	D101-V105 WeakPolarHBondContact O-CB 3.4Å; D101-V105 VanDerWaalsContact O-CG2 3.25Å; D101-V105 WeakPolarHBondContact O-CG2 3.47Å; D101-V105 PolarHBondContact O-N 2.68Å; A102-V105 PolarHBondContact O-N 3.29Å; V105-I108 PolarHBondContact O-N 2.86Å; V105-K109 WeakPolarHBondContact O-CG 3.29Å; V105-K109 PolarHBondContact O-N 2.74Å
106	D	61	Low	54.5	Low	76 Å²	76	105.1 Å²	105.1	41%	0.406	52%	0.517	S	S	.	.	H	α-helix	trans	-73.9	-36.7	178.8	-70.4	-23.7	0	0	0	112.1	A102 H103 F104 I108 K109 E110	A102-D106 WeakPolarHBondContact O-CB 3.34Å; A102-D106 PolarHBondContact O-N 2.74Å; H103-D106 PolarHBondContact O-N 3.15Å; F104-D106 VanDerWaalsContact C-N 3.34Å; D106-I108 VanDerWaalsContact C-N 3.34Å; D106-I108 PolarHBondContact O-N 3.15Å; D106-K109 CarbonylContact O-C 3.59Å; D106-K109 WeakPolarHBondContact O-CA 3.48Å; D106-K109 WeakPolarHBondContact O-CB 3.01Å; D106-K109 PolarHBondContact O-N 3.44Å; D106-K109 WeakPolarHBondContact OD1-CD 3.32Å; D106-K109 IonicContact OD1-NZ 2.76Å; D106-K109 PolarHBondContact OD1-NZ 2.88Å; D106-E110 PolarHBondContact O-N 2.85Å
107	V	58.6	Low	54.5	Low	66 Å²	66	105 Å²	105	40%	0.4	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-39.4	168.2	169.9	0	0	0	0	111.4	H103 F104 K109 E110 D111	H103-V107 WeakPolarHBondContact O-CG2 3.42Å; H103-V107 PolarHBondContact O-N 3.46Å; F104-V107 PolarHBondContact O-N 3.03Å; V107-K109 VanDerWaalsContact C-N 3.28Å; V107-K109 PolarHBondContact O-N 2.99Å; V107-E110 PolarHBondContact O-N 3.17Å; V107-D111 PolarHBondContact O-N 3.4Å
108	I	56.2	Low	54.4	Low	93 Å²	93	103.1 Å²	103.1	48%	0.477	51%	0.511	S	S	.	.	H	α-helix	trans	-65.3	-30.6	172.2	-72.6	167.3	0	0	0	111.6	F104 V105 D106 S112	F104-I108 HydrophobicContact CD1-CD1 3.69Å; F104-I108 HydrophobicContact CE1-CD1 3.43Å; F104-I108 VanDerWaalsContact CE1-CD1 3.43Å; F104-I108 HydrophobicContact CG-CD1 4.36Å; F104-I108 HydrophobicContact CZ-CD1 3.89Å; F104-I108 WeakPolarHBondContact O-CB 3.35Å; F104-I108 VanDerWaalsContact O-CG1 3.28Å; F104-I108 WeakPolarHBondContact O-CG1 3.39Å; F104-I108 PolarHBondContact O-N 3.44Å; V105-I108 PolarHBondContact O-N 2.86Å; D106-I108 VanDerWaalsContact C-N 3.34Å; D106-I108 PolarHBondContact O-N 3.15Å; I108-S112 PolarHBondContact O-N 2.8Å
109	K	57.8	Low	54.3	Low	119 Å²	119	106.9 Å²	106.9	52%	0.517	52%	0.522	S	S	.	.	H	α-helix	trans	-74.3	-32.6	171.7	-71.1	171.2	-162.8	153.7	0	112.5	V105 D106 V107 S112	V105-K109 WeakPolarHBondContact O-CG 3.29Å; V105-K109 PolarHBondContact O-N 2.74Å; D106-K109 CarbonylContact O-C 3.59Å; D106-K109 WeakPolarHBondContact O-CA 3.48Å; D106-K109 WeakPolarHBondContact O-CB 3.01Å; D106-K109 PolarHBondContact O-N 3.44Å; D106-K109 WeakPolarHBondContact OD1-CD 3.32Å; D106-K109 IonicContact OD1-NZ 2.76Å; D106-K109 PolarHBondContact OD1-NZ 2.88Å; V107-K109 VanDerWaalsContact C-N 3.28Å; V107-K109 PolarHBondContact O-N 2.99Å; K109-S112 WeakPolarHBondContact O-CA 3.46Å; K109-S112 VanDerWaalsContact O-CB 3.23Å; K109-S112 WeakPolarHBondContact O-CB 3.3Å; K109-S112 PolarHBondContact O-N 3.18Å; K109-S112 VanDerWaalsContact O-N 3.1Å; K109-S112 PolarHBondContact O-OG 3.33Å
110	E	56.9	Low	54.4	Low	144 Å²	144	107 Å²	107	67%	0.673	53%	0.527	S	S	*	.	H	α-helix	trans	-68.5	-41.7	173.2	-72.1	-179	160.9	0	0	110.8	D106 V107 S112 L113	D106-E110 PolarHBondContact O-N 2.85Å; V107-E110 PolarHBondContact O-N 3.17Å; E110-S112 PolarHBondContact O-N 3.19Å; E110-L113 WeakPolarHBondContact O-CG 3.39Å; E110-L113 PolarHBondContact O-N 3.33Å
111	D	50.6	Low	54.6	Low	87 Å²	87	105.5 Å²	105.5	47%	0.465	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-68	-10.9	169.4	-141.3	36.1	0	0	0	112	V107 L113 M114	V107-D111 PolarHBondContact O-N 3.4Å; D111-L113 PolarHBondContact O-N 3.34Å; D111-L113 VanDerWaalsContact O-N 3.1Å; D111-M114 WeakPolarHBondContact O-CG 3.45Å; D111-M114 PolarHBondContact O-N 2.89Å
112	S	49	Very low	55.6	Low	54 Å²	54	103.5 Å²	103.5	38%	0.378	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-74.3	10.5	173.2	89.7	0	0	0	0	114.8	I108 K109 E110 M114 K115	I108-S112 PolarHBondContact O-N 2.8Å; K109-S112 WeakPolarHBondContact O-CA 3.46Å; K109-S112 VanDerWaalsContact O-CB 3.23Å; K109-S112 WeakPolarHBondContact O-CB 3.3Å; K109-S112 PolarHBondContact O-N 3.18Å; K109-S112 VanDerWaalsContact O-N 3.1Å; K109-S112 PolarHBondContact O-OG 3.33Å; E110-S112 PolarHBondContact O-N 3.19Å; S112-M114 PolarHBondContact O-N 3.25Å; S112-K115 PolarHBondContact O-N 3.1Å
113	L	50.8	Low	56.4	Low	122 Å²	122	102.3 Å²	102.3	64%	0.639	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-45.3	-23.7	152.5	-80.8	164.7	0	0	0	112.7	E110 D111 K115 D116 Y117	E110-L113 WeakPolarHBondContact O-CG 3.39Å; E110-L113 PolarHBondContact O-N 3.33Å; D111-L113 PolarHBondContact O-N 3.34Å; D111-L113 VanDerWaalsContact O-N 3.1Å; L113-K115 PolarHBondContact O-N 3.45Å; L113-D116 PolarHBondContact O-N 3.02Å; L113-Y117 WeakPolarHBondContact O-CD2 3.35Å; L113-Y117 WeakPolarHBondContact O-CE2 3.48Å
114	M	51.5	Low	57.6	Low	64 Å²	64	100.4 Å²	100.4	32%	0.315	49%	0.486	S	S	.	.	H	α-helix	trans	-38.3	-26.7	160.9	-75.5	-71.6	-123.5	0	0	115.7	D111 S112 D116 F118	D111-M114 WeakPolarHBondContact O-CG 3.45Å; D111-M114 PolarHBondContact O-N 2.89Å; S112-M114 PolarHBondContact O-N 3.25Å; M114-D116 PolarHBondContact O-N 3.41Å; M114-F118 WeakPolarHBondContact O-CD2 3.36Å
115	K	49.4	Very low	58.8	Low	148 Å²	148	102.7 Å²	102.7	64%	0.643	50%	0.495	S	S	*	.	H	α-helix	trans	-62.4	-38.7	179.6	-117.8	174.1	-176.7	170.9	0	114	S112 L113 Y117 Y119	S112-K115 PolarHBondContact O-N 3.1Å; L113-K115 PolarHBondContact O-N 3.45Å; K115-Y117 VanDerWaalsContact C-N 3.33Å; K115-Y117 PolarHBondContact O-N 3.46Å; K115-Y119 WeakPolarHBondContact O-CD2 3.49Å
116	D	50.2	Low	59.6	Low	115 Å²	115	105.7 Å²	105.7	62%	0.615	51%	0.508	S	S	*	.	H	α-helix	trans	-72.9	-26.2	-172.6	-81.4	-22.5	0	0	0	113.3	L113 M114 F118 Y119 K120	L113-D116 PolarHBondContact O-N 3.02Å; M114-D116 PolarHBondContact O-N 3.41Å; D116-F118 PolarHBondContact O-N 3.31Å; D116-Y119 PolarHBondContact O-N 3.05Å; D116-K120 PolarHBondContact O-N 3.48Å
117	Y	50.2	Low	60.4	Low	119 Å²	119	105.1 Å²	105.1	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-39.9	179.4	-62.2	-95.1	0	0	0	112.2	L113 K115 Y119 K120	L113-Y117 WeakPolarHBondContact O-CD2 3.35Å; L113-Y117 WeakPolarHBondContact O-CE2 3.48Å; K115-Y117 VanDerWaalsContact C-N 3.33Å; K115-Y117 PolarHBondContact O-N 3.46Å; Y117-Y119 VanDerWaalsContact C-N 3.26Å; Y117-Y119 PolarHBondContact O-N 3.38Å; Y117-K120 PolarHBondContact O-N 3.31Å
118	F	52.3	Low	61.5	Low	137 Å²	137	102.1 Å²	102.1	60%	0.601	49%	0.492	S	S	*	.	H	α-helix	trans	-67.4	-22.4	176.7	-71.9	-79.3	0	0	0	113.7	M114 D116	M114-F118 WeakPolarHBondContact O-CD2 3.36Å; D116-F118 PolarHBondContact O-N 3.31Å
119	Y	51.1	Low	62.9	Low	180 Å²	180	99 Å²	99	71%	0.706	48%	0.477	S	S	*	.	H	α-helix	trans	-90	-19.1	-179	-72	-71.1	0	0	0	114.2	K115 D116 Y117	K115-Y119 WeakPolarHBondContact O-CD2 3.49Å; D116-Y119 PolarHBondContact O-N 3.05Å; Y117-Y119 VanDerWaalsContact C-N 3.26Å; Y117-Y119 PolarHBondContact O-N 3.38Å
120	K	57.9	Low	64.2	Low	180 Å²	180	93.7 Å²	93.7	78%	0.783	45%	0.454	S	S	*	.	S	Bend	trans	-141.7	79.7	179.4	-69.3	179	-172	159	0	111.1	D116 Y117	D116-K120 PolarHBondContact O-N 3.48Å; Y117-K120 PolarHBondContact O-N 3.31Å
121	P	62.5	Low	65.6	Low	44 Å²	44	91.8 Å²	91.8	29%	0.286	45%	0.448	S	S	.	.			trans	-58	137.7	173.3	25.9	-35.2	0	0	0	110	L123 L385	P121-L123 HydrophobicContact CB-CD1 3.99Å; P121-L123 HydrophobicContact CB-CG 4.04Å; P121-L123 HydrophobicContact CG-CD1 4.21Å; P121-L123 PolarHBondContact O-N 2.97Å; P121-L385 HydrophobicContact CB-CD1 4.3Å
122	P	72.7	Confident	67.2	Low	41 Å²	41	93.3 Å²	93.3	27%	0.266	45%	0.452	S	S	.	.	S	Bend	trans	-78.4	62.3	-173.2	31.6	-35.7	0	0	0	111.7	F130 L131 H388	P122-F130 HydrophobicContact CG-CD1 4.43Å; P122-F130 CarbonylContact O-C 3.6Å; P122-F130 WeakPolarHBondContact O-CA 3.31Å; P122-L131 HydrophobicContact CB-CB 4.39Å; P122-L131 HydrophobicContact CB-CD1 3.92Å; P122-L131 PolarHBondContact O-N 3.3Å; P122-H388 WeakPolarHBondContact CD-NE2 3.34Å; P122-H388 WeakPolarHBondContact CG-NE2 3.41Å
123	L	80	Confident	69	Low	22 Å²	22	101.4 Å²	101.4	12%	0.115	47%	0.474	C	S	.	.	B	Isolated β-bridge	trans	-113.7	139.8	-174	-58.1	176	0	0	0	111.6	P121 K125 L128 T129 F130 V381 R384	P121-L123 HydrophobicContact CB-CD1 3.99Å; P121-L123 HydrophobicContact CB-CG 4.04Å; P121-L123 HydrophobicContact CG-CD1 4.21Å; P121-L123 PolarHBondContact O-N 2.97Å; L123-K125 PolarHBondContact O-N 3.48Å; L123-L128 WeakPolarHBondContact CD2-O 3.36Å; L123-T129 WeakPolarHBondContact CA-O 3.38Å; L123-F130 HydrophobicContact CD2-CD1 3.42Å; L123-F130 VanDerWaalsContact CD2-CD1 3.42Å; L123-F130 HydrophobicContact CD2-CE1 3.6Å; L123-F130 HydrophobicContact CD2-CG 4.03Å; L123-F130 HydrophobicContact CD2-CZ 4.33Å; L123-V381 HydrophobicContact CD1-CG1 4.34Å; L123-R384 HydrophobicContact CD1-CB 4.43Å; L123-R384 HydrophobicContact CD2-CB 4.32Å
124	H	81.1	Confident	70.7	Confident	91 Å²	91	98.7 Å²	98.7	42%	0.421	47%	0.466	S	S	.	.			trans	-67.2	120.9	167.3	-78.4	-82.4	0	0	0	110.7	L126 S127 L128 T129	H124-L126 PolarHBondContact O-N 3.5Å; H124-S127 PolarHBondContact O-N 3.02Å; H124-L128 WeakPolarHBondContact O-CA 3.32Å; H124-L128 PolarHBondContact O-N 3.25Å; H124-T129 PolarHBondContact N-O 3.37Å
125	K	77.4	Confident	72.4	Confident	183 Å²	183	96.6 Å²	96.6	80%	0.796	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-27.1	-172.9	-64.5	-176.4	178.8	-179	0	116.5	L123	L123-K125 PolarHBondContact O-N 3.48Å
126	L	73.5	Confident	74.3	Confident	135 Å²	135	90.2 Å²	90.2	71%	0.707	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-42.2	-177.4	-71.8	167.2	0	0	0	113.9	H124 Y293 W294	H124-L126 PolarHBondContact O-N 3.5Å; L126-Y293 PolarHBondContact O-OH 2.97Å; L126-W294 PolarHBondContact O-NE1 3.07Å
127	S	77.9	Confident	76	Confident	63 Å²	63	87.7 Å²	87.7	44%	0.441	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-14.6	-176.7	-165.8	0	0	0	0	113.4	H124 T129	H124-S127 PolarHBondContact O-N 3.02Å; S127-T129 PolarHBondContact O-N 3.48Å
128	L	82.4	Confident	77.8	Confident	3 Å²	3	84 Å²	84	2%	0.016	41%	0.414	C	S	.	.			trans	52.5	9.4	-170.4	-57.3	-172.8	0	0	0	115.8	L123 H124 Y293 R377 E380 V381 R384	L123-L128 WeakPolarHBondContact CD2-O 3.36Å; H124-L128 WeakPolarHBondContact O-CA 3.32Å; H124-L128 PolarHBondContact O-N 3.25Å; L128-Y293 HydrophobicContact CD1-CD1 3.53Å; L128-Y293 HydrophobicContact CD1-CE1 3.54Å; L128-Y293 HydrophobicContact CD1-CG 4.43Å; L128-Y293 HydrophobicContact CG-CD1 4.18Å; L128-Y293 HydrophobicContact CG-CE1 3.71Å; L128-R377 HydrophobicContact CD1-CG 4.24Å; L128-E380 HydrophobicContact CD1-CB 3.98Å; L128-E380 HydrophobicContact CD1-CG 3.96Å; L128-V381 HydrophobicContact CD1-CG2 3.81Å; L128-V381 HydrophobicContact CD2-CG2 3.67Å; L128-V381 HydrophobicContact CG-CG2 4.38Å; L128-R384 WeakPolarHBondContact O-CD 3.34Å; L128-R384 PolarHBondContact O-NE 3.44Å; L128-R384 PolarHBondContact O-NH1 2.79Å
129	T	85.4	Confident	79.5	Confident	27 Å²	27	78 Å²	78	17%	0.166	39%	0.387	C	S	.	.			trans	-69	149.1	170.7	55.3	0	0	0	0	110.5	L123 H124 S127 E136	L123-T129 WeakPolarHBondContact CA-O 3.38Å; H124-T129 PolarHBondContact N-O 3.37Å; S127-T129 PolarHBondContact O-N 3.48Å; T129-E136 WeakPolarHBondContact CA-OE2 3.3Å
130	F	86.1	Confident	81.3	Confident	8 Å²	8	74 Å²	74	4%	0.035	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-62	147	170.4	-62.5	-77.6	0	0	0	110.7	P122 L123 E132 L135 E136 Y139 R384 Y387 H388	P122-F130 HydrophobicContact CG-CD1 4.43Å; P122-F130 CarbonylContact O-C 3.6Å; P122-F130 WeakPolarHBondContact O-CA 3.31Å; L123-F130 HydrophobicContact CD2-CD1 3.42Å; L123-F130 VanDerWaalsContact CD2-CD1 3.42Å; L123-F130 HydrophobicContact CD2-CE1 3.6Å; L123-F130 HydrophobicContact CD2-CG 4.03Å; L123-F130 HydrophobicContact CD2-CZ 4.33Å; F130-E132 VanDerWaalsContact C-N 3.28Å; F130-L135 HydrophobicContact CB-CB 4.48Å; F130-L135 HydrophobicContact CB-CD2 4.23Å; F130-L135 HydrophobicContact CB-CG 4.46Å; F130-L135 HydrophobicContact CD1-CD2 3.59Å; F130-L135 HydrophobicContact CD1-CG 4.29Å; F130-L135 HydrophobicContact CD2-CD2 4.33Å; F130-L135 HydrophobicContact CD2-CG 4.14Å; F130-L135 HydrophobicContact CE1-CD2 3.95Å; F130-L135 HydrophobicContact CE2-CG 4.45Å; F130-L135 HydrophobicContact CG-CD2 3.8Å; F130-L135 HydrophobicContact CG-CG 4.06Å; F130-L135 HydrophobicContact CZ-CD2 4.45Å; F130-E136 HydrophobicContact CB-CB 4.21Å; F130-E136 HydrophobicContact CD2-CB 4.41Å; F130-E136 WeakPolarHBondContact CD2-OE2 3.38Å; F130-E136 PolarHBondContact N-OE2 2.87Å; F130-Y139 HydrophobicContact CE2-CD1 4.16Å; F130-Y139 HydrophobicContact CE2-CD2 4.2Å; F130-Y139 AromaticContact CE2-CG 3.81Å; F130-Y139 HydrophobicContact CE2-CG 3.81Å; F130-R384 HydrophobicContact CE1-CB 4.33Å; F130-R384 HydrophobicContact CE2-CB 4.47Å; F130-R384 HydrophobicContact CE2-CG 4.4Å; F130-R384 HydrophobicContact CZ-CB 3.82Å; F130-R384 HydrophobicContact CZ-CG 4.23Å; F130-R384 WeakPolarHBondContact CZ-O 3.39Å; F130-Y387 HydrophobicContact CE2-CD1 4.24Å; F130-Y387 HydrophobicContact CZ-CD1 4.17Å; F130-H388 HydrophobicContact CE1-CB 4.19Å; F130-H388 AromaticContact CE1-CD2 3.92Å
131	L	84.5	Confident	82.7	Confident	104 Å²	104	69.5 Å²	69.5	55%	0.545	35%	0.354	S	S	.	.	S	Bend	trans	-64.9	-34.9	173.9	-75.4	162.9	0	0	0	111	P122	P122-L131 HydrophobicContact CB-CB 4.39Å; P122-L131 HydrophobicContact CB-CD1 3.92Å; P122-L131 PolarHBondContact O-N 3.3Å
132	E	85.6	Confident	83.8	Confident	119 Å²	119	68.9 Å²	68.9	56%	0.556	35%	0.351	S	S	*	.	S	Bend	trans	-86.7	126.4	178.3	-146.9	-163.8	152.2	0	0	111.3	F130 S134 L135 E136	F130-E132 VanDerWaalsContact C-N 3.28Å; E132-S134 VanDerWaalsContact CG-OG 3.23Å; E132-S134 WeakPolarHBondContact CG-OG 3.26Å; E132-S134 PolarHBondContact OE1-OG 3.34Å; E132-L135 HydrophobicContact CB-CB 4.16Å; E132-E136 PolarHBondContact O-N 2.72Å; E132-E136 VanDerWaalsContact O-N 3.1Å
133	R	86	Confident	84.3	Confident	224 Å²	224	67.5 Å²	67.5	85%	0.845	34%	0.341	S	S	*	.	H	α-helix	trans	-72.9	-34.5	-173.9	-67.1	-177.7	179.6	172.8	0.5	113.6	S137	R133-S137 WeakPolarHBondContact O-CB 3.32Å; R133-S137 PolarHBondContact O-N 3.1Å
134	S	86.9	Confident	84.6	Confident	66 Å²	66	69.1 Å²	69.1	46%	0.462	35%	0.348	S	S	.	.	H	α-helix	trans	-55.6	-55.4	170.5	36.5	0	0	0	0	110.6	E132 E136 S137 A138	E132-S134 VanDerWaalsContact CG-OG 3.23Å; E132-S134 WeakPolarHBondContact CG-OG 3.26Å; E132-S134 PolarHBondContact OE1-OG 3.34Å; S134-E136 PolarHBondContact O-N 3.49Å; S134-S137 WeakPolarHBondContact O-CB 3.42Å; S134-S137 PolarHBondContact O-N 2.92Å; S134-S137 VanDerWaalsContact O-N 3.14Å; S134-A138 PolarHBondContact O-N 2.86Å
135	L	86.2	Confident	84.7	Confident	20 Å²	20	69.3 Å²	69.3	11%	0.105	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-42.1	-179.7	-172.6	65.5	0	0	0	112.6	F130 E132 S137 A138 Y139 Y387 V391	F130-L135 HydrophobicContact CB-CB 4.48Å; F130-L135 HydrophobicContact CB-CD2 4.23Å; F130-L135 HydrophobicContact CB-CG 4.46Å; F130-L135 HydrophobicContact CD1-CD2 3.59Å; F130-L135 HydrophobicContact CD1-CG 4.29Å; F130-L135 HydrophobicContact CD2-CD2 4.33Å; F130-L135 HydrophobicContact CD2-CG 4.14Å; F130-L135 HydrophobicContact CE1-CD2 3.95Å; F130-L135 HydrophobicContact CE2-CG 4.45Å; F130-L135 HydrophobicContact CG-CD2 3.8Å; F130-L135 HydrophobicContact CG-CG 4.06Å; F130-L135 HydrophobicContact CZ-CD2 4.45Å; E132-L135 HydrophobicContact CB-CB 4.16Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.09Å; L135-A138 PolarHBondContact O-N 2.67Å; L135-Y139 WeakPolarHBondContact O-CB 3.28Å; L135-Y139 PolarHBondContact O-N 2.96Å; L135-Y387 HydrophobicContact CD1-CE1 4.02Å; L135-V391 HydrophobicContact CD1-CG1 4.28Å
136	E	89.3	Confident	84.9	Confident	13 Å²	13	62.6 Å²	62.6	6%	0.061	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-35.2	173.6	-179.3	67.8	-161.7	0	0	112.1	T129 F130 E132 S134 R140 R384	T129-E136 WeakPolarHBondContact CA-OE2 3.3Å; F130-E136 HydrophobicContact CB-CB 4.21Å; F130-E136 HydrophobicContact CD2-CB 4.41Å; F130-E136 WeakPolarHBondContact CD2-OE2 3.38Å; F130-E136 PolarHBondContact N-OE2 2.87Å; E132-E136 PolarHBondContact O-N 2.72Å; E132-E136 VanDerWaalsContact O-N 3.1Å; S134-E136 PolarHBondContact O-N 3.49Å; E136-R140 WeakPolarHBondContact O-CG 3.42Å; E136-R140 PolarHBondContact O-N 2.92Å; E136-R140 IonicContact OE1-CZ 2.74Å; E136-R140 IonicContact OE1-NE 2.69Å; E136-R140 PolarHBondContact OE1-NE 2.85Å; E136-R140 IonicContact OE1-NH2 3.37Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å; E136-R384 IonicContact OE1-NH1 3.78Å; E136-R384 IonicContact OE1-NH2 2.71Å; E136-R384 IonicContact OE2-CZ 3.99Å; E136-R384 IonicContact OE2-NH1 2.64Å; E136-R384 PolarHBondContact OE2-NH1 3.47Å; E136-R384 IonicContact OE2-NH2 3.69Å
137	S	87.9	Confident	85.2	Confident	63 Å²	63	57.6 Å²	57.6	44%	0.441	30%	0.295	S	S	.	.	H	α-helix	trans	-68.3	-44.6	174.6	-167.1	0	0	0	0	111.7	R133 S134 L135 R140 I141	R133-S137 WeakPolarHBondContact O-CB 3.32Å; R133-S137 PolarHBondContact O-N 3.1Å; S134-S137 WeakPolarHBondContact O-CB 3.42Å; S134-S137 PolarHBondContact O-N 2.92Å; S134-S137 VanDerWaalsContact O-N 3.14Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.09Å; S137-R140 PolarHBondContact O-N 3.08Å; S137-I141 WeakPolarHBondContact O-CG1 3.16Å; S137-I141 PolarHBondContact O-N 2.82Å
138	A	87.5	Confident	85.2	Confident	41 Å²	41	58.1 Å²	58.1	34%	0.339	29%	0.291	S	S	.	.	H	α-helix	trans	-60.7	-47.2	175.9	0	0	0	0	0	111.1	S134 L135 R140 I141 S142 Y387	S134-A138 PolarHBondContact O-N 2.86Å; L135-A138 PolarHBondContact O-N 2.67Å; A138-R140 VanDerWaalsContact C-N 3.3Å; A138-R140 PolarHBondContact O-N 2.84Å; A138-I141 PolarHBondContact O-N 3.47Å; A138-I141 VanDerWaalsContact O-N 3.13Å; A138-S142 VanDerWaalsContact O-CB 3.3Å; A138-S142 WeakPolarHBondContact O-CB 3.34Å; A138-S142 PolarHBondContact O-N 2.67Å; A138-Y387 VanDerWaalsContact C-OH 3.28Å
139	Y	88.4	Confident	84.7	Confident	11 Å²	11	63 Å²	63	4%	0.043	32%	0.317	C	S	.	.	H	α-helix	trans	-56.1	-40.6	176.1	174.7	-112.4	0	0	0	113.3	F130 L135 I141 W238 Y383 R384 Y387	F130-Y139 HydrophobicContact CE2-CD1 4.16Å; F130-Y139 HydrophobicContact CE2-CD2 4.2Å; F130-Y139 AromaticContact CE2-CG 3.81Å; F130-Y139 HydrophobicContact CE2-CG 3.81Å; L135-Y139 WeakPolarHBondContact O-CB 3.28Å; L135-Y139 PolarHBondContact O-N 2.96Å; Y139-I141 VanDerWaalsContact C-N 3.34Å; Y139-W238 HydrophobicContact CD1-CH2 4.28Å; Y139-W238 HydrophobicContact CD1-CZ3 4.13Å; Y139-W238 AromaticContact CE1-CH2 3.64Å; Y139-W238 HydrophobicContact CE1-CH2 3.64Å; Y139-W238 AromaticContact CE1-CZ3 3.7Å; Y139-W238 HydrophobicContact CE1-CZ3 3.7Å; Y139-Y383 HydrophobicContact CE2-CD1 4.04Å; Y139-Y383 AromaticContact CE2-CE1 3.78Å; Y139-Y383 HydrophobicContact CE2-CE1 3.78Å; Y139-Y383 WeakPolarHBondContact OH-CD1 3.36Å; Y139-R384 HydrophobicContact CE1-CG 4.29Å; Y139-R384 VanDerWaalsContact CE1-CZ 3.49Å; Y139-R384 HydrophobicContact CE2-CG 4.34Å; Y139-Y387 AromaticContact CD2-CD1 3.57Å; Y139-Y387 HydrophobicContact CD2-CD1 3.57Å; Y139-Y387 HydrophobicContact CD2-CD2 4.09Å; Y139-Y387 AromaticContact CD2-CE1 3.98Å; Y139-Y387 HydrophobicContact CD2-CE1 3.98Å; Y139-Y387 HydrophobicContact CD2-CE2 4.48Å; Y139-Y387 AromaticContact CD2-CG 3.62Å; Y139-Y387 HydrophobicContact CD2-CG 3.62Å; Y139-Y387 HydrophobicContact CE2-CG 4.26Å; Y139-Y387 HydrophobicContact CG-CD1 4.19Å; Y139-Y387 HydrophobicContact CG-CE1 4.29Å; Y139-Y387 PolarHBondContact N-OH 3.38Å
140	R	89	Confident	83.7	Confident	97 Å²	97	65.6 Å²	65.6	37%	0.366	33%	0.327	S	S	.	.	H	α-helix	trans	-69.6	-31.3	179.5	-72.3	172.6	-174.5	-159	2.7	113.3	E136 S137 A138 W238	E136-R140 WeakPolarHBondContact O-CG 3.42Å; E136-R140 PolarHBondContact O-N 2.92Å; E136-R140 IonicContact OE1-CZ 2.74Å; E136-R140 IonicContact OE1-NE 2.69Å; E136-R140 PolarHBondContact OE1-NE 2.85Å; E136-R140 IonicContact OE1-NH2 3.37Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å; S137-R140 PolarHBondContact O-N 3.08Å; A138-R140 VanDerWaalsContact C-N 3.3Å; A138-R140 PolarHBondContact O-N 2.84Å; R140-W238 HydrophobicContact CB-CB 4.4Å; R140-W238 HydrophobicContact CB-CD2 4.1Å; R140-W238 HydrophobicContact CB-CE3 3.96Å; R140-W238 HydrophobicContact CB-CG 4.29Å; R140-W238 HydrophobicContact CG-CD2 3.71Å; R140-W238 HydrophobicContact CG-CE3 3.74Å; R140-W238 HydrophobicContact CG-CG 4.18Å; R140-W238 HydrophobicContact CG-CH2 4.42Å; R140-W238 HydrophobicContact CG-CZ2 4.39Å; R140-W238 HydrophobicContact CG-CZ3 4.09Å
141	I	87.2	Confident	82.4	Confident	84 Å²	84	68.3 Å²	68.3	43%	0.431	35%	0.351	S	S	.	.	H	α-helix	trans	-91.4	-30.5	-177.1	-63.6	168.2	0	0	0	111.5	S137 A138 Y139 Y143 Q144 E145	S137-I141 WeakPolarHBondContact O-CG1 3.16Å; S137-I141 PolarHBondContact O-N 2.82Å; A138-I141 PolarHBondContact O-N 3.47Å; A138-I141 VanDerWaalsContact O-N 3.13Å; Y139-I141 VanDerWaalsContact C-N 3.34Å; I141-Y143 VanDerWaalsContact C-N 3.29Å; I141-Y143 PolarHBondContact O-N 2.99Å; I141-Q144 CarbonylContact O-C 3.53Å; I141-Q144 WeakPolarHBondContact O-CA 3.45Å; I141-Q144 WeakPolarHBondContact O-CB 3.36Å; I141-Q144 PolarHBondContact O-N 3.29Å; I141-E145 HydrophobicContact CG2-CB 4.37Å; I141-E145 PolarHBondContact O-N 3.19Å
142	S	85.7	Confident	80.9	Confident	32 Å²	32	66.9 Å²	66.9	22%	0.224	35%	0.354	C	S	.	.	H	α-helix	trans	-47.5	-42.2	-172.9	167.2	0	0	0	0	114.8	A138 E145 E146 Y387	A138-S142 VanDerWaalsContact O-CB 3.3Å; A138-S142 WeakPolarHBondContact O-CB 3.34Å; A138-S142 PolarHBondContact O-N 2.67Å; S142-E145 PolarHBondContact O-N 3.19Å; S142-E146 WeakPolarHBondContact O-CB 3.35Å; S142-E146 PolarHBondContact O-N 3.08Å; S142-Y387 WeakPolarHBondContact OG-CE2 3.35Å
143	Y	83	Confident	79.3	Confident	12 Å²	12	64.2 Å²	64.2	5%	0.047	35%	0.346	C	S	.	.	H	α-helix	trans	-69.2	-36.4	176.9	-176.1	-90.6	0	0	0	113.2	I141 V147 P159 T160 R241	I141-Y143 VanDerWaalsContact C-N 3.29Å; I141-Y143 PolarHBondContact O-N 2.99Å; Y143-V147 HydrophobicContact CE1-CG2 4.32Å; Y143-V147 WeakPolarHBondContact O-CG2 3.32Å; Y143-V147 PolarHBondContact O-N 2.85Å; Y143-P159 HydrophobicContact CD2-CB 3.8Å; Y143-P159 HydrophobicContact CE2-CB 4.18Å; Y143-T160 HydrophobicContact CE2-CG2 4.27Å; Y143-R241 VanDerWaalsContact CG-NH1 3.28Å
144	Q	85.6	Confident	77.8	Confident	56 Å²	56	62.6 Å²	62.6	26%	0.262	35%	0.348	S	S	.	.	H	α-helix	trans	-70.4	-38.4	174.8	177	-179.5	-21	0	0	110.4	I141 V147 E148 R233	I141-Q144 CarbonylContact O-C 3.53Å; I141-Q144 WeakPolarHBondContact O-CA 3.45Å; I141-Q144 WeakPolarHBondContact O-CB 3.36Å; I141-Q144 PolarHBondContact O-N 3.29Å; Q144-V147 PolarHBondContact O-N 2.87Å; Q144-E148 VanDerWaalsContact O-CB 3.28Å; Q144-E148 WeakPolarHBondContact O-CB 3.37Å; Q144-E148 PolarHBondContact O-N 2.88Å; Q144-R233 HydrophobicContact CG-CG 4.3Å
145	E	84.2	Confident	76.7	Confident	95 Å²	95	63.6 Å²	63.6	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-40.6	175.3	-179.3	170.7	-162.1	0	0	112.4	I141 S142 V147 E148 N149	I141-E145 HydrophobicContact CG2-CB 4.37Å; I141-E145 PolarHBondContact O-N 3.19Å; S142-E145 PolarHBondContact O-N 3.19Å; E145-V147 PolarHBondContact O-N 3.33Å; E145-E148 PolarHBondContact O-N 3.22Å; E145-E148 VanDerWaalsContact O-N 3.13Å; E145-N149 WeakPolarHBondContact CG-ND2 3.2Å; E145-N149 VanDerWaalsContact O-CB 3.3Å; E145-N149 WeakPolarHBondContact O-CB 3.27Å; E145-N149 PolarHBondContact O-N 3.12Å
146	E	80.6	Confident	75.8	Confident	42 Å²	42	71 Å²	71	20%	0.196	38%	0.383	C	S	.	.	H	α-helix	trans	-61.7	-42.7	174.4	-170.4	-179.6	-169.2	0	0	111.9	S142 E148 Q150 S158 P159 T160	S142-E146 WeakPolarHBondContact O-CB 3.35Å; S142-E146 PolarHBondContact O-N 3.08Å; E146-E148 VanDerWaalsContact C-N 3.28Å; E146-E148 PolarHBondContact O-N 3.05Å; E146-Q150 PolarHBondContact O-N 3.42Å; E146-S158 WeakPolarHBondContact OE1-CB 3.39Å; E146-S158 PolarHBondContact OE1-OG 3.08Å; E146-P159 WeakPolarHBondContact OE2-CB 3.43Å; E146-P159 VanDerWaalsContact OE2-CD 3.29Å; E146-P159 WeakPolarHBondContact OE2-CD 3.38Å; E146-P159 WeakPolarHBondContact OE2-CG 3.26Å; E146-T160 HydrophobicContact CG-CG2 4.08Å
147	V	80.3	Confident	74.8	Confident	30 Å²	30	73.3 Å²	73.3	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-67.1	-27.7	174.3	171.6	0	0	0	0	112.4	Y143 Q144 E145 T160 M217	Y143-V147 HydrophobicContact CE1-CG2 4.32Å; Y143-V147 WeakPolarHBondContact O-CG2 3.32Å; Y143-V147 PolarHBondContact O-N 2.85Å; Q144-V147 PolarHBondContact O-N 2.87Å; E145-V147 PolarHBondContact O-N 3.33Å; V147-T160 HydrophobicContact CG2-CG2 3.85Å; V147-M217 HydrophobicContact CG1-SD 4.41Å; V147-M217 HydrophobicContact CG2-SD 4.32Å
148	E	76.9	Confident	74.4	Confident	74 Å²	74	70.7 Å²	70.7	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-82.6	-47.6	-179.4	165.7	157.4	-169.7	0	0	112.9	Q144 E145 E146 Q150 R233	Q144-E148 VanDerWaalsContact O-CB 3.28Å; Q144-E148 WeakPolarHBondContact O-CB 3.37Å; Q144-E148 PolarHBondContact O-N 2.88Å; E145-E148 PolarHBondContact O-N 3.22Å; E145-E148 VanDerWaalsContact O-N 3.13Å; E146-E148 VanDerWaalsContact C-N 3.28Å; E146-E148 PolarHBondContact O-N 3.05Å; E148-Q150 PolarHBondContact O-N 3.39Å; E148-Q150 PolarHBondContact O-NE2 3.49Å; E148-Q150 VanDerWaalsContact O-NE2 3.11Å; E148-R233 VanDerWaalsContact CD-NE 3.27Å; E148-R233 IonicContact OE1-CZ 3.74Å; E148-R233 IonicContact OE1-NE 2.67Å; E148-R233 IonicContact OE1-NH2 2.95Å; E148-R233 PolarHBondContact OE1-NH2 3.3Å; E148-R233 IonicContact OE2-CZ 3.55Å; E148-R233 IonicContact OE2-NE 3.61Å; E148-R233 PolarHBondContact OE2-NE 3.21Å; E148-R233 IonicContact OE2-NH2 2.65Å; E148-R233 PolarHBondContact OE2-NH2 2.93Å
149	N	72	Confident	74.1	Confident	104 Å²	104	70 Å²	70	56%	0.556	38%	0.378	S	S	*	.	H	α-helix	trans	-73.2	-6	-176.9	-71.3	-15.1	0	0	0	113.4	E145 A151	E145-N149 WeakPolarHBondContact CG-ND2 3.2Å; E145-N149 VanDerWaalsContact O-CB 3.3Å; E145-N149 WeakPolarHBondContact O-CB 3.27Å; E145-N149 PolarHBondContact O-N 3.12Å; N149-A151 PolarHBondContact O-N 3.44Å
150	Q	65	Low	73.9	Confident	83 Å²	83	70 Å²	70	39%	0.388	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	39.6	173.4	-68.3	152.7	58.5	0	0	112.6	E146 E148 A152 Y220	E146-Q150 PolarHBondContact O-N 3.42Å; E148-Q150 PolarHBondContact O-N 3.39Å; E148-Q150 PolarHBondContact O-NE2 3.49Å; E148-Q150 VanDerWaalsContact O-NE2 3.11Å; Q150-A152 PolarHBondContact O-N 2.9Å; Q150-Y220 HydrophobicContact CB-CE2 4.36Å; Q150-Y220 HydrophobicContact CG-CD2 4.45Å; Q150-Y220 HydrophobicContact CG-CE2 3.75Å; Q150-Y220 PolarHBondContact OE1-OH 2.64Å; Q150-Y220 VanDerWaalsContact OE1-OH 3.08Å
151	A	58	Low	73.8	Confident	65 Å²	65	66.5 Å²	66.5	54%	0.537	37%	0.367	S	S	.	.			trans	-64.1	108.9	174.6	0	0	0	0	0	109.2	N149 V153	N149-A151 PolarHBondContact O-N 3.44Å; A151-V153 PolarHBondContact O-N 2.95Å
152	A	52.8	Low	73.8	Confident	74 Å²	74	64 Å²	64	61%	0.612	36%	0.357	S	S	*	.			trans	-55.9	134.4	172.5	0	0	0	0	0	109.3	Q150 Q154	Q150-A152 PolarHBondContact O-N 2.9Å; A152-Q154 PolarHBondContact O-N 3.19Å
153	V	52.9	Low	73.9	Confident	63 Å²	63	63.4 Å²	63.4	38%	0.382	35%	0.352	S	S	.	.			trans	-63.6	100.6	-174.1	-178.9	0	0	0	0	110.3	A151 T155 F161 A218	A151-V153 PolarHBondContact O-N 2.95Å; V153-T155 VanDerWaalsContact CG1-O 3.28Å; V153-T155 WeakPolarHBondContact CG1-O 3.41Å; V153-F161 HydrophobicContact CG1-CB 4.37Å; V153-A218 WeakPolarHBondContact CG2-O 3.31Å
154	Q	54.1	Low	74.2	Confident	189 Å²	189	63.9 Å²	63.9	88%	0.883	36%	0.355	S	S	*	.			trans	-90.3	-14	174.6	-68.7	-174.2	5.6	0	0	112.7	A152	A152-Q154 PolarHBondContact O-N 3.19Å
155	T	65.2	Low	74.5	Confident	87 Å²	87	65 Å²	65	53%	0.534	36%	0.362	S	S	.	.	S	Bend	trans	-141.8	146.3	-177.8	68.4	0	0	0	0	112.7	V153 A157 S158	V153-T155 VanDerWaalsContact CG1-O 3.28Å; V153-T155 WeakPolarHBondContact CG1-O 3.41Å; T155-A157 PolarHBondContact O-N 3.01Å; T155-A157 VanDerWaalsContact O-N 3.11Å; T155-S158 PolarHBondContact O-N 3.38Å
156	F	66.4	Low	74.8	Confident	177 Å²	177	61.6 Å²	61.6	78%	0.776	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-6.4	173.5	-66.4	-68.2	0	0	0	114.2	F161	F156-F161 HydrophobicContact CB-CE1 4.42Å; F156-F161 HydrophobicContact CD1-CD1 4.42Å; F156-F161 AromaticContact CD1-CE1 3.67Å; F156-F161 HydrophobicContact CD1-CE1 3.67Å; F156-F161 AromaticContact CD1-CZ 3.86Å; F156-F161 HydrophobicContact CD1-CZ 3.86Å; F156-F161 HydrophobicContact CE1-CZ 4.29Å; F156-F161 WeakPolarHBondContact O-CD1 3.26Å
157	A	67.5	Low	75.4	Confident	60 Å²	60	60.5 Å²	60.5	50%	0.496	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	3.5	-179.1	0	0	0	0	0	113.6	T155	T155-A157 PolarHBondContact O-N 3.01Å; T155-A157 VanDerWaalsContact O-N 3.11Å
158	S	80.9	Confident	76	Confident	8 Å²	8	62.1 Å²	62.1	6%	0.056	35%	0.349	C	S	.	.			trans	-60.1	131.5	175.7	163.8	0	0	0	0	111.4	E146 T155 T160 F161 S162	E146-S158 WeakPolarHBondContact OE1-CB 3.39Å; E146-S158 PolarHBondContact OE1-OG 3.08Å; T155-S158 PolarHBondContact O-N 3.38Å; S158-T160 PolarHBondContact O-N 2.96Å; S158-T160 PolarHBondContact OG-N 2.77Å; S158-T160 PolarHBondContact OG-OG1 3.38Å; S158-F161 PolarHBondContact O-N 2.93Å; S158-S162 PolarHBondContact O-N 2.78Å; S158-S162 PolarHBondContact O-OG 3.25Å
159	P	81.2	Confident	76.8	Confident	27 Å²	27	62.5 Å²	62.5	18%	0.175	35%	0.353	C	S	.	.	H	α-helix	trans	-53.5	-33.4	172.3	-28.8	33.8	0	0	0	114.8	Y143 E146 S163 H290 Y383	Y143-P159 HydrophobicContact CD2-CB 3.8Å; Y143-P159 HydrophobicContact CE2-CB 4.18Å; E146-P159 WeakPolarHBondContact OE2-CB 3.43Å; E146-P159 VanDerWaalsContact OE2-CD 3.29Å; E146-P159 WeakPolarHBondContact OE2-CD 3.38Å; E146-P159 WeakPolarHBondContact OE2-CG 3.26Å; P159-S163 WeakPolarHBondContact O-CB 3.43Å; P159-S163 PolarHBondContact O-N 2.79Å; P159-S163 VanDerWaalsContact O-N 3.1Å; P159-H290 PolarHBondContact O-CE1 2.91Å; P159-H290 VanDerWaalsContact O-CE1 3.24Å; P159-Y383 WeakPolarHBondContact CB-OH 3.4Å; P159-Y383 WeakPolarHBondContact CG-OH 3.4Å
160	T	84.1	Confident	77.8	Confident	12 Å²	12	57.6 Å²	57.6	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-69.5	-41.2	176.4	65.7	0	0	0	0	111.9	Y143 E146 V147 S158 S163 F164	Y143-T160 HydrophobicContact CE2-CG2 4.27Å; E146-T160 HydrophobicContact CG-CG2 4.08Å; V147-T160 HydrophobicContact CG2-CG2 3.85Å; S158-T160 PolarHBondContact O-N 2.96Å; S158-T160 PolarHBondContact OG-N 2.77Å; S158-T160 PolarHBondContact OG-OG1 3.38Å; T160-S163 PolarHBondContact O-N 3.46Å; T160-F164 PolarHBondContact O-N 2.94Å; T160-F164 VanDerWaalsContact O-N 3.13Å
161	F	86.4	Confident	79.1	Confident	23 Å²	23	54.7 Å²	54.7	10%	0.101	32%	0.316	C	S	.	.	H	α-helix	trans	-70.2	-42	178	-176	-98	0	0	0	112.3	V153 F156 S158 S163 F164 L165 F219	V153-F161 HydrophobicContact CG1-CB 4.37Å; F156-F161 HydrophobicContact CB-CE1 4.42Å; F156-F161 HydrophobicContact CD1-CD1 4.42Å; F156-F161 AromaticContact CD1-CE1 3.67Å; F156-F161 HydrophobicContact CD1-CE1 3.67Å; F156-F161 AromaticContact CD1-CZ 3.86Å; F156-F161 HydrophobicContact CD1-CZ 3.86Å; F156-F161 HydrophobicContact CE1-CZ 4.29Å; F156-F161 WeakPolarHBondContact O-CD1 3.26Å; S158-F161 PolarHBondContact O-N 2.93Å; F161-S163 VanDerWaalsContact C-N 3.34Å; F161-S163 PolarHBondContact O-N 3.49Å; F161-F164 HydrophobicContact CD2-CD1 4.24Å; F161-F164 HydrophobicContact CE2-CD1 4.1Å; F161-F164 HydrophobicContact CE2-CE1 4.34Å; F161-F164 WeakPolarHBondContact O-CB 3.29Å; F161-F164 PolarHBondContact O-N 2.82Å; F161-F164 VanDerWaalsContact O-N 3.11Å; F161-L165 HydrophobicContact CD1-CD1 4.18Å; F161-L165 HydrophobicContact CD1-CG 4.41Å; F161-L165 HydrophobicContact CE1-CD1 3.65Å; F161-L165 HydrophobicContact CE1-CD2 4.36Å; F161-L165 HydrophobicContact CE1-CG 3.98Å; F161-L165 HydrophobicContact CZ-CD1 4.36Å; F161-L165 HydrophobicContact CZ-CD2 4.27Å; F161-L165 HydrophobicContact CZ-CG 4.34Å; F161-L165 PolarHBondContact O-N 3.39Å; F161-F219 HydrophobicContact CD2-CZ 4.5Å; F161-F219 HydrophobicContact CE2-CE1 4.39Å; F161-F219 AromaticContact CE2-CZ 3.96Å; F161-F219 HydrophobicContact CE2-CZ 3.96Å
162	S	86.8	Confident	80.8	Confident	31 Å²	31	56.5 Å²	56.5	22%	0.217	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-42.9	173.8	-54.2	0	0	0	0	111.4	S158 F164 L165 D166	S158-S162 PolarHBondContact O-N 2.78Å; S158-S162 PolarHBondContact O-OG 3.25Å; S162-F164 VanDerWaalsContact C-N 3.25Å; S162-F164 PolarHBondContact O-N 3.37Å; S162-L165 PolarHBondContact O-N 3.24Å; S162-L165 VanDerWaalsContact O-N 3.07Å; S162-D166 PolarHBondContact O-N 2.94Å
163	S	88.3	Confident	82.7	Confident	19 Å²	19	54.3 Å²	54.3	13%	0.133	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-32.8	173.8	-171.6	0	0	0	0	113	P159 T160 F161 M167	P159-S163 WeakPolarHBondContact O-CB 3.43Å; P159-S163 PolarHBondContact O-N 2.79Å; P159-S163 VanDerWaalsContact O-N 3.1Å; T160-S163 PolarHBondContact O-N 3.46Å; F161-S163 VanDerWaalsContact C-N 3.34Å; F161-S163 PolarHBondContact O-N 3.49Å; S163-M167 VanDerWaalsContact O-CG 3.24Å; S163-M167 WeakPolarHBondContact O-CG 3.46Å; S163-M167 PolarHBondContact O-N 3.2Å
164	F	90.3	Very high	84.6	Confident	23 Å²	23	51.6 Å²	51.6	10%	0.101	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-42.5	172	155.8	-102.4	0	0	0	112.4	T160 F161 S162 M167 L168 L211 A214 I215 A218 F219	T160-F164 PolarHBondContact O-N 2.94Å; T160-F164 VanDerWaalsContact O-N 3.13Å; F161-F164 HydrophobicContact CD2-CD1 4.24Å; F161-F164 HydrophobicContact CE2-CD1 4.1Å; F161-F164 HydrophobicContact CE2-CE1 4.34Å; F161-F164 WeakPolarHBondContact O-CB 3.29Å; F161-F164 PolarHBondContact O-N 2.82Å; F161-F164 VanDerWaalsContact O-N 3.11Å; S162-F164 VanDerWaalsContact C-N 3.25Å; S162-F164 PolarHBondContact O-N 3.37Å; F164-M167 PolarHBondContact O-N 3.22Å; F164-L168 HydrophobicContact CE2-CB 4.47Å; F164-L168 HydrophobicContact CZ-CD2 4.13Å; F164-L168 WeakPolarHBondContact O-CB 3.28Å; F164-L168 PolarHBondContact O-N 3.39Å; F164-L211 HydrophobicContact CD2-CD1 4.4Å; F164-L211 HydrophobicContact CE2-CD1 4.19Å; F164-A214 HydrophobicContact CB-CB 4.41Å; F164-I215 HydrophobicContact CD2-CG1 3.78Å; F164-I215 HydrophobicContact CE2-CD1 4.31Å; F164-I215 HydrophobicContact CE2-CG1 3.49Å; F164-I215 VanDerWaalsContact CE2-CG1 3.49Å; F164-A218 HydrophobicContact CB-CB 3.71Å; F164-A218 HydrophobicContact CG-CB 4.2Å; F164-F219 AromaticContact CD1-CE2 3.88Å; F164-F219 HydrophobicContact CD1-CE2 3.88Å; F164-F219 HydrophobicContact CD1-CZ 4.29Å; F164-F219 HydrophobicContact CD2-CE2 4.36Å; F164-F219 AromaticContact CE1-CE2 3.62Å; F164-F219 HydrophobicContact CE1-CE2 3.62Å; F164-F219 AromaticContact CE1-CZ 3.88Å; F164-F219 HydrophobicContact CE1-CZ 3.88Å; F164-F219 HydrophobicContact CE2-CE2 4.15Å; F164-F219 HydrophobicContact CG-CE2 4.24Å; F164-F219 AromaticContact CZ-CE2 3.77Å; F164-F219 HydrophobicContact CZ-CE2 3.77Å; F164-F219 HydrophobicContact CZ-CZ 4.32Å
165	L	90.6	Very high	86.4	Confident	79 Å²	79	48.1 Å²	48.1	41%	0.414	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-42.4	175.4	-66.5	-178.5	0	0	0	111.8	F161 S162 M167 L168 L169	F161-L165 HydrophobicContact CD1-CD1 4.18Å; F161-L165 HydrophobicContact CD1-CG 4.41Å; F161-L165 HydrophobicContact CE1-CD1 3.65Å; F161-L165 HydrophobicContact CE1-CD2 4.36Å; F161-L165 HydrophobicContact CE1-CG 3.98Å; F161-L165 HydrophobicContact CZ-CD1 4.36Å; F161-L165 HydrophobicContact CZ-CD2 4.27Å; F161-L165 HydrophobicContact CZ-CG 4.34Å; F161-L165 PolarHBondContact O-N 3.39Å; S162-L165 PolarHBondContact O-N 3.24Å; S162-L165 VanDerWaalsContact O-N 3.07Å; L165-M167 VanDerWaalsContact C-N 3.35Å; L165-M167 PolarHBondContact O-N 3.47Å; L165-L168 PolarHBondContact O-N 3.26Å; L165-L169 PolarHBondContact O-N 2.63Å
166	D	91.3	Very high	87.7	Confident	23 Å²	23	46.6 Å²	46.6	12%	0.123	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-46.6	175.1	-65.9	-1.1	0	0	0	110.7	S162 L169 C170 N287 F288	S162-D166 PolarHBondContact O-N 2.94Å; D166-L169 PolarHBondContact O-N 3.22Å; D166-C170 WeakPolarHBondContact O-CB 3.48Å; D166-C170 PolarHBondContact O-N 3.18Å; D166-N287 PolarHBondContact O-ND2 3.47Å; D166-F288 HydrophobicContact CB-CD1 3.58Å; D166-F288 HydrophobicContact CB-CE1 3.46Å; D166-F288 VanDerWaalsContact CB-CE1 3.46Å; D166-F288 HydrophobicContact CB-CG 4.36Å; D166-F288 HydrophobicContact CB-CZ 4.19Å
167	M	92.7	Very high	88.9	Confident	20 Å²	20	38.6 Å²	38.6	10%	0.099	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-42.9	177.1	-70.9	-64.6	170.5	0	0	112.4	S163 F164 L165 L169 C170 C171 A210 L211 A214 L248 F288	S163-M167 VanDerWaalsContact O-CG 3.24Å; S163-M167 WeakPolarHBondContact O-CG 3.46Å; S163-M167 PolarHBondContact O-N 3.2Å; F164-M167 PolarHBondContact O-N 3.22Å; L165-M167 VanDerWaalsContact C-N 3.35Å; L165-M167 PolarHBondContact O-N 3.47Å; M167-L169 VanDerWaalsContact C-N 3.34Å; M167-L169 PolarHBondContact O-N 3.26Å; M167-C170 WeakPolarHBondContact O-CB 3.47Å; M167-C170 PolarHBondContact O-N 3.27Å; M167-C171 PolarHBondContact O-N 3.24Å; M167-C171 PolarHBondContact O-SG 3.06Å; M167-A210 HydrophobicContact SD-CB 4.5Å; M167-L211 HydrophobicContact CB-CD1 4.49Å; M167-A214 HydrophobicContact CB-CB 4.07Å; M167-A214 HydrophobicContact CG-CB 3.97Å; M167-L248 HydrophobicContact CE-CD1 3.38Å; M167-L248 HydrophobicContact SD-CD1 3.86Å; M167-F288 HydrophobicContact CE-CD1 4.21Å; M167-F288 HydrophobicContact CE-CE1 3.36Å; M167-F288 HydrophobicContact CE-CZ 3.83Å; M167-F288 HydrophobicContact CG-CE1 3.98Å; M167-F288 HydrophobicContact CG-CZ 4.34Å; M167-F288 HydrophobicContact SD-CE1 3.56Å; M167-F288 VanDerWaalsContact SD-CE1 3.56Å; M167-F288 HydrophobicContact SD-CZ 3.54Å; M167-F288 VanDerWaalsContact SD-CZ 3.54Å
168	L	92.9	Very high	90	Very high	64 Å²	64	36.4 Å²	36.4	34%	0.335	21%	0.208	S	C	.	.	H	α-helix	trans	-60.5	-43.8	176.7	-178.6	65.2	0	0	0	111.4	F164 L165 C170 C171 L172 L211	F164-L168 HydrophobicContact CE2-CB 4.47Å; F164-L168 HydrophobicContact CZ-CD2 4.13Å; F164-L168 WeakPolarHBondContact O-CB 3.28Å; F164-L168 PolarHBondContact O-N 3.39Å; L165-L168 PolarHBondContact O-N 3.26Å; L168-C170 VanDerWaalsContact C-N 3.35Å; L168-C171 PolarHBondContact O-N 3.43Å; L168-L172 HydrophobicContact CG-CD1 4.44Å; L168-L172 WeakPolarHBondContact O-CG 3.43Å; L168-L172 PolarHBondContact O-N 3.37Å; L168-L172 VanDerWaalsContact O-N 3.07Å; L168-L211 HydrophobicContact CB-CD1 4.31Å; L168-L211 HydrophobicContact CD1-CD1 4.32Å
169	L	92.7	Very high	90.4	Very high	82 Å²	82	40.8 Å²	40.8	43%	0.429	23%	0.23	S	C	.	.	H	α-helix	trans	-64.2	-40	175.6	-175.1	61.1	0	0	0	111.5	L165 D166 M167 L172 V173	L165-L169 PolarHBondContact O-N 2.63Å; D166-L169 PolarHBondContact O-N 3.22Å; M167-L169 VanDerWaalsContact C-N 3.34Å; M167-L169 PolarHBondContact O-N 3.26Å; L169-L172 PolarHBondContact O-N 3.49Å; L169-V173 HydrophobicContact CD1-CG2 4.4Å; L169-V173 WeakPolarHBondContact O-CG2 3.46Å; L169-V173 PolarHBondContact O-N 2.93Å
170	C	93.2	Very high	90.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-51.2	175.2	-159.7	0	0	0	0	111.8	D166 M167 L168 L172 V173 V174 E207 Q284 F288	D166-C170 WeakPolarHBondContact O-CB 3.48Å; D166-C170 PolarHBondContact O-N 3.18Å; M167-C170 WeakPolarHBondContact O-CB 3.47Å; M167-C170 PolarHBondContact O-N 3.27Å; L168-C170 VanDerWaalsContact C-N 3.35Å; C170-L172 VanDerWaalsContact C-N 3.31Å; C170-L172 PolarHBondContact O-N 3.28Å; C170-V173 PolarHBondContact O-N 3Å; C170-V173 VanDerWaalsContact O-N 3.15Å; C170-V174 WeakPolarHBondContact O-CG2 3.4Å; C170-V174 PolarHBondContact O-N 2.88Å; C170-E207 PolarHBondContact SG-OE1 3Å; C170-Q284 VanDerWaalsContact CA-NE2 3.34Å; C170-F288 HydrophobicContact CB-CE2 4Å; C170-F288 HydrophobicContact CB-CZ 3.88Å
171	C	93.6	Very high	90.9	Very high	23 Å²	23	40.8 Å²	40.8	16%	0.155	23%	0.233	C	C	.	.	H	α-helix	trans	-55.2	-43.2	175.6	-74.5	0	0	0	0	112.7	M167 L168 L175 E207 L211	M167-C171 PolarHBondContact O-N 3.24Å; M167-C171 PolarHBondContact O-SG 3.06Å; L168-C171 PolarHBondContact O-N 3.43Å; C171-L175 VanDerWaalsContact O-CB 3.27Å; C171-L175 WeakPolarHBondContact O-CB 3.45Å; C171-L175 PolarHBondContact O-N 2.76Å; C171-E207 PolarHBondContact SG-OE2 3.19Å; C171-L211 HydrophobicContact CB-CD2 4.39Å
172	L	93.5	Very high	90.9	Very high	103 Å²	103	41.8 Å²	41.8	54%	0.539	24%	0.237	S	C	.	.	H	α-helix	trans	-65.1	-41.9	177.7	-70.6	171.7	0	0	0	112.3	L168 L169 C170 L175 A176	L168-L172 HydrophobicContact CG-CD1 4.44Å; L168-L172 WeakPolarHBondContact O-CG 3.43Å; L168-L172 PolarHBondContact O-N 3.37Å; L168-L172 VanDerWaalsContact O-N 3.07Å; L169-L172 PolarHBondContact O-N 3.49Å; C170-L172 VanDerWaalsContact C-N 3.31Å; C170-L172 PolarHBondContact O-N 3.28Å; L172-L175 PolarHBondContact O-N 3.23Å; L172-A176 WeakPolarHBondContact O-CB 3.28Å; L172-A176 PolarHBondContact O-N 3.3Å
173	V	93.3	Very high	90.8	Very high	27 Å²	27	44.4 Å²	44.4	16%	0.164	25%	0.249	C	C	.	.	H	α-helix	trans	-68.2	-43.2	177.6	171.4	0	0	0	0	111.4	L169 C170 L175 A176 L177 I280 Q284	L169-V173 HydrophobicContact CD1-CG2 4.4Å; L169-V173 WeakPolarHBondContact O-CG2 3.46Å; L169-V173 PolarHBondContact O-N 2.93Å; C170-V173 PolarHBondContact O-N 3Å; C170-V173 VanDerWaalsContact O-N 3.15Å; V173-L175 VanDerWaalsContact C-N 3.35Å; V173-L175 PolarHBondContact O-N 3.44Å; V173-A176 PolarHBondContact O-N 3.47Å; V173-L177 HydrophobicContact CG1-CD1 3.82Å; V173-L177 HydrophobicContact CG1-CG 4.32Å; V173-L177 WeakPolarHBondContact O-CB 3.33Å; V173-L177 WeakPolarHBondContact O-CG 3.39Å; V173-L177 PolarHBondContact O-N 2.97Å; V173-I280 HydrophobicContact CG1-CG2 4.35Å; V173-Q284 HydrophobicContact CG1-CB 4.39Å; V173-Q284 HydrophobicContact CG1-CG 4.2Å
174	V	92.5	Very high	90.3	Very high	6 Å²	6	46.4 Å²	46.4	4%	0.036	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-45.7	174.5	173.1	0	0	0	0	110.8	C170 S178 V203 E207 P252	C170-V174 WeakPolarHBondContact O-CG2 3.4Å; C170-V174 PolarHBondContact O-N 2.88Å; V174-S178 VanDerWaalsContact O-CB 3.22Å; V174-S178 WeakPolarHBondContact O-CB 3.47Å; V174-S178 PolarHBondContact O-N 2.71Å; V174-S178 PolarHBondContact O-OG 3.12Å; V174-V203 HydrophobicContact CG1-CG1 3.75Å; V174-E207 HydrophobicContact CB-CG 4.45Å; V174-E207 HydrophobicContact CG1-CG 4.3Å; V174-E207 HydrophobicContact CG2-CG 4.17Å; V174-P252 HydrophobicContact CG2-CB 3.97Å; V174-P252 HydrophobicContact CG2-CG 3.61Å
175	L	92.2	Very high	89.6	Confident	116 Å²	116	46 Å²	46	61%	0.607	25%	0.253	S	S	*	.	H	α-helix	trans	-63.5	-44	178.8	-177.3	143.1	0	0	0	111.7	C171 L172 V173 L179	C171-L175 VanDerWaalsContact O-CB 3.27Å; C171-L175 WeakPolarHBondContact O-CB 3.45Å; C171-L175 PolarHBondContact O-N 2.76Å; L172-L175 PolarHBondContact O-N 3.23Å; V173-L175 VanDerWaalsContact C-N 3.35Å; V173-L175 PolarHBondContact O-N 3.44Å; L175-L179 VanDerWaalsContact O-CB 3.22Å; L175-L179 WeakPolarHBondContact O-CB 3.36Å; L175-L179 PolarHBondContact O-N 2.74Å
176	A	92.2	Very high	89	Confident	55 Å²	55	48.6 Å²	48.6	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-45.7	177.5	0	0	0	0	0	112.6	L172 V173 A180	L172-A176 WeakPolarHBondContact O-CB 3.28Å; L172-A176 PolarHBondContact O-N 3.3Å; V173-A176 PolarHBondContact O-N 3.47Å; A176-A180 WeakPolarHBondContact O-CB 3.25Å; A176-A180 PolarHBondContact O-N 3.42Å
177	L	91.6	Very high	88.4	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.052	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-44.2	177.6	-73.8	173.7	0	0	0	111.8	V173 A180 C181 P252 V256 A277 I280 A281	V173-L177 HydrophobicContact CG1-CD1 3.82Å; V173-L177 HydrophobicContact CG1-CG 4.32Å; V173-L177 WeakPolarHBondContact O-CB 3.33Å; V173-L177 WeakPolarHBondContact O-CG 3.39Å; V173-L177 PolarHBondContact O-N 2.97Å; L177-A180 PolarHBondContact O-N 3.02Å; L177-C181 WeakPolarHBondContact O-CB 3.33Å; L177-C181 PolarHBondContact O-N 3.15Å; L177-C181 PolarHBondContact O-SG 3.5Å; L177-P252 HydrophobicContact CD1-CB 4.02Å; L177-V256 HydrophobicContact CB-CG2 4.16Å; L177-V256 HydrophobicContact CD1-CG2 4.2Å; L177-V256 HydrophobicContact CD2-CG2 4.33Å; L177-V256 HydrophobicContact CG-CG2 4.48Å; L177-A277 HydrophobicContact CD2-CB 4.14Å; L177-I280 HydrophobicContact CD1-CG2 4.33Å; L177-I280 HydrophobicContact CD2-CB 4.18Å; L177-I280 HydrophobicContact CD2-CD1 4.5Å; L177-I280 HydrophobicContact CD2-CG2 4.04Å; L177-I280 HydrophobicContact CG-CG2 4.42Å; L177-A281 HydrophobicContact CD1-CB 4.17Å
178	S	90.3	Very high	87.4	Confident	14 Å²	14	55.5 Å²	55.5	10%	0.098	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-48.9	177.1	-58	0	0	0	0	110.9	V174 A180 C181 F182	V174-S178 VanDerWaalsContact O-CB 3.22Å; V174-S178 WeakPolarHBondContact O-CB 3.47Å; V174-S178 PolarHBondContact O-N 2.71Å; V174-S178 PolarHBondContact O-OG 3.12Å; S178-A180 VanDerWaalsContact C-N 3.34Å; S178-A180 PolarHBondContact O-N 3.19Å; S178-C181 PolarHBondContact O-N 2.89Å; S178-C181 VanDerWaalsContact O-N 3.14Å; S178-F182 VanDerWaalsContact O-CD2 3.29Å; S178-F182 WeakPolarHBondContact O-CD2 3.27Å; S178-F182 PolarHBondContact O-N 3.48Å
179	L	89.9	Confident	86.4	Confident	99 Å²	99	61.5 Å²	61.5	52%	0.518	34%	0.337	S	S	.	.	H	α-helix	trans	-58.8	-45	177.3	-178.7	63.7	0	0	0	111.5	L175 C181 F182 L183	L175-L179 VanDerWaalsContact O-CB 3.22Å; L175-L179 WeakPolarHBondContact O-CB 3.36Å; L175-L179 PolarHBondContact O-N 2.74Å; L179-C181 VanDerWaalsContact C-N 3.32Å; L179-C181 PolarHBondContact O-N 3.49Å; L179-F182 PolarHBondContact O-N 2.98Å; L179-L183 HydrophobicContact CD1-CD1 4.26Å; L179-L183 HydrophobicContact CD1-CG 4.12Å; L179-L183 HydrophobicContact CG-CD1 3.87Å; L179-L183 HydrophobicContact CG-CG 4.22Å; L179-L183 WeakPolarHBondContact O-CB 3.24Å; L179-L183 VanDerWaalsContact O-CG 3.24Å; L179-L183 WeakPolarHBondContact O-CG 3.45Å; L179-L183 PolarHBondContact O-N 3.05Å
180	A	89.1	Confident	85.2	Confident	35 Å²	35	62.4 Å²	62.4	29%	0.289	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-40.5	176.2	0	0	0	0	0	112.2	A176 L177 S178 F273	A176-A180 WeakPolarHBondContact O-CB 3.25Å; A176-A180 PolarHBondContact O-N 3.42Å; L177-A180 PolarHBondContact O-N 3.02Å; S178-A180 VanDerWaalsContact C-N 3.34Å; S178-A180 PolarHBondContact O-N 3.19Å; A180-F273 HydrophobicContact CB-CE2 4.41Å; A180-F273 HydrophobicContact CB-CZ 3.98Å; A180-F273 WeakPolarHBondContact O-CZ 3.39Å
181	C	86.3	Confident	84.2	Confident	5 Å²	5	68 Å²	68	3%	0.034	38%	0.378	C	S	.	.	H	α-helix	trans	-69.6	-31.2	178.3	-65.3	0	0	0	0	113.5	L177 S178 L179 P185 H259	L177-C181 WeakPolarHBondContact O-CB 3.33Å; L177-C181 PolarHBondContact O-N 3.15Å; L177-C181 PolarHBondContact O-SG 3.5Å; S178-C181 PolarHBondContact O-N 2.89Å; S178-C181 VanDerWaalsContact O-N 3.14Å; L179-C181 VanDerWaalsContact C-N 3.32Å; L179-C181 PolarHBondContact O-N 3.49Å; C181-P185 WeakPolarHBondContact O-CD 3.49Å; C181-H259 HydrophobicContact CB-CB 4.44Å; C181-H259 VanDerWaalsContact CB-CD2 3.43Å; C181-H259 WeakPolarHBondContact CB-CD2 3.43Å; C181-H259 WeakPolarHBondContact CB-NE2 3.42Å
182	F	86.7	Confident	83.1	Confident	43 Å²	43	69 Å²	69	19%	0.189	38%	0.384	C	S	.	.	H	α-helix	trans	-84.1	-31.6	175.1	-80.1	-71.5	0	0	0	114.4	S178 L179 R184 P185 L186 P192 F197 T200 H259	S178-F182 VanDerWaalsContact O-CD2 3.29Å; S178-F182 WeakPolarHBondContact O-CD2 3.27Å; S178-F182 PolarHBondContact O-N 3.48Å; L179-F182 PolarHBondContact O-N 2.98Å; F182-R184 VanDerWaalsContact C-N 3.25Å; F182-R184 PolarHBondContact O-N 3.03Å; F182-P185 WeakPolarHBondContact O-CD 3.31Å; F182-L186 PolarHBondContact O-N 3.42Å; F182-P192 HydrophobicContact CD1-CG 4.5Å; F182-P192 HydrophobicContact CE1-CB 4.36Å; F182-F197 HydrophobicContact CD1-CD1 4.43Å; F182-F197 AromaticContact CD1-CE1 3.84Å; F182-F197 HydrophobicContact CD1-CE1 3.84Å; F182-F197 HydrophobicContact CD1-CZ 4.08Å; F182-F197 AromaticContact CE1-CD1 3.5Å; F182-F197 HydrophobicContact CE1-CD1 3.5Å; F182-F197 VanDerWaalsContact CE1-CD1 3.5Å; F182-F197 HydrophobicContact CE1-CD2 4.3Å; F182-F197 AromaticContact CE1-CE1 3.32Å; F182-F197 HydrophobicContact CE1-CE1 3.32Å; F182-F197 HydrophobicContact CE1-CE2 4.16Å; F182-F197 HydrophobicContact CE1-CG 4Å; F182-F197 AromaticContact CE1-CZ 3.69Å; F182-F197 HydrophobicContact CE1-CZ 3.69Å; F182-F197 AromaticContact CZ-CD1 3.74Å; F182-F197 HydrophobicContact CZ-CD1 3.74Å; F182-F197 AromaticContact CZ-CE1 3.99Å; F182-F197 HydrophobicContact CZ-CE1 3.99Å; F182-F197 HydrophobicContact CZ-CG 4.25Å; F182-T200 HydrophobicContact CE2-CG2 3.92Å; F182-H259 AromaticContact CD1-CE1 3.75Å; F182-H259 AromaticContact CD2-CE1 3.77Å; F182-H259 AromaticContact CD2-NE2 3.87Å; F182-H259 AromaticContact CE1-CE1 3.57Å; F182-H259 AromaticContact CE2-CE1 3.57Å; F182-H259 AromaticContact CE2-NE2 3.48Å; F182-H259 WeakPolarHBondContact CE2-NE2 3.31Å; F182-H259 AromaticContact CG-CE1 3.84Å; F182-H259 AromaticContact CZ-CE1 3.47Å; F182-H259 VanDerWaalsContact CZ-CE1 3.47Å; F182-H259 WeakPolarHBondContact CZ-CE1 3.47Å; F182-H259 AromaticContact CZ-NE2 3.7Å
183	L	84.8	Confident	82.4	Confident	86 Å²	86	66.4 Å²	66.4	45%	0.45	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-35.7	178.8	-82.8	169.9	0	0	0	112.4	L179 L186 V187	L179-L183 HydrophobicContact CD1-CD1 4.26Å; L179-L183 HydrophobicContact CD1-CG 4.12Å; L179-L183 HydrophobicContact CG-CD1 3.87Å; L179-L183 HydrophobicContact CG-CG 4.22Å; L179-L183 WeakPolarHBondContact O-CB 3.24Å; L179-L183 VanDerWaalsContact O-CG 3.24Å; L179-L183 WeakPolarHBondContact O-CG 3.45Å; L179-L183 PolarHBondContact O-N 3.05Å; L183-L186 PolarHBondContact O-N 3.37Å; L183-V187 WeakPolarHBondContact O-CG2 3.36Å; L183-V187 PolarHBondContact O-N 2.88Å
184	R	76.6	Confident	81.9	Confident	61 Å²	61	68.6 Å²	68.6	23%	0.23	40%	0.396	C	S	.	.	H	α-helix	trans	-70.2	-53	-176	178.1	175.2	-176.7	159.3	-0.1	114	F182 L186 V187 T188 Q269 F270	F182-R184 VanDerWaalsContact C-N 3.25Å; F182-R184 PolarHBondContact O-N 3.03Å; R184-L186 PolarHBondContact O-N 3.05Å; R184-V187 PolarHBondContact O-N 3.05Å; R184-V187 VanDerWaalsContact O-N 3.09Å; R184-T188 PolarHBondContact O-N 3.26Å; R184-T188 PolarHBondContact O-OG1 2.87Å; R184-T188 VanDerWaalsContact O-OG1 3.08Å; R184-Q269 PolarHBondContact NH1-O 3.25Å; R184-Q269 VanDerWaalsContact NH2-C 3.3Å; R184-Q269 PolarHBondContact NH2-O 3.01Å; R184-F270 VanDerWaalsContact NH2-N 3.13Å
185	P	76.5	Confident	81.4	Confident	15 Å²	15	74.2 Å²	74.2	10%	0.097	43%	0.425	C	S	.	.	H	α-helix	trans	-52.9	-37.4	172.3	-28.5	35.2	0	0	0	113	C181 F182 T188 Q189 Q190 P192	C181-P185 WeakPolarHBondContact O-CD 3.49Å; F182-P185 WeakPolarHBondContact O-CD 3.31Å; P185-T188 WeakPolarHBondContact CA-OG1 3.31Å; P185-T188 CarbonylContact O-C 3.6Å; P185-T188 PolarHBondContact O-N 2.84Å; P185-T188 PolarHBondContact O-OG1 2.95Å; P185-Q189 PolarHBondContact O-N 3.32Å; P185-Q190 PolarHBondContact O-N 2.65Å; P185-P192 HydrophobicContact CB-CG 4.02Å
186	L	77.1	Confident	81.1	Confident	133 Å²	133	68.8 Å²	68.8	70%	0.696	40%	0.397	S	S	*	.	H	α-helix	trans	-64.3	-42.5	177.1	-174.7	65.6	0	0	0	112.1	F182 L183 R184	F182-L186 PolarHBondContact O-N 3.42Å; L183-L186 PolarHBondContact O-N 3.37Å; R184-L186 PolarHBondContact O-N 3.05Å
187	V	79.1	Confident	80.8	Confident	121 Å²	121	71.4 Å²	71.4	73%	0.733	40%	0.398	S	S	*	.	H	α-helix	trans	-70.5	-33.6	175.1	170.2	0	0	0	0	112.3	L183 R184	L183-V187 WeakPolarHBondContact O-CG2 3.36Å; L183-V187 PolarHBondContact O-N 2.88Å; R184-V187 PolarHBondContact O-N 3.05Å; R184-V187 VanDerWaalsContact O-N 3.09Å
188	T	71.4	Confident	80.7	Confident	68 Å²	68	76 Å²	76	42%	0.417	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	4	179.9	57	0	0	0	0	114.5	R184 P185 Q190	R184-T188 PolarHBondContact O-N 3.26Å; R184-T188 PolarHBondContact O-OG1 2.87Å; R184-T188 VanDerWaalsContact O-OG1 3.08Å; P185-T188 WeakPolarHBondContact CA-OG1 3.31Å; P185-T188 CarbonylContact O-C 3.6Å; P185-T188 PolarHBondContact O-N 2.84Å; P185-T188 PolarHBondContact O-OG1 2.95Å; T188-Q190 PolarHBondContact O-N 2.88Å; T188-Q190 PolarHBondContact OG1-OE1 3.02Å
189	Q	71.4	Confident	80.7	Confident	189 Å²	189	78.8 Å²	78.8	88%	0.883	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	30.3	-175.2	-60.3	-167.7	2	0	0	114.6	P185	P185-Q189 PolarHBondContact O-N 3.32Å
190	Q	69.2	Low	80.6	Confident	102 Å²	102	74.7 Å²	74.7	48%	0.477	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-94.2	132.3	172.9	-71.6	178.5	-46.9	0	0	109.7	P185 T188 P192	P185-Q190 PolarHBondContact O-N 2.65Å; T188-Q190 PolarHBondContact O-N 2.88Å; T188-Q190 PolarHBondContact OG1-OE1 3.02Å; Q190-P192 WeakPolarHBondContact O-CD 3.43Å
191	S	70.6	Confident	80.6	Confident	116 Å²	116	76 Å²	76	81%	0.811	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-66.7	122.1	173.4	41.1	0	0	0	0	110.1
192	P	71.7	Confident	81	Confident	44 Å²	44	79.4 Å²	79.4	29%	0.286	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-65.7	151.3	174.7	-14.1	27.7	0	0	0	110.4	F182 P185 Q190 F197	F182-P192 HydrophobicContact CD1-CG 4.5Å; F182-P192 HydrophobicContact CE1-CB 4.36Å; P185-P192 HydrophobicContact CB-CG 4.02Å; Q190-P192 WeakPolarHBondContact O-CD 3.43Å; P192-F197 HydrophobicContact CB-CD2 4.21Å; P192-F197 HydrophobicContact CB-CE2 3.58Å; P192-F197 HydrophobicContact CB-CZ 4.15Å; P192-F197 HydrophobicContact CG-CE2 3.68Å; P192-F197 HydrophobicContact CG-CZ 3.85Å
193	S	78.6	Confident	81.2	Confident	50 Å²	50	77.5 Å²	77.5	35%	0.35	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-64.5	140.7	175.9	73.5	0	0	0	0	110.6	L195 A196	S193-L195 PolarHBondContact O-N 2.75Å; S193-L195 VanDerWaalsContact O-N 3.17Å; S193-A196 PolarHBondContact O-N 2.89Å; S193-A196 VanDerWaalsContact O-N 3.1Å; S193-A196 WeakPolarHBondContact OG-CB 3.43Å; S193-A196 PolarHBondContact OG-N 3.3Å
194	A	81.7	Confident	81.5	Confident	73 Å²	73	75.9 Å²	75.9	60%	0.603	44%	0.436	S	S	*	.	H	α-helix	trans	-59.2	-29	177.4	0	0	0	0	0	112.3	I198	A194-I198 WeakPolarHBondContact O-CG1 3.48Å; A194-I198 PolarHBondContact O-N 2.99Å
195	L	82.9	Confident	82.3	Confident	124 Å²	124	79 Å²	79	65%	0.649	46%	0.457	S	S	*	.	H	α-helix	trans	-66.5	-38.8	176.3	-64.6	174.9	0	0	0	112.7	S193 F197 I198 L199	S193-L195 PolarHBondContact O-N 2.75Å; S193-L195 VanDerWaalsContact O-N 3.17Å; L195-F197 PolarHBondContact O-N 3.4Å; L195-I198 PolarHBondContact O-N 2.79Å; L195-L199 WeakPolarHBondContact O-CB 3.49Å; L195-L199 WeakPolarHBondContact O-CG 3.41Å; L195-L199 PolarHBondContact O-N 2.9Å
196	A	85	Confident	83.1	Confident	1 Å²	1	82 Å²	82	1%	0.008	47%	0.471	C	S	.	.	H	α-helix	trans	-63	-41.2	178.4	0	0	0	0	0	112.1	S193 T200 S258	S193-A196 PolarHBondContact O-N 2.89Å; S193-A196 VanDerWaalsContact O-N 3.1Å; S193-A196 WeakPolarHBondContact OG-CB 3.43Å; S193-A196 PolarHBondContact OG-N 3.3Å; A196-T200 WeakPolarHBondContact O-CB 2.81Å; A196-T200 PolarHBondContact O-N 3.35Å; A196-T200 PolarHBondContact O-OG1 2.9Å; A196-S258 WeakPolarHBondContact CB-O 3.3Å
197	F	86.8	Confident	83.8	Confident	110 Å²	110	75.9 Å²	75.9	48%	0.482	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-48.2	174.4	-79.2	-69.7	0	0	0	112.5	F182 P192 L195 A201	F182-F197 HydrophobicContact CD1-CD1 4.43Å; F182-F197 AromaticContact CD1-CE1 3.84Å; F182-F197 HydrophobicContact CD1-CE1 3.84Å; F182-F197 HydrophobicContact CD1-CZ 4.08Å; F182-F197 AromaticContact CE1-CD1 3.5Å; F182-F197 HydrophobicContact CE1-CD1 3.5Å; F182-F197 VanDerWaalsContact CE1-CD1 3.5Å; F182-F197 HydrophobicContact CE1-CD2 4.3Å; F182-F197 AromaticContact CE1-CE1 3.32Å; F182-F197 HydrophobicContact CE1-CE1 3.32Å; F182-F197 HydrophobicContact CE1-CE2 4.16Å; F182-F197 HydrophobicContact CE1-CG 4Å; F182-F197 AromaticContact CE1-CZ 3.69Å; F182-F197 HydrophobicContact CE1-CZ 3.69Å; F182-F197 AromaticContact CZ-CD1 3.74Å; F182-F197 HydrophobicContact CZ-CD1 3.74Å; F182-F197 AromaticContact CZ-CE1 3.99Å; F182-F197 HydrophobicContact CZ-CE1 3.99Å; F182-F197 HydrophobicContact CZ-CG 4.25Å; P192-F197 HydrophobicContact CB-CD2 4.21Å; P192-F197 HydrophobicContact CB-CE2 3.58Å; P192-F197 HydrophobicContact CB-CZ 4.15Å; P192-F197 HydrophobicContact CG-CE2 3.68Å; P192-F197 HydrophobicContact CG-CZ 3.85Å; L195-F197 PolarHBondContact O-N 3.4Å; F197-A201 VanDerWaalsContact O-CB 3.3Å; F197-A201 WeakPolarHBondContact O-CB 3.39Å; F197-A201 PolarHBondContact O-N 3.22Å
198	I	89.6	Confident	84.4	Confident	106 Å²	106	72.9 Å²	72.9	54%	0.544	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-47.7	-179.5	-66.3	165.9	0	0	0	110.5	A194 L195 A201 V202	A194-I198 WeakPolarHBondContact O-CG1 3.48Å; A194-I198 PolarHBondContact O-N 2.99Å; L195-I198 PolarHBondContact O-N 2.79Å; I198-A201 PolarHBondContact O-N 3.5Å; I198-V202 WeakPolarHBondContact O-CG2 3.38Å; I198-V202 PolarHBondContact O-N 3.2Å
199	L	88.9	Confident	85.4	Confident	74 Å²	74	74.5 Å²	74.5	39%	0.387	43%	0.433	S	S	.	.	H	α-helix	trans	-64.3	-43.6	-179.5	-73.6	170.4	0	0	0	112	L195 A201 V202 V203	L195-L199 WeakPolarHBondContact O-CB 3.49Å; L195-L199 WeakPolarHBondContact O-CG 3.41Å; L195-L199 PolarHBondContact O-N 2.9Å; L199-A201 VanDerWaalsContact C-N 3.35Å; L199-A201 PolarHBondContact O-N 3.23Å; L199-V202 PolarHBondContact O-N 3.24Å; L199-V203 WeakPolarHBondContact O-CG2 3.16Å; L199-V203 PolarHBondContact O-N 3.3Å
200	T	88.3	Confident	86.4	Confident	13 Å²	13	66.4 Å²	66.4	8%	0.08	40%	0.398	C	S	.	.	H	α-helix	trans	-68	-35.2	178.5	-54.1	0	0	0	0	112.1	F182 A196 V203 A204 S258	F182-T200 HydrophobicContact CE2-CG2 3.92Å; A196-T200 WeakPolarHBondContact O-CB 2.81Å; A196-T200 PolarHBondContact O-N 3.35Å; A196-T200 PolarHBondContact O-OG1 2.9Å; T200-V203 PolarHBondContact O-N 3.41Å; T200-A204 WeakPolarHBondContact O-CB 3.48Å; T200-A204 PolarHBondContact O-N 2.91Å; T200-S258 PolarHBondContact OG1-OG 3.42Å
201	A	90.6	Very high	87.5	Confident	62 Å²	62	63.2 Å²	63.2	51%	0.512	38%	0.384	S	S	.	.	H	α-helix	trans	-64.1	-39.9	173.6	0	0	0	0	0	112.3	F197 I198 L199 L205	F197-A201 VanDerWaalsContact O-CB 3.3Å; F197-A201 WeakPolarHBondContact O-CB 3.39Å; F197-A201 PolarHBondContact O-N 3.22Å; I198-A201 PolarHBondContact O-N 3.5Å; L199-A201 VanDerWaalsContact C-N 3.35Å; L199-A201 PolarHBondContact O-N 3.23Å; A201-L205 WeakPolarHBondContact O-CB 3.48Å; A201-L205 PolarHBondContact O-N 3.24Å
202	V	92.8	Very high	88.3	Confident	76 Å²	76	62.1 Å²	62.1	46%	0.461	37%	0.368	S	S	.	.	H	α-helix	trans	-65.4	-44.3	174	171.5	0	0	0	0	111.2	I198 L199 L205 L206	I198-V202 WeakPolarHBondContact O-CG2 3.38Å; I198-V202 PolarHBondContact O-N 3.2Å; L199-V202 PolarHBondContact O-N 3.24Å; V202-L205 PolarHBondContact O-N 3.43Å; V202-L206 HydrophobicContact CG1-CD1 4.12Å; V202-L206 WeakPolarHBondContact O-CG 3.49Å; V202-L206 PolarHBondContact O-N 3.28Å
203	V	92.7	Very high	89.1	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.018	37%	0.373	C	S	.	.	H	α-helix	trans	-58.7	-48.9	175.5	166.1	0	0	0	0	111.2	V174 L199 T200 L205 L206 E207 L251 L254 A255	V174-V203 HydrophobicContact CG1-CG1 3.75Å; L199-V203 WeakPolarHBondContact O-CG2 3.16Å; L199-V203 PolarHBondContact O-N 3.3Å; T200-V203 PolarHBondContact O-N 3.41Å; V203-L205 VanDerWaalsContact C-N 3.32Å; V203-L205 PolarHBondContact O-N 3.05Å; V203-L206 PolarHBondContact O-N 2.84Å; V203-E207 PolarHBondContact O-N 2.83Å; V203-L251 HydrophobicContact CG1-CB 3.98Å; V203-L251 HydrophobicContact CG2-CD2 4.24Å; V203-L254 HydrophobicContact CG2-CD2 4.25Å; V203-L254 HydrophobicContact CG2-CG 4.47Å; V203-A255 HydrophobicContact CG1-CB 4.36Å
204	A	91.1	Very high	89.6	Confident	52 Å²	52	60.6 Å²	60.6	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-62.9	-36	179.4	0	0	0	0	0	112.9	T200 A208	T200-A204 WeakPolarHBondContact O-CB 3.48Å; T200-A204 PolarHBondContact O-N 2.91Å; A204-A208 VanDerWaalsContact O-CB 3.28Å; A204-A208 WeakPolarHBondContact O-CB 3.27Å; A204-A208 PolarHBondContact O-N 3.16Å
205	L	93.2	Very high	89.8	Confident	128 Å²	128	59.9 Å²	59.9	67%	0.67	34%	0.344	S	S	*	.	H	α-helix	trans	-66.9	-40.7	175.6	-178.3	63.7	0	0	0	112.1	A201 V202 V203 L209	A201-L205 WeakPolarHBondContact O-CB 3.48Å; A201-L205 PolarHBondContact O-N 3.24Å; V202-L205 PolarHBondContact O-N 3.43Å; V203-L205 VanDerWaalsContact C-N 3.32Å; V203-L205 PolarHBondContact O-N 3.05Å; L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 PolarHBondContact O-N 3.36Å
206	L	92.3	Very high	89.9	Confident	76 Å²	76	58.3 Å²	58.3	40%	0.398	33%	0.329	S	S	.	.	H	α-helix	trans	-67.1	-44.6	177.5	-70.6	170.9	0	0	0	111.9	V202 V203 L209 A210 L251	V202-L206 HydrophobicContact CG1-CD1 4.12Å; V202-L206 WeakPolarHBondContact O-CG 3.49Å; V202-L206 PolarHBondContact O-N 3.28Å; V203-L206 PolarHBondContact O-N 2.84Å; L206-L209 PolarHBondContact O-N 3.44Å; L206-A210 WeakPolarHBondContact O-CB 3.45Å; L206-A210 PolarHBondContact O-N 3.04Å; L206-L251 HydrophobicContact CB-CD1 3.96Å; L206-L251 HydrophobicContact CD1-CD2 4.28Å
207	E	91.9	Very high	89.7	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.028	34%	0.339	C	S	.	.	H	α-helix	trans	-59.9	-47.3	173.6	-77.1	-70.6	166	0	0	111.7	C170 C171 V174 V203 L209 A210 L211 L251	C170-E207 PolarHBondContact SG-OE1 3Å; C171-E207 PolarHBondContact SG-OE2 3.19Å; V174-E207 HydrophobicContact CB-CG 4.45Å; V174-E207 HydrophobicContact CG1-CG 4.3Å; V174-E207 HydrophobicContact CG2-CG 4.17Å; V203-E207 PolarHBondContact O-N 2.83Å; E207-L209 VanDerWaalsContact C-N 3.32Å; E207-L209 PolarHBondContact O-N 2.86Å; E207-A210 PolarHBondContact O-N 2.86Å; E207-L211 WeakPolarHBondContact O-CB 3.4Å; E207-L211 PolarHBondContact O-N 2.93Å; E207-L251 HydrophobicContact CG-CD1 3.86Å
208	A	92.8	Very high	89.5	Confident	57 Å²	57	55.1 Å²	55.1	47%	0.471	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-38.3	178.8	0	0	0	0	0	112.7	A204 L212	A204-A208 VanDerWaalsContact O-CB 3.28Å; A204-A208 WeakPolarHBondContact O-CB 3.27Å; A204-A208 PolarHBondContact O-N 3.16Å; A208-L212 WeakPolarHBondContact O-CB 3.36Å; A208-L212 PolarHBondContact O-N 3.07Å
209	L	91.8	Very high	89.1	Confident	103 Å²	103	55.5 Å²	55.5	54%	0.539	32%	0.315	S	S	.	.	H	α-helix	trans	-67.2	-43.7	174.3	-176.3	65.2	0	0	0	111.6	L205 L206 E207 L212 C213	L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 PolarHBondContact O-N 3.36Å; L206-L209 PolarHBondContact O-N 3.44Å; E207-L209 VanDerWaalsContact C-N 3.32Å; E207-L209 PolarHBondContact O-N 2.86Å; L209-L212 PolarHBondContact O-N 3.03Å; L209-C213 PolarHBondContact O-N 2.8Å; L209-C213 PolarHBondContact O-SG 3.14Å
210	A	91.5	Very high	88.2	Confident	18 Å²	18	56.1 Å²	56.1	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-44	178	0	0	0	0	0	112.1	M167 L206 E207 C213 A214 L248	M167-A210 HydrophobicContact SD-CB 4.5Å; L206-A210 WeakPolarHBondContact O-CB 3.45Å; L206-A210 PolarHBondContact O-N 3.04Å; E207-A210 PolarHBondContact O-N 2.86Å; A210-C213 WeakPolarHBondContact O-CB 3.36Å; A210-C213 PolarHBondContact O-N 3.26Å; A210-A214 WeakPolarHBondContact O-CB 3.4Å; A210-A214 PolarHBondContact O-N 3.31Å; A210-L248 HydrophobicContact CB-CD1 3.9Å; A210-L248 HydrophobicContact CB-CD2 3.68Å; A210-L248 HydrophobicContact CB-CG 4.48Å
211	L	92	Very high	86.9	Confident	35 Å²	35	59 Å²	59	18%	0.183	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-41.7	175.3	-177.5	62.3	0	0	0	111.8	F164 M167 L168 C171 E207 C213 A214 I215	F164-L211 HydrophobicContact CD2-CD1 4.4Å; F164-L211 HydrophobicContact CE2-CD1 4.19Å; M167-L211 HydrophobicContact CB-CD1 4.49Å; L168-L211 HydrophobicContact CB-CD1 4.31Å; L168-L211 HydrophobicContact CD1-CD1 4.32Å; C171-L211 HydrophobicContact CB-CD2 4.39Å; E207-L211 WeakPolarHBondContact O-CB 3.4Å; E207-L211 PolarHBondContact O-N 2.93Å; L211-C213 VanDerWaalsContact C-N 3.34Å; L211-C213 PolarHBondContact O-N 2.91Å; L211-A214 PolarHBondContact O-N 3.39Å; L211-I215 HydrophobicContact CD1-CD1 4.19Å; L211-I215 HydrophobicContact CD1-CG1 4.33Å; L211-I215 HydrophobicContact CG-CD1 3.92Å; L211-I215 HydrophobicContact CG-CG1 4.48Å; L211-I215 WeakPolarHBondContact O-CB 3.12Å; L211-I215 VanDerWaalsContact O-CG1 3.29Å; L211-I215 WeakPolarHBondContact O-CG1 3.34Å; L211-I215 PolarHBondContact O-N 2.63Å
212	L	89.1	Confident	85.5	Confident	93 Å²	93	62.3 Å²	62.3	49%	0.487	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-43.1	174.6	-179.4	63	0	0	0	111.5	A208 L209 R216	A208-L212 WeakPolarHBondContact O-CB 3.36Å; A208-L212 PolarHBondContact O-N 3.07Å; L209-L212 PolarHBondContact O-N 3.03Å; L212-R216 HydrophobicContact CD1-CG 4.47Å; L212-R216 WeakPolarHBondContact O-CB 3.38Å; L212-R216 WeakPolarHBondContact O-CG 3.47Å; L212-R216 PolarHBondContact O-N 3.12Å
213	C	87.1	Confident	84	Confident	57 Å²	57	63.5 Å²	63.5	39%	0.385	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-42.3	173.6	-73.2	0	0	0	0	112.3	L209 A210 L211 R216 M217	L209-C213 PolarHBondContact O-N 2.8Å; L209-C213 PolarHBondContact O-SG 3.14Å; A210-C213 WeakPolarHBondContact O-CB 3.36Å; A210-C213 PolarHBondContact O-N 3.26Å; L211-C213 VanDerWaalsContact C-N 3.34Å; L211-C213 PolarHBondContact O-N 2.91Å; C213-R216 PolarHBondContact O-N 2.83Å; C213-M217 WeakPolarHBondContact O-CG 3.27Å; C213-M217 PolarHBondContact O-N 3.22Å
214	A	88.6	Confident	82.7	Confident	6 Å²	6	65.2 Å²	65.2	5%	0.05	36%	0.358	C	S	.	.	H	α-helix	trans	-65.5	-45.1	179.1	0	0	0	0	0	112.3	F164 M167 A210 L211 R216 M217 A218	F164-A214 HydrophobicContact CB-CB 4.41Å; M167-A214 HydrophobicContact CB-CB 4.07Å; M167-A214 HydrophobicContact CG-CB 3.97Å; A210-A214 WeakPolarHBondContact O-CB 3.4Å; A210-A214 PolarHBondContact O-N 3.31Å; L211-A214 PolarHBondContact O-N 3.39Å; A214-R216 VanDerWaalsContact C-N 3.29Å; A214-R216 PolarHBondContact O-N 3.38Å; A214-M217 PolarHBondContact O-N 3.2Å; A214-A218 WeakPolarHBondContact O-CB 3.36Å; A214-A218 PolarHBondContact O-N 3.48Å
215	I	87.4	Confident	82	Confident	57 Å²	57	69.3 Å²	69.3	29%	0.292	37%	0.373	S	S	.	.	H	α-helix	trans	-57.6	-43.8	172.8	-70.5	166.3	0	0	0	110.5	F164 L211 A218 F219	F164-I215 HydrophobicContact CD2-CG1 3.78Å; F164-I215 HydrophobicContact CE2-CD1 4.31Å; F164-I215 HydrophobicContact CE2-CG1 3.49Å; F164-I215 VanDerWaalsContact CE2-CG1 3.49Å; L211-I215 HydrophobicContact CD1-CD1 4.19Å; L211-I215 HydrophobicContact CD1-CG1 4.33Å; L211-I215 HydrophobicContact CG-CD1 3.92Å; L211-I215 HydrophobicContact CG-CG1 4.48Å; L211-I215 WeakPolarHBondContact O-CB 3.12Å; L211-I215 VanDerWaalsContact O-CG1 3.29Å; L211-I215 WeakPolarHBondContact O-CG1 3.34Å; L211-I215 PolarHBondContact O-N 2.63Å; I215-A218 PolarHBondContact O-N 2.58Å; I215-F219 HydrophobicContact CG2-CD2 4.14Å; I215-F219 WeakPolarHBondContact O-CB 3.33Å; I215-F219 PolarHBondContact O-N 3.39Å
216	R	83.6	Confident	81.2	Confident	91 Å²	91	67.9 Å²	67.9	34%	0.343	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-36.5	179.7	-72.9	-77.6	177.3	166.2	0.9	112.9	L212 C213 A214 Y220 M232	L212-R216 HydrophobicContact CD1-CG 4.47Å; L212-R216 WeakPolarHBondContact O-CB 3.38Å; L212-R216 WeakPolarHBondContact O-CG 3.47Å; L212-R216 PolarHBondContact O-N 3.12Å; C213-R216 PolarHBondContact O-N 2.83Å; A214-R216 VanDerWaalsContact C-N 3.29Å; A214-R216 PolarHBondContact O-N 3.38Å; R216-Y220 PolarHBondContact O-N 3.39Å; R216-M232 HydrophobicContact CB-SD 4.4Å
217	M	81.2	Confident	80.5	Confident	41 Å²	41	69.2 Å²	69.2	20%	0.202	39%	0.387	C	S	.	.	H	α-helix	trans	-73.7	-39.5	175.1	-70.6	-163.8	-58.7	0	0	112.5	V147 C213 A214 M232	V147-M217 HydrophobicContact CG1-SD 4.41Å; V147-M217 HydrophobicContact CG2-SD 4.32Å; C213-M217 WeakPolarHBondContact O-CG 3.27Å; C213-M217 PolarHBondContact O-N 3.22Å; A214-M217 PolarHBondContact O-N 3.2Å; M217-M232 HydrophobicContact CG-CB 4.43Å; M217-M232 HydrophobicContact CG-CG 4.13Å; M217-M232 HydrophobicContact CG-SD 3.69Å; M217-M232 HydrophobicContact SD-CB 4.3Å; M217-M232 HydrophobicContact SD-CG 4.42Å
218	A	82.5	Confident	79.9	Confident	3 Å²	3	71.9 Å²	71.9	3%	0.025	41%	0.405	C	S	.	.	H	α-helix	trans	-80.4	-39.2	-176	0	0	0	0	0	114.2	V153 F164 A214 I215	V153-A218 WeakPolarHBondContact CG2-O 3.31Å; F164-A218 HydrophobicContact CB-CB 3.71Å; F164-A218 HydrophobicContact CG-CB 4.2Å; A214-A218 WeakPolarHBondContact O-CB 3.36Å; A214-A218 PolarHBondContact O-N 3.48Å; I215-A218 PolarHBondContact O-N 2.58Å
219	F	81.4	Confident	79.1	Confident	114 Å²	114	73.9 Å²	73.9	50%	0.5	40%	0.4	S	S	.	.	S	Bend	trans	-101.7	3.6	-175.2	-66.6	-78.7	0	0	0	114.6	F161 F164 I215 L221	F161-F219 HydrophobicContact CD2-CZ 4.5Å; F161-F219 HydrophobicContact CE2-CE1 4.39Å; F161-F219 AromaticContact CE2-CZ 3.96Å; F161-F219 HydrophobicContact CE2-CZ 3.96Å; F164-F219 AromaticContact CD1-CE2 3.88Å; F164-F219 HydrophobicContact CD1-CE2 3.88Å; F164-F219 HydrophobicContact CD1-CZ 4.29Å; F164-F219 HydrophobicContact CD2-CE2 4.36Å; F164-F219 AromaticContact CE1-CE2 3.62Å; F164-F219 HydrophobicContact CE1-CE2 3.62Å; F164-F219 AromaticContact CE1-CZ 3.88Å; F164-F219 HydrophobicContact CE1-CZ 3.88Å; F164-F219 HydrophobicContact CE2-CE2 4.15Å; F164-F219 HydrophobicContact CG-CE2 4.24Å; F164-F219 AromaticContact CZ-CE2 3.77Å; F164-F219 HydrophobicContact CZ-CE2 3.77Å; F164-F219 HydrophobicContact CZ-CZ 4.32Å; I215-F219 HydrophobicContact CG2-CD2 4.14Å; I215-F219 WeakPolarHBondContact O-CB 3.33Å; I215-F219 PolarHBondContact O-N 3.39Å; F219-L221 PolarHBondContact O-N 2.89Å
220	Y	69.3	Low	78.6	Confident	87 Å²	87	73.6 Å²	73.6	34%	0.341	40%	0.402	S	S	.	.			trans	37.4	68.9	173	-169.8	-103.2	0	0	0	114.4	Q150 R216 D222	Q150-Y220 HydrophobicContact CB-CE2 4.36Å; Q150-Y220 HydrophobicContact CG-CD2 4.45Å; Q150-Y220 HydrophobicContact CG-CE2 3.75Å; Q150-Y220 PolarHBondContact OE1-OH 2.64Å; Q150-Y220 VanDerWaalsContact OE1-OH 3.08Å; R216-Y220 PolarHBondContact O-N 3.39Å; Y220-D222 VanDerWaalsContact CE1-OD1 3.24Å; Y220-D222 WeakPolarHBondContact CE1-OD1 3.44Å; Y220-D222 PolarHBondContact O-N 2.87Å
221	L	62.5	Low	78.2	Confident	74 Å²	74	77.6 Å²	77.6	39%	0.387	42%	0.42	S	S	.	.			trans	-70.6	111.9	173.1	-74.4	109.8	0	0	0	109.6	F219 S223 V224	F219-L221 PolarHBondContact O-N 2.89Å; L221-S223 PolarHBondContact O-N 2.95Å; L221-V224 WeakPolarHBondContact O-CG2 3.25Å
222	D	59.7	Low	77.7	Confident	131 Å²	131	77.8 Å²	77.8	70%	0.701	42%	0.421	S	S	*	.	S	Bend	trans	-51.2	-22	-173.6	-73.8	-61	0	0	0	116.5	Y220 V224	Y220-D222 VanDerWaalsContact CE1-OD1 3.24Å; Y220-D222 WeakPolarHBondContact CE1-OD1 3.44Å; Y220-D222 PolarHBondContact O-N 2.87Å; D222-V224 VanDerWaalsContact C-N 3.28Å; D222-V224 PolarHBondContact O-N 3.45Å
223	S	62.8	Low	77.3	Confident	102 Å²	102	77.9 Å²	77.9	71%	0.713	42%	0.415	S	S	*	.			trans	-82.8	39.6	-170.1	55.6	0	0	0	0	115.6	L221	L221-S223 PolarHBondContact O-N 2.95Å
224	V	65.2	Low	77.2	Confident	38 Å²	38	78 Å²	78	23%	0.23	42%	0.419	C	S	.	.			trans	-101.1	128.9	-170.2	178.1	0	0	0	0	113.1	L221 D222 T228 M232	L221-V224 WeakPolarHBondContact O-CG2 3.25Å; D222-V224 VanDerWaalsContact C-N 3.28Å; D222-V224 PolarHBondContact O-N 3.45Å; V224-T228 VanDerWaalsContact CG1-OG1 3.26Å; V224-T228 WeakPolarHBondContact CG1-OG1 3.41Å; V224-M232 HydrophobicContact CG1-CE 4.16Å
225	L	75.4	Confident	77	Confident	139 Å²	139	80.1 Å²	80.1	73%	0.728	43%	0.432	S	S	*	.			trans	-61.3	143.5	170.9	-68.7	167.3	0	0	0	111.7	C227 T228 R229	L225-C227 PolarHBondContact O-N 2.92Å; L225-C227 VanDerWaalsContact O-N 3.07Å; L225-T228 PolarHBondContact O-N 2.84Å; L225-T228 VanDerWaalsContact O-N 3.09Å; L225-T228 PolarHBondContact O-OG1 3.11Å; L225-R229 PolarHBondContact O-N 2.92Å
226	S	76	Confident	77	Confident	98 Å²	98	77.5 Å²	77.5	69%	0.685	42%	0.419	S	S	*	.	H	α-helix	trans	-55.5	-32.7	-179.4	-49	0	0	0	0	113.8	R229 V230	S226-R229 PolarHBondContact O-N 3.42Å; S226-V230 WeakPolarHBondContact O-CG2 3.39Å; S226-V230 PolarHBondContact O-N 3.11Å; S226-V230 VanDerWaalsContact O-N 3.08Å
227	C	79	Confident	77.2	Confident	103 Å²	103	73.7 Å²	73.7	70%	0.696	41%	0.408	S	S	*	.	H	α-helix	trans	-60.2	-48.2	176.8	-177	0	0	0	0	112.5	L225 R229 V230 L231	L225-C227 PolarHBondContact O-N 2.92Å; L225-C227 VanDerWaalsContact O-N 3.07Å; C227-R229 VanDerWaalsContact C-N 3.31Å; C227-R229 PolarHBondContact O-N 2.86Å; C227-V230 PolarHBondContact O-N 3.34Å; C227-L231 PolarHBondContact O-N 3.24Å
228	T	78.4	Confident	77.6	Confident	63 Å²	63	74.1 Å²	74.1	39%	0.387	41%	0.407	S	S	.	.	H	α-helix	trans	-69.7	-28.1	179.3	30.6	0	0	0	0	112.3	V224 L225 L231 M232	V224-T228 VanDerWaalsContact CG1-OG1 3.26Å; V224-T228 WeakPolarHBondContact CG1-OG1 3.41Å; L225-T228 PolarHBondContact O-N 2.84Å; L225-T228 VanDerWaalsContact O-N 3.09Å; L225-T228 PolarHBondContact O-OG1 3.11Å; T228-L231 PolarHBondContact O-N 2.66Å; T228-M232 WeakPolarHBondContact O-CG 3.34Å; T228-M232 PolarHBondContact O-N 3.26Å
229	R	77	Confident	77.9	Confident	99 Å²	99	80.6 Å²	80.6	37%	0.374	44%	0.44	S	S	.	.	H	α-helix	trans	-65.2	-43.6	170.2	-169.1	-176.8	-65.5	-170.6	-5.2	112.5	L225 S226 C227 M232 R233	L225-R229 PolarHBondContact O-N 2.92Å; S226-R229 PolarHBondContact O-N 3.42Å; C227-R229 VanDerWaalsContact C-N 3.31Å; C227-R229 PolarHBondContact O-N 2.86Å; R229-M232 PolarHBondContact O-N 2.65Å; R229-R233 PolarHBondContact O-N 3.27Å; R229-R233 VanDerWaalsContact O-N 3.12Å
230	V	81.8	Confident	78.4	Confident	96 Å²	96	78.3 Å²	78.3	58%	0.582	44%	0.435	S	S	*	.	H	α-helix	trans	-63.4	-42.1	175.1	173.6	0	0	0	0	110.9	S226 C227 R233 A234	S226-V230 WeakPolarHBondContact O-CG2 3.39Å; S226-V230 PolarHBondContact O-N 3.11Å; S226-V230 VanDerWaalsContact O-N 3.08Å; C227-V230 PolarHBondContact O-N 3.34Å; V230-R233 PolarHBondContact O-N 3.02Å; V230-A234 WeakPolarHBondContact O-CB 3.41Å; V230-A234 PolarHBondContact O-N 3.43Å
231	L	81.6	Confident	79.3	Confident	103 Å²	103	75.6 Å²	75.6	54%	0.539	42%	0.424	S	S	.	.	H	α-helix	trans	-60.1	-45.9	175.5	-177.8	63.3	0	0	0	112.2	C227 T228 R233 A234 V235	C227-L231 PolarHBondContact O-N 3.24Å; T228-L231 PolarHBondContact O-N 2.66Å; L231-R233 PolarHBondContact O-N 3.06Å; L231-A234 PolarHBondContact O-N 3.29Å; L231-V235 HydrophobicContact CD1-CG2 4.25Å; L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 3.47Å
232	M	81.4	Confident	80.7	Confident	38 Å²	38	73.1 Å²	73.1	19%	0.187	41%	0.41	C	S	.	.	H	α-helix	trans	-62.1	-42.2	177.9	-71.6	-177	-59.9	0	0	112.2	R216 M217 V224 T228 R229 A234 V235 S236	R216-M232 HydrophobicContact CB-SD 4.4Å; M217-M232 HydrophobicContact CG-CB 4.43Å; M217-M232 HydrophobicContact CG-CG 4.13Å; M217-M232 HydrophobicContact CG-SD 3.69Å; M217-M232 HydrophobicContact SD-CB 4.3Å; M217-M232 HydrophobicContact SD-CG 4.42Å; V224-M232 HydrophobicContact CG1-CE 4.16Å; T228-M232 WeakPolarHBondContact O-CG 3.34Å; T228-M232 PolarHBondContact O-N 3.26Å; R229-M232 PolarHBondContact O-N 2.65Å; M232-A234 VanDerWaalsContact C-N 3.33Å; M232-A234 PolarHBondContact O-N 2.86Å; M232-V235 PolarHBondContact O-N 3.05Å; M232-S236 WeakPolarHBondContact O-CB 3.48Å; M232-S236 PolarHBondContact O-N 3.42Å; M232-S236 PolarHBondContact O-OG 3.13Å
233	R	82.2	Confident	82.3	Confident	96 Å²	96	74.1 Å²	74.1	36%	0.362	41%	0.409	S	S	.	.	H	α-helix	trans	-64.4	-35.5	174.7	-164.8	-160.1	-108.3	117.3	-18.7	112.4	Q144 E148 R229 V230 L231 S236	Q144-R233 HydrophobicContact CG-CG 4.3Å; E148-R233 VanDerWaalsContact CD-NE 3.27Å; E148-R233 IonicContact OE1-CZ 3.74Å; E148-R233 IonicContact OE1-NE 2.67Å; E148-R233 IonicContact OE1-NH2 2.95Å; E148-R233 PolarHBondContact OE1-NH2 3.3Å; E148-R233 IonicContact OE2-CZ 3.55Å; E148-R233 IonicContact OE2-NE 3.61Å; E148-R233 PolarHBondContact OE2-NE 3.21Å; E148-R233 IonicContact OE2-NH2 2.65Å; E148-R233 PolarHBondContact OE2-NH2 2.93Å; R229-R233 PolarHBondContact O-N 3.27Å; R229-R233 VanDerWaalsContact O-N 3.12Å; V230-R233 PolarHBondContact O-N 3.02Å; L231-R233 PolarHBondContact O-N 3.06Å; R233-S236 PolarHBondContact O-OG 3.01Å; R233-S236 VanDerWaalsContact O-OG 3.13Å
234	A	84.7	Confident	83.6	Confident	58 Å²	58	71.8 Å²	71.8	48%	0.479	39%	0.39	S	S	.	.	H	α-helix	trans	-69.7	-36.7	176.5	0	0	0	0	0	112.5	V230 L231 M232	V230-A234 WeakPolarHBondContact O-CB 3.41Å; V230-A234 PolarHBondContact O-N 3.43Å; L231-A234 PolarHBondContact O-N 3.29Å; M232-A234 VanDerWaalsContact C-N 3.33Å; M232-A234 PolarHBondContact O-N 2.86Å
235	V	84.8	Confident	84.8	Confident	52 Å²	52	70.3 Å²	70.3	32%	0.315	38%	0.382	S	S	.	.	H	α-helix	trans	-76.7	-30.7	179.2	173.4	0	0	0	0	112.6	L231 M232 G237	L231-V235 HydrophobicContact CD1-CG2 4.25Å; L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 3.47Å; M232-V235 PolarHBondContact O-N 3.05Å; V235-G237 VanDerWaalsContact C-N 3.27Å; V235-G237 PolarHBondContact O-N 3.36Å
236	S	85.9	Confident	85.6	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.014	36%	0.355	C	S	.	.	H	α-helix	trans	-72.8	-15.6	-180	64.5	0	0	0	0	114.4	M232 R233	M232-S236 WeakPolarHBondContact O-CB 3.48Å; M232-S236 PolarHBondContact O-N 3.42Å; M232-S236 PolarHBondContact O-OG 3.13Å; R233-S236 PolarHBondContact O-OG 3.01Å; R233-S236 VanDerWaalsContact O-OG 3.13Å
237	G	88.1	Confident	86.4	Confident	11 Å²	11	63 Å²	63	11%	0.113	34%	0.342	C	S	.	.	S	Bend	trans	-61.8	141.1	177.7	0	0	0	0	0	113.7	V235 I239 V240 R241	V235-G237 VanDerWaalsContact C-N 3.27Å; V235-G237 PolarHBondContact O-N 3.36Å; G237-I239 PolarHBondContact O-N 3.47Å; G237-I239 VanDerWaalsContact O-N 3.15Å; G237-V240 PolarHBondContact O-N 2.73Å; G237-V240 VanDerWaalsContact O-N 3.12Å; G237-R241 WeakPolarHBondContact O-CB 3.28Å; G237-R241 PolarHBondContact O-N 2.71Å
238	W	89.2	Confident	87	Confident	49 Å²	49	58.8 Å²	58.8	19%	0.186	31%	0.312	C	S	.	.	H	α-helix	trans	-46.1	-51.3	-167.2	179.3	-92.6	0	0	0	115.4	Y139 R140 H242	Y139-W238 HydrophobicContact CD1-CH2 4.28Å; Y139-W238 HydrophobicContact CD1-CZ3 4.13Å; Y139-W238 AromaticContact CE1-CH2 3.64Å; Y139-W238 HydrophobicContact CE1-CH2 3.64Å; Y139-W238 AromaticContact CE1-CZ3 3.7Å; Y139-W238 HydrophobicContact CE1-CZ3 3.7Å; R140-W238 HydrophobicContact CB-CB 4.4Å; R140-W238 HydrophobicContact CB-CD2 4.1Å; R140-W238 HydrophobicContact CB-CE3 3.96Å; R140-W238 HydrophobicContact CB-CG 4.29Å; R140-W238 HydrophobicContact CG-CD2 3.71Å; R140-W238 HydrophobicContact CG-CE3 3.74Å; R140-W238 HydrophobicContact CG-CG 4.18Å; R140-W238 HydrophobicContact CG-CH2 4.42Å; R140-W238 HydrophobicContact CG-CZ2 4.39Å; R140-W238 HydrophobicContact CG-CZ3 4.09Å; W238-H242 AromaticContact CD2-CE1 3.7Å; W238-H242 AromaticContact CD2-ND1 3.97Å; W238-H242 AromaticContact CE2-CE1 3.31Å; W238-H242 AromaticContact CE2-ND1 3.77Å; W238-H242 AromaticContact CH2-CE1 3.66Å; W238-H242 AromaticContact CZ2-CE1 3.29Å; W238-H242 WeakPolarHBondContact CZ2-CE1 3.43Å; W238-H242 AromaticContact CZ2-NE2 3.83Å; W238-H242 AromaticContact NE1-CE1 3.78Å; W238-H242 AromaticContact NE1-ND1 3.84Å; W238-H242 PolarHBondContact O-N 2.64Å; W238-H242 PolarHBondContact O-ND1 2.89Å
239	I	90.1	Very high	87.6	Confident	140 Å²	140	55.9 Å²	55.9	72%	0.718	29%	0.294	S	S	*	.	H	α-helix	trans	-70.1	-44.6	-175.9	-61	172.8	0	0	0	111	G237 H242 F243	G237-I239 PolarHBondContact O-N 3.47Å; G237-I239 VanDerWaalsContact O-N 3.15Å; I239-H242 PolarHBondContact O-N 3.06Å; I239-F243 PolarHBondContact O-N 3.05Å; I239-F243 VanDerWaalsContact O-N 3.08Å
240	V	90.9	Very high	88.3	Confident	65 Å²	65	52.6 Å²	52.6	39%	0.394	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-42.6	-179.4	-176.8	0	0	0	0	110.1	G237 H242 F243 V244	G237-V240 PolarHBondContact O-N 2.73Å; G237-V240 VanDerWaalsContact O-N 3.12Å; V240-H242 VanDerWaalsContact C-N 3.31Å; V240-H242 PolarHBondContact O-N 3.12Å; V240-F243 PolarHBondContact O-N 3.17Å; V240-F243 VanDerWaalsContact O-N 3.17Å; V240-V244 HydrophobicContact CG1-CG2 4.14Å; V240-V244 WeakPolarHBondContact O-CG2 3.37Å; V240-V244 PolarHBondContact O-N 3.35Å
241	R	89.6	Confident	88.8	Confident	30 Å²	30	48.3 Å²	48.3	11%	0.113	26%	0.26	C	S	.	.	H	α-helix	trans	-58.6	-39.3	174.8	-167.6	-178.5	77.6	-150.7	7.5	112.8	Y143 G237 G245 H290 L291	Y143-R241 VanDerWaalsContact CG-NH1 3.28Å; G237-R241 WeakPolarHBondContact O-CB 3.28Å; G237-R241 PolarHBondContact O-N 2.71Å; R241-G245 WeakPolarHBondContact O-CA 3.08Å; R241-G245 PolarHBondContact O-N 2.85Å; R241-H290 PolarHBondContact NH2-O 3.17Å; R241-L291 HydrophobicContact CG-CD2 4.32Å
242	H	91.6	Very high	89.3	Confident	22 Å²	22	43.4 Å²	43.4	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-43	175.2	-80.1	78.7	0	0	0	112.1	W238 I239 V240 A246 S292 M295	W238-H242 AromaticContact CD2-CE1 3.7Å; W238-H242 AromaticContact CD2-ND1 3.97Å; W238-H242 AromaticContact CE2-CE1 3.31Å; W238-H242 AromaticContact CE2-ND1 3.77Å; W238-H242 AromaticContact CH2-CE1 3.66Å; W238-H242 AromaticContact CZ2-CE1 3.29Å; W238-H242 WeakPolarHBondContact CZ2-CE1 3.43Å; W238-H242 AromaticContact CZ2-NE2 3.83Å; W238-H242 AromaticContact NE1-CE1 3.78Å; W238-H242 AromaticContact NE1-ND1 3.84Å; W238-H242 PolarHBondContact O-N 2.64Å; W238-H242 PolarHBondContact O-ND1 2.89Å; I239-H242 PolarHBondContact O-N 3.06Å; V240-H242 VanDerWaalsContact C-N 3.31Å; V240-H242 PolarHBondContact O-N 3.12Å; H242-A246 WeakPolarHBondContact O-CB 3.33Å; H242-A246 PolarHBondContact O-N 2.84Å; H242-S292 PolarHBondContact NE2-N 3.19Å; H242-M295 HydrophobicContact CB-SD 3.92Å; H242-M295 WeakPolarHBondContact O-CE 3.45Å
243	F	92.1	Very high	89.8	Confident	152 Å²	152	41.7 Å²	41.7	67%	0.667	23%	0.226	S	C	*	.	H	α-helix	trans	-64.9	-49.3	177.4	-175.3	-96.9	0	0	0	112.5	I239 V240 G245 A246 V247	I239-F243 PolarHBondContact O-N 3.05Å; I239-F243 VanDerWaalsContact O-N 3.08Å; V240-F243 PolarHBondContact O-N 3.17Å; V240-F243 VanDerWaalsContact O-N 3.17Å; F243-G245 VanDerWaalsContact C-N 3.34Å; F243-G245 PolarHBondContact O-N 3.42Å; F243-A246 PolarHBondContact O-N 3.48Å; F243-V247 HydrophobicContact CE1-CG2 4.5Å; F243-V247 PolarHBondContact O-N 2.92Å
244	V	90.7	Very high	90.2	Very high	54 Å²	54	41 Å²	41	33%	0.327	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-43	176.8	174.5	0	0	0	0	110.6	V240 A246 V247 L248	V240-V244 HydrophobicContact CG1-CG2 4.14Å; V240-V244 WeakPolarHBondContact O-CG2 3.37Å; V240-V244 PolarHBondContact O-N 3.35Å; V244-A246 PolarHBondContact O-N 3.36Å; V244-V247 PolarHBondContact O-N 3.01Å; V244-L248 HydrophobicContact CG1-CD1 3.73Å; V244-L248 HydrophobicContact CG1-CG 4.32Å; V244-L248 WeakPolarHBondContact O-CG 3.33Å; V244-L248 PolarHBondContact O-N 2.96Å
245	G	91	Very high	90.4	Very high	6 Å²	6	38.3 Å²	38.3	6%	0.062	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-44.5	174.9	0	0	0	0	0	113.1	R241 F243 V247 L248 V249	R241-G245 WeakPolarHBondContact O-CA 3.08Å; R241-G245 PolarHBondContact O-N 2.85Å; F243-G245 VanDerWaalsContact C-N 3.34Å; F243-G245 PolarHBondContact O-N 3.42Å; G245-V247 VanDerWaalsContact C-N 3.29Å; G245-V247 PolarHBondContact O-N 3.32Å; G245-L248 PolarHBondContact O-N 3.09Å; G245-V249 WeakPolarHBondContact O-CB 3.45Å; G245-V249 WeakPolarHBondContact O-CG2 3.46Å; G245-V249 PolarHBondContact O-N 3.39Å
246	A	92.1	Very high	90.6	Very high	19 Å²	19	35.9 Å²	35.9	16%	0.157	19%	0.192	C	C	.	.	H	α-helix	trans	-58.9	-38.8	176.4	0	0	0	0	0	112.9	H242 F243 V244 S250 M295 I299	H242-A246 WeakPolarHBondContact O-CB 3.33Å; H242-A246 PolarHBondContact O-N 2.84Å; F243-A246 PolarHBondContact O-N 3.48Å; V244-A246 PolarHBondContact O-N 3.36Å; A246-S250 WeakPolarHBondContact O-CB 3.41Å; A246-S250 PolarHBondContact O-N 3Å; A246-S250 PolarHBondContact O-OG 3.07Å; A246-M295 HydrophobicContact CB-CE 4.04Å; A246-M295 HydrophobicContact CB-CG 4.4Å; A246-M295 HydrophobicContact CB-SD 3.9Å; A246-I299 HydrophobicContact CB-CD1 3.73Å
247	V	92.5	Very high	90.8	Very high	66 Å²	66	38 Å²	38	40%	0.4	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-54.1	174.3	175.2	0	0	0	0	110.3	F243 V244 G245 V249 S250 L251	F243-V247 HydrophobicContact CE1-CG2 4.5Å; F243-V247 PolarHBondContact O-N 2.92Å; V244-V247 PolarHBondContact O-N 3.01Å; G245-V247 VanDerWaalsContact C-N 3.29Å; G245-V247 PolarHBondContact O-N 3.32Å; V247-V249 PolarHBondContact O-N 3.11Å; V247-S250 WeakPolarHBondContact O-CB 3.28Å; V247-S250 PolarHBondContact O-N 2.96Å; V247-L251 HydrophobicContact CG1-CD2 4.48Å; V247-L251 PolarHBondContact O-N 3.08Å
248	L	91.4	Very high	90.7	Very high	13 Å²	13	38.1 Å²	38.1	7%	0.068	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-45	-174.9	-66.3	172.4	0	0	0	112.5	M167 A210 V244 G245 S250 L251	M167-L248 HydrophobicContact CE-CD1 3.38Å; M167-L248 HydrophobicContact SD-CD1 3.86Å; A210-L248 HydrophobicContact CB-CD1 3.9Å; A210-L248 HydrophobicContact CB-CD2 3.68Å; A210-L248 HydrophobicContact CB-CG 4.48Å; V244-L248 HydrophobicContact CG1-CD1 3.73Å; V244-L248 HydrophobicContact CG1-CG 4.32Å; V244-L248 WeakPolarHBondContact O-CG 3.33Å; V244-L248 PolarHBondContact O-N 2.96Å; G245-L248 PolarHBondContact O-N 3.09Å; L248-S250 PolarHBondContact O-N 3.5Å; L248-S250 VanDerWaalsContact O-N 3.11Å; L248-L251 HydrophobicContact CD2-CD1 3.81Å; L248-L251 WeakPolarHBondContact O-CB 3.38Å; L248-L251 PolarHBondContact O-N 2.94Å; L248-L251 VanDerWaalsContact O-N 3.14Å
249	V	91.5	Very high	90.4	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-25.1	176.6	-173.9	0	0	0	0	111.9	G245 V247 P252 Y285 F288 L291	G245-V249 WeakPolarHBondContact O-CB 3.45Å; G245-V249 WeakPolarHBondContact O-CG2 3.46Å; G245-V249 PolarHBondContact O-N 3.39Å; V247-V249 PolarHBondContact O-N 3.11Å; V249-P252 WeakPolarHBondContact O-CD 3.42Å; V249-Y285 HydrophobicContact CB-CD1 4.43Å; V249-Y285 HydrophobicContact CB-CE1 4.37Å; V249-Y285 HydrophobicContact CG1-CD1 3.3Å; V249-Y285 HydrophobicContact CG1-CD2 4.26Å; V249-Y285 HydrophobicContact CG1-CE1 3.6Å; V249-Y285 HydrophobicContact CG1-CG 3.65Å; V249-F288 HydrophobicContact CB-CD2 4.43Å; V249-F288 HydrophobicContact CG2-CB 4.2Å; V249-F288 HydrophobicContact CG2-CD2 3.37Å; V249-F288 HydrophobicContact CG2-CE2 3.99Å; V249-F288 HydrophobicContact CG2-CG 3.99Å; V249-L291 HydrophobicContact CG2-CD1 4.09Å
250	S	92.1	Very high	90	Very high	31 Å²	31	32 Å²	32	22%	0.217	17%	0.169	C	C	.	.	H	α-helix	trans	-87.7	-13	-178.9	-55	0	0	0	0	114.7	A246 V247 L248 A253 L254 Y285 I299	A246-S250 WeakPolarHBondContact O-CB 3.41Å; A246-S250 PolarHBondContact O-N 3Å; A246-S250 PolarHBondContact O-OG 3.07Å; V247-S250 WeakPolarHBondContact O-CB 3.28Å; V247-S250 PolarHBondContact O-N 2.96Å; L248-S250 PolarHBondContact O-N 3.5Å; L248-S250 VanDerWaalsContact O-N 3.11Å; S250-A253 PolarHBondContact O-N 2.89Å; S250-L254 PolarHBondContact O-N 3.25Å; S250-Y285 WeakPolarHBondContact CA-OH 3.47Å; S250-Y285 PolarHBondContact OG-OH 2.86Å; S250-I299 WeakPolarHBondContact OG-CG2 3.38Å
251	L	91.4	Very high	89.2	Confident	6 Å²	6	31.3 Å²	31.3	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-61.2	-41.2	-178.2	-65.4	-175.1	0	0	0	114.6	V203 L206 E207 V247 L248 A253 L254 A255	V203-L251 HydrophobicContact CG1-CB 3.98Å; V203-L251 HydrophobicContact CG2-CD2 4.24Å; L206-L251 HydrophobicContact CB-CD1 3.96Å; L206-L251 HydrophobicContact CD1-CD2 4.28Å; E207-L251 HydrophobicContact CG-CD1 3.86Å; V247-L251 HydrophobicContact CG1-CD2 4.48Å; V247-L251 PolarHBondContact O-N 3.08Å; L248-L251 HydrophobicContact CD2-CD1 3.81Å; L248-L251 WeakPolarHBondContact O-CB 3.38Å; L248-L251 PolarHBondContact O-N 2.94Å; L248-L251 VanDerWaalsContact O-N 3.14Å; L251-A253 VanDerWaalsContact C-N 3.34Å; L251-A253 PolarHBondContact O-N 2.93Å; L251-L254 PolarHBondContact O-N 3.24Å; L251-A255 PolarHBondContact O-N 2.99Å
252	P	91.6	Very high	88	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-40.9	175.5	-15.2	22.9	0	0	0	113	V174 L177 V249 A255 V256 A281 Q284	V174-P252 HydrophobicContact CG2-CB 3.97Å; V174-P252 HydrophobicContact CG2-CG 3.61Å; L177-P252 HydrophobicContact CD1-CB 4.02Å; V249-P252 WeakPolarHBondContact O-CD 3.42Å; P252-A255 PolarHBondContact O-N 2.84Å; P252-V256 WeakPolarHBondContact O-CG2 3.35Å; P252-V256 PolarHBondContact O-N 3.3Å; P252-A281 HydrophobicContact CB-CB 4.34Å; P252-Q284 HydrophobicContact CG-CG 3.99Å
253	A	91.8	Very high	86.7	Confident	2 Å²	2	35.6 Å²	35.6	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-42.3	178.1	0	0	0	0	0	111.4	S250 L251 A255 V256 Y257 A281 V303	S250-A253 PolarHBondContact O-N 2.89Å; L251-A253 VanDerWaalsContact C-N 3.34Å; L251-A253 PolarHBondContact O-N 2.93Å; A253-A255 VanDerWaalsContact C-N 3.34Å; A253-A255 PolarHBondContact O-N 3.47Å; A253-V256 PolarHBondContact O-N 3.36Å; A253-Y257 WeakPolarHBondContact O-CD2 3.38Å; A253-Y257 PolarHBondContact O-N 3.3Å; A253-A281 HydrophobicContact CB-CB 4.25Å; A253-V303 HydrophobicContact CB-CG1 3.85Å; A253-V303 HydrophobicContact CB-CG2 4.08Å
254	L	90.4	Very high	85.4	Confident	81 Å²	81	29.1 Å²	29.1	42%	0.424	17%	0.167	S	C	.	.	H	α-helix	trans	-62.8	-39.1	176.8	-175.9	61.8	0	0	0	112.2	V203 S250 L251 Y257 S258	V203-L254 HydrophobicContact CG2-CD2 4.25Å; V203-L254 HydrophobicContact CG2-CG 4.47Å; S250-L254 PolarHBondContact O-N 3.25Å; L251-L254 PolarHBondContact O-N 3.24Å; L254-Y257 PolarHBondContact O-N 3.31Å; L254-S258 PolarHBondContact O-N 2.93Å
255	A	89.3	Confident	84.2	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-50.3	174.3	0	0	0	0	0	111.2	V203 L251 P252 A253 Y257 S258 H259	V203-A255 HydrophobicContact CG1-CB 4.36Å; L251-A255 PolarHBondContact O-N 2.99Å; P252-A255 PolarHBondContact O-N 2.84Å; A253-A255 VanDerWaalsContact C-N 3.34Å; A253-A255 PolarHBondContact O-N 3.47Å; A255-Y257 PolarHBondContact O-N 2.93Å; A255-S258 WeakPolarHBondContact O-CB 3.33Å; A255-S258 PolarHBondContact O-N 3.42Å; A255-S258 PolarHBondContact O-OG 2.85Å; A255-H259 PolarHBondContact O-CD2 3.02Å
256	V	90.4	Very high	83.1	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-41.6	178.3	-179.2	0	0	0	0	111.8	L177 P252 A253 S258 H259 I274 A277 I278	L177-V256 HydrophobicContact CB-CG2 4.16Å; L177-V256 HydrophobicContact CD1-CG2 4.2Å; L177-V256 HydrophobicContact CD2-CG2 4.33Å; L177-V256 HydrophobicContact CG-CG2 4.48Å; P252-V256 WeakPolarHBondContact O-CG2 3.35Å; P252-V256 PolarHBondContact O-N 3.3Å; A253-V256 PolarHBondContact O-N 3.36Å; V256-S258 PolarHBondContact O-N 3.06Å; V256-H259 PolarHBondContact O-N 3.32Å; V256-I274 HydrophobicContact CG1-CD1 4.34Å; V256-I274 HydrophobicContact CG1-CG2 4.49Å; V256-A277 HydrophobicContact CG1-CB 3.79Å; V256-A277 HydrophobicContact CG2-CB 4.11Å; V256-I278 HydrophobicContact CB-CG1 4.31Å; V256-I278 HydrophobicContact CG1-CD1 4.24Å; V256-I278 HydrophobicContact CG1-CG1 3.69Å
257	Y	88.4	Confident	82.3	Confident	47 Å²	47	39.8 Å²	39.8	18%	0.184	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-25.9	176.4	-81.7	-56.5	0	0	0	113.9	A253 L254 A255 H259 F260 I278 V303 L307 L310	A253-Y257 WeakPolarHBondContact O-CD2 3.38Å; A253-Y257 PolarHBondContact O-N 3.3Å; L254-Y257 PolarHBondContact O-N 3.31Å; A255-Y257 PolarHBondContact O-N 2.93Å; Y257-H259 PolarHBondContact O-N 3.2Å; Y257-F260 WeakPolarHBondContact O-CB 3.22Å; Y257-F260 PolarHBondContact O-N 2.9Å; Y257-F260 VanDerWaalsContact O-N 3.13Å; Y257-I278 HydrophobicContact CD1-CD1 4.26Å; Y257-I278 HydrophobicContact CE1-CD1 3.72Å; Y257-V303 HydrophobicContact CE2-CG1 4.16Å; Y257-V303 PolarHBondContact OH-O 3.4Å; Y257-L307 WeakPolarHBondContact OH-CB 3.39Å; Y257-L307 PolarHBondContact OH-N 3.42Å; Y257-L310 HydrophobicContact CD1-CD1 4.43Å; Y257-L310 HydrophobicContact CE1-CD1 3.96Å
258	S	86.8	Confident	81.6	Confident	14 Å²	14	39.2 Å²	39.2	10%	0.098	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.1	177.8	81.3	0	0	0	0	113.7	A196 T200 L254 A255 V256	A196-S258 WeakPolarHBondContact CB-O 3.3Å; T200-S258 PolarHBondContact OG1-OG 3.42Å; L254-S258 PolarHBondContact O-N 2.93Å; A255-S258 WeakPolarHBondContact O-CB 3.33Å; A255-S258 PolarHBondContact O-N 3.42Å; A255-S258 PolarHBondContact O-OG 2.85Å; V256-S258 PolarHBondContact O-N 3.06Å
259	H	83	Confident	81.1	Confident	14 Å²	14	44.7 Å²	44.7	7%	0.065	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	6.4	177.9	-68.5	-94.5	0	0	0	114.1	C181 F182 A255 V256 Y257 T261	C181-H259 HydrophobicContact CB-CB 4.44Å; C181-H259 VanDerWaalsContact CB-CD2 3.43Å; C181-H259 WeakPolarHBondContact CB-CD2 3.43Å; C181-H259 WeakPolarHBondContact CB-NE2 3.42Å; F182-H259 AromaticContact CD1-CE1 3.75Å; F182-H259 AromaticContact CD2-CE1 3.77Å; F182-H259 AromaticContact CD2-NE2 3.87Å; F182-H259 AromaticContact CE1-CE1 3.57Å; F182-H259 AromaticContact CE2-CE1 3.57Å; F182-H259 AromaticContact CE2-NE2 3.48Å; F182-H259 WeakPolarHBondContact CE2-NE2 3.31Å; F182-H259 AromaticContact CG-CE1 3.84Å; F182-H259 AromaticContact CZ-CE1 3.47Å; F182-H259 VanDerWaalsContact CZ-CE1 3.47Å; F182-H259 WeakPolarHBondContact CZ-CE1 3.47Å; F182-H259 AromaticContact CZ-NE2 3.7Å; A255-H259 PolarHBondContact O-CD2 3.02Å; V256-H259 PolarHBondContact O-N 3.32Å; Y257-H259 PolarHBondContact O-N 3.2Å; H259-T261 PolarHBondContact O-N 3.47Å
260	F	81.7	Confident	80.5	Confident	47 Å²	47	45.8 Å²	45.8	21%	0.206	24%	0.237	C	C	.	.			trans	-73.8	117.3	-179	-157	-81.2	0	0	0	111.4	Y257 M264 L310 P315	Y257-F260 WeakPolarHBondContact O-CB 3.22Å; Y257-F260 PolarHBondContact O-N 2.9Å; Y257-F260 VanDerWaalsContact O-N 3.13Å; F260-M264 HydrophobicContact CD1-CG 4.12Å; F260-M264 HydrophobicContact CD2-CE 4.4Å; F260-M264 HydrophobicContact CD2-CG 4.12Å; F260-M264 HydrophobicContact CD2-SD 4Å; F260-M264 HydrophobicContact CE1-CB 4.45Å; F260-M264 HydrophobicContact CE1-CG 3.83Å; F260-M264 HydrophobicContact CE2-CE 3.57Å; F260-M264 HydrophobicContact CE2-CG 3.85Å; F260-M264 HydrophobicContact CE2-SD 3.73Å; F260-M264 HydrophobicContact CG-CG 4.25Å; F260-M264 HydrophobicContact CZ-CB 4.32Å; F260-M264 HydrophobicContact CZ-CE 3.86Å; F260-M264 HydrophobicContact CZ-CG 3.69Å; F260-M264 HydrophobicContact CZ-SD 4.14Å; F260-L310 HydrophobicContact CD2-CD1 4.33Å; F260-L310 HydrophobicContact CE1-CD1 4.48Å; F260-L310 HydrophobicContact CE1-CD2 4.16Å; F260-L310 HydrophobicContact CE2-CB 4.18Å; F260-L310 HydrophobicContact CE2-CD1 4.01Å; F260-L310 HydrophobicContact CZ-CB 3.78Å; F260-L310 HydrophobicContact CZ-CD1 4.1Å; F260-L310 HydrophobicContact CZ-CD2 4.24Å; F260-L310 HydrophobicContact CZ-CG 4.27Å; F260-P315 HydrophobicContact CE1-CG 4.06Å
261	T	73.9	Confident	80	Confident	49 Å²	49	44.5 Å²	44.5	30%	0.301	23%	0.228	S	C	.	.			trans	-124.1	160.2	179.8	60	0	0	0	0	111.2	H259 D263 M264	H259-T261 PolarHBondContact O-N 3.47Å; T261-D263 PolarHBondContact O-N 3.3Å; T261-M264 VanDerWaalsContact O-CB 3.22Å; T261-M264 WeakPolarHBondContact O-CB 3.45Å; T261-M264 WeakPolarHBondContact O-CG 3.33Å; T261-M264 PolarHBondContact O-N 3.4Å
262	C	65.4	Low	79.7	Confident	61 Å²	61	48.3 Å²	48.3	41%	0.412	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-63.1	-19.8	176.2	-80.9	0	0	0	0	113.8	M264 C316	C262-M264 PolarHBondContact O-N 3.24Å; C262-M264 VanDerWaalsContact O-N 3.11Å; C262-C316 HydrophobicContact CB-CB 3.97Å; C262-C316 WeakPolarHBondContact CB-SG 3.24Å; C262-C316 WeakPolarHBondContact SG-CB 3.35Å; C262-C316 CovalentContact SG-SG 2.04Å; C262-C316 PolarHBondContact SG-SG 2.96Å
263	D	63.1	Low	79.6	Confident	82 Å²	82	51.2 Å²	51.2	44%	0.439	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-65.4	-7.5	172.5	-72	-49.4	0	0	0	114	T261 Y265 N266	T261-D263 PolarHBondContact O-N 3.3Å; D263-Y265 PolarHBondContact O-N 3Å; D263-N266 WeakPolarHBondContact O-CB 3.27Å; D263-N266 PolarHBondContact O-N 3.13Å; D263-N266 PolarHBondContact OD1-ND2 2.92Å
264	M	66	Low	79.3	Confident	15 Å²	15	51.2 Å²	51.2	7%	0.074	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-44.9	-35.2	168.9	-86.1	-78.3	-49.7	0	0	114.4	F260 T261 C262 F270 T271 I274	F260-M264 HydrophobicContact CD1-CG 4.12Å; F260-M264 HydrophobicContact CD2-CE 4.4Å; F260-M264 HydrophobicContact CD2-CG 4.12Å; F260-M264 HydrophobicContact CD2-SD 4Å; F260-M264 HydrophobicContact CE1-CB 4.45Å; F260-M264 HydrophobicContact CE1-CG 3.83Å; F260-M264 HydrophobicContact CE2-CE 3.57Å; F260-M264 HydrophobicContact CE2-CG 3.85Å; F260-M264 HydrophobicContact CE2-SD 3.73Å; F260-M264 HydrophobicContact CG-CG 4.25Å; F260-M264 HydrophobicContact CZ-CB 4.32Å; F260-M264 HydrophobicContact CZ-CE 3.86Å; F260-M264 HydrophobicContact CZ-CG 3.69Å; F260-M264 HydrophobicContact CZ-SD 4.14Å; T261-M264 VanDerWaalsContact O-CB 3.22Å; T261-M264 WeakPolarHBondContact O-CB 3.45Å; T261-M264 WeakPolarHBondContact O-CG 3.33Å; T261-M264 PolarHBondContact O-N 3.4Å; C262-M264 PolarHBondContact O-N 3.24Å; C262-M264 VanDerWaalsContact O-N 3.11Å; M264-F270 HydrophobicContact CB-CD1 4.48Å; M264-F270 HydrophobicContact CG-CD1 3.98Å; M264-F270 HydrophobicContact CG-CE1 3.81Å; M264-F270 HydrophobicContact SD-CD1 3.44Å; M264-F270 WeakPolarHBondContact SD-CD1 3.38Å; M264-F270 HydrophobicContact SD-CE1 3.43Å; M264-F270 WeakPolarHBondContact SD-CE1 3.49Å; M264-T271 HydrophobicContact CE-CG2 4.03Å; M264-T271 PolarHBondContact O-OG1 3.38Å; M264-I274 HydrophobicContact CE-CB 4.48Å; M264-I274 HydrophobicContact CE-CG2 4.46Å; M264-I274 HydrophobicContact SD-CB 4.07Å; M264-I274 HydrophobicContact SD-CG1 3.84Å; M264-I274 HydrophobicContact SD-CG2 4.19Å
265	Y	65.1	Low	79.2	Confident	132 Å²	132	48 Å²	48	52%	0.518	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-90.5	-13.9	-177.9	-160.9	-95.2	0	0	0	113.2	D263	D263-Y265 PolarHBondContact O-N 3Å
266	N	66.9	Low	79.2	Confident	122 Å²	122	51.3 Å²	51.3	65%	0.652	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-16.4	-177.1	-67.1	-23.4	0	0	0	112.9	D263	D263-N266 WeakPolarHBondContact O-CB 3.27Å; D263-N266 PolarHBondContact O-N 3.13Å; D263-N266 PolarHBondContact OD1-ND2 2.92Å
267	S	75.6	Confident	79.2	Confident	50 Å²	50	51.6 Å²	51.6	35%	0.35	27%	0.268	S	S	.	.			trans	-143.6	113.8	178	-172.6	0	0	0	0	112.7	Q269 F270 T271	S267-Q269 PolarHBondContact O-N 3.44Å; S267-Q269 VanDerWaalsContact O-N 3.16Å; S267-F270 WeakPolarHBondContact O-CA 3.13Å; S267-F270 WeakPolarHBondContact O-CB 3.45Å; S267-F270 PolarHBondContact O-N 2.89Å; S267-T271 PolarHBondContact O-N 2.8Å; S267-T271 PolarHBondContact O-OG1 3.41Å
268	I	76.9	Confident	79.4	Confident	54 Å²	54	49.4 Å²	49.4	28%	0.277	26%	0.259	S	S	.	.	H	α-helix	trans	-51.3	-39.4	174.5	-60.5	156.3	0	0	0	111.6	F270 T271 M272 P353 H354 L357	I268-F270 PolarHBondContact O-N 2.57Å; I268-T271 WeakPolarHBondContact O-CB 3.3Å; I268-T271 PolarHBondContact O-N 3.28Å; I268-M272 HydrophobicContact CG2-CG 4.32Å; I268-M272 HydrophobicContact CG2-SD 4.16Å; I268-M272 WeakPolarHBondContact O-CG 3.41Å; I268-M272 PolarHBondContact O-N 3.25Å; I268-P353 HydrophobicContact CD1-CB 3.61Å; I268-P353 HydrophobicContact CD1-CG 3.72Å; I268-H354 VanDerWaalsContact CG1-NE2 3.25Å; I268-H354 WeakPolarHBondContact CG1-NE2 3.38Å; I268-L357 HydrophobicContact CG2-CD2 4.41Å
269	Q	80.9	Confident	79.6	Confident	127 Å²	127	51.4 Å²	51.4	59%	0.593	27%	0.269	S	S	*	.	H	α-helix	trans	-63.2	-29.5	178.3	-64.1	-63.3	-26.6	0	0	112	R184 S267 F273	R184-Q269 PolarHBondContact NH1-O 3.25Å; R184-Q269 VanDerWaalsContact NH2-C 3.3Å; R184-Q269 PolarHBondContact NH2-O 3.01Å; S267-Q269 PolarHBondContact O-N 3.44Å; S267-Q269 VanDerWaalsContact O-N 3.16Å; Q269-F273 WeakPolarHBondContact O-CB 3.44Å; Q269-F273 PolarHBondContact O-N 3.44Å
270	F	80.3	Confident	80.1	Confident	26 Å²	26	55.1 Å²	55.1	11%	0.114	29%	0.288	C	S	.	.	H	α-helix	trans	-75.9	-45.5	174.7	-165.3	-90	0	0	0	110.8	R184 M264 S267 I268 M272 F273 I274	R184-F270 VanDerWaalsContact NH2-N 3.13Å; M264-F270 HydrophobicContact CB-CD1 4.48Å; M264-F270 HydrophobicContact CG-CD1 3.98Å; M264-F270 HydrophobicContact CG-CE1 3.81Å; M264-F270 HydrophobicContact SD-CD1 3.44Å; M264-F270 WeakPolarHBondContact SD-CD1 3.38Å; M264-F270 HydrophobicContact SD-CE1 3.43Å; M264-F270 WeakPolarHBondContact SD-CE1 3.49Å; S267-F270 WeakPolarHBondContact O-CA 3.13Å; S267-F270 WeakPolarHBondContact O-CB 3.45Å; S267-F270 PolarHBondContact O-N 2.89Å; I268-F270 PolarHBondContact O-N 2.57Å; F270-M272 VanDerWaalsContact C-N 3.35Å; F270-M272 PolarHBondContact O-N 2.96Å; F270-F273 PolarHBondContact O-N 3.25Å; F270-I274 HydrophobicContact CD1-CG1 4.08Å; F270-I274 HydrophobicContact CE1-CD1 4.36Å; F270-I274 HydrophobicContact CE1-CG1 3.77Å; F270-I274 HydrophobicContact CZ-CD1 4.36Å; F270-I274 HydrophobicContact CZ-CG1 4.22Å; F270-I274 PolarHBondContact O-N 3.06Å; F270-I274 VanDerWaalsContact O-N 3.11Å
271	T	82	Confident	80.6	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-54	-49.2	174.1	-33	0	0	0	0	111.7	M264 S267 I268 C275 L311 L357	M264-T271 HydrophobicContact CE-CG2 4.03Å; M264-T271 PolarHBondContact O-OG1 3.38Å; S267-T271 PolarHBondContact O-N 2.8Å; S267-T271 PolarHBondContact O-OG1 3.41Å; I268-T271 WeakPolarHBondContact O-CB 3.3Å; I268-T271 PolarHBondContact O-N 3.28Å; T271-C275 PolarHBondContact O-N 3.45Å; T271-C275 PolarHBondContact O-SG 2.92Å; T271-L311 HydrophobicContact CG2-CD1 3.46Å; T271-L311 VanDerWaalsContact CG2-CD1 3.46Å; T271-L357 HydrophobicContact CG2-CD2 4.23Å
272	M	85.3	Confident	81.5	Confident	86 Å²	86	50.6 Å²	50.6	42%	0.424	26%	0.264	S	S	.	.	H	α-helix	trans	-63.3	-43.4	179.8	-71.5	-177.1	72.8	0	0	112.7	I268 F270 C275 C276 L357	I268-M272 HydrophobicContact CG2-CG 4.32Å; I268-M272 HydrophobicContact CG2-SD 4.16Å; I268-M272 WeakPolarHBondContact O-CG 3.41Å; I268-M272 PolarHBondContact O-N 3.25Å; F270-M272 VanDerWaalsContact C-N 3.35Å; F270-M272 PolarHBondContact O-N 2.96Å; M272-C275 PolarHBondContact O-N 3.31Å; M272-C276 PolarHBondContact O-N 3.29Å; M272-C276 PolarHBondContact O-SG 3.28Å; M272-C276 VanDerWaalsContact O-SG 3.37Å; M272-L357 HydrophobicContact CG-CD1 4.42Å; M272-L357 HydrophobicContact CG-CD2 4.28Å
273	F	87.7	Confident	82.8	Confident	61 Å²	61	51.3 Å²	51.3	27%	0.268	27%	0.266	S	S	.	.	H	α-helix	trans	-61.1	-46.6	179.4	173.5	-95.9	0	0	0	112.2	A180 Q269 F270 C275 C276 A277	A180-F273 HydrophobicContact CB-CE2 4.41Å; A180-F273 HydrophobicContact CB-CZ 3.98Å; A180-F273 WeakPolarHBondContact O-CZ 3.39Å; Q269-F273 WeakPolarHBondContact O-CB 3.44Å; Q269-F273 PolarHBondContact O-N 3.44Å; F270-F273 PolarHBondContact O-N 3.25Å; F273-C275 VanDerWaalsContact C-N 3.34Å; F273-C275 PolarHBondContact O-N 3.11Å; F273-C276 PolarHBondContact O-N 2.88Å; F273-A277 WeakPolarHBondContact O-CB 3.39Å; F273-A277 PolarHBondContact O-N 2.65Å
274	I	85.8	Confident	84.2	Confident	3 Å²	3	48 Å²	48	2%	0.015	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-37.3	177.9	-65.1	-62.6	0	0	0	111.3	V256 M264 F270 A277 I278	V256-I274 HydrophobicContact CG1-CD1 4.34Å; V256-I274 HydrophobicContact CG1-CG2 4.49Å; M264-I274 HydrophobicContact CE-CB 4.48Å; M264-I274 HydrophobicContact CE-CG2 4.46Å; M264-I274 HydrophobicContact SD-CB 4.07Å; M264-I274 HydrophobicContact SD-CG1 3.84Å; M264-I274 HydrophobicContact SD-CG2 4.19Å; F270-I274 HydrophobicContact CD1-CG1 4.08Å; F270-I274 HydrophobicContact CE1-CD1 4.36Å; F270-I274 HydrophobicContact CE1-CG1 3.77Å; F270-I274 HydrophobicContact CZ-CD1 4.36Å; F270-I274 HydrophobicContact CZ-CG1 4.22Å; F270-I274 PolarHBondContact O-N 3.06Å; F270-I274 VanDerWaalsContact O-N 3.11Å; I274-A277 PolarHBondContact O-N 3.34Å; I274-I278 HydrophobicContact CG2-CD1 3.87Å; I274-I278 WeakPolarHBondContact O-CG1 3.33Å; I274-I278 PolarHBondContact O-N 3.47Å
275	C	88	Confident	85.5	Confident	14 Å²	14	47.4 Å²	47.4	10%	0.095	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-47	172.8	-66.8	0	0	0	0	111.7	T271 M272 F273 A277 I278 I279 F365	T271-C275 PolarHBondContact O-N 3.45Å; T271-C275 PolarHBondContact O-SG 2.92Å; M272-C275 PolarHBondContact O-N 3.31Å; F273-C275 VanDerWaalsContact C-N 3.34Å; F273-C275 PolarHBondContact O-N 3.11Å; C275-A277 PolarHBondContact O-N 3.42Å; C275-I278 PolarHBondContact O-N 2.94Å; C275-I279 VanDerWaalsContact O-CG1 3.27Å; C275-I279 WeakPolarHBondContact O-CG1 3.4Å; C275-I279 PolarHBondContact O-N 3.46Å; C275-F365 HydrophobicContact CB-CE2 4.44Å; C275-F365 HydrophobicContact CB-CZ 4.31Å
276	C	90.1	Very high	86.8	Confident	70 Å²	70	41.9 Å²	41.9	47%	0.473	23%	0.226	S	C	.	.	H	α-helix	trans	-62.7	-41.4	176.5	-67.8	0	0	0	0	112.7	M272 F273 I278 I279 I280	M272-C276 PolarHBondContact O-N 3.29Å; M272-C276 PolarHBondContact O-SG 3.28Å; M272-C276 VanDerWaalsContact O-SG 3.37Å; F273-C276 PolarHBondContact O-N 2.88Å; C276-I278 PolarHBondContact O-N 2.82Å; C276-I279 PolarHBondContact O-N 3.03Å; C276-I280 WeakPolarHBondContact O-CG1 3.4Å; C276-I280 PolarHBondContact O-N 3.1Å; C276-I280 VanDerWaalsContact O-N 3.09Å
277	A	91.3	Very high	87.9	Confident	7 Å²	7	37.1 Å²	37.1	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-40.1	176.5	0	0	0	0	0	112.2	L177 V256 F273 I274 C275 I280 A281	L177-A277 HydrophobicContact CD2-CB 4.14Å; V256-A277 HydrophobicContact CG1-CB 3.79Å; V256-A277 HydrophobicContact CG2-CB 4.11Å; F273-A277 WeakPolarHBondContact O-CB 3.39Å; F273-A277 PolarHBondContact O-N 2.65Å; I274-A277 PolarHBondContact O-N 3.34Å; C275-A277 PolarHBondContact O-N 3.42Å; A277-I280 PolarHBondContact O-N 2.91Å; A277-A281 PolarHBondContact O-N 3.34Å
278	I	91.2	Very high	88.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-73	-32.1	175.8	-69.1	170.8	0	0	0	111.8	V256 Y257 I274 C275 C276 I280 A281 I282 V303 L307 F365	V256-I278 HydrophobicContact CB-CG1 4.31Å; V256-I278 HydrophobicContact CG1-CD1 4.24Å; V256-I278 HydrophobicContact CG1-CG1 3.69Å; Y257-I278 HydrophobicContact CD1-CD1 4.26Å; Y257-I278 HydrophobicContact CE1-CD1 3.72Å; I274-I278 HydrophobicContact CG2-CD1 3.87Å; I274-I278 WeakPolarHBondContact O-CG1 3.33Å; I274-I278 PolarHBondContact O-N 3.47Å; C275-I278 PolarHBondContact O-N 2.94Å; C276-I278 PolarHBondContact O-N 2.82Å; I278-I280 VanDerWaalsContact C-N 3.34Å; I278-I280 PolarHBondContact O-N 3.2Å; I278-A281 CarbonylContact O-C 3.56Å; I278-A281 PolarHBondContact O-N 3.27Å; I278-I282 HydrophobicContact CG2-CD1 3.77Å; I278-I282 HydrophobicContact CG2-CG1 4.19Å; I278-I282 WeakPolarHBondContact O-CB 3.4Å; I278-I282 VanDerWaalsContact O-CG1 3.28Å; I278-I282 WeakPolarHBondContact O-CG1 3.36Å; I278-I282 PolarHBondContact O-N 2.59Å; I278-V303 HydrophobicContact CG2-CG1 4.39Å; I278-L307 HydrophobicContact CB-CD2 3.85Å; I278-L307 HydrophobicContact CD1-CB 4.26Å; I278-L307 HydrophobicContact CD1-CD1 3.81Å; I278-L307 HydrophobicContact CD1-CD2 3.81Å; I278-L307 HydrophobicContact CD1-CG 4.17Å; I278-L307 HydrophobicContact CG1-CD2 4.4Å; I278-L307 HydrophobicContact CG2-CB 4.44Å; I278-L307 HydrophobicContact CG2-CD2 3.68Å; I278-F365 HydrophobicContact CG2-CE1 4.45Å
279	I	92.3	Very high	88.9	Confident	57 Å²	57	34 Å²	34	29%	0.292	18%	0.182	S	C	.	.	H	α-helix	trans	-58.9	-46.9	170.4	-72.4	166	0	0	0	110.4	C275 C276 I282 V283 F365 L368	C275-I279 VanDerWaalsContact O-CG1 3.27Å; C275-I279 WeakPolarHBondContact O-CG1 3.4Å; C275-I279 PolarHBondContact O-N 3.46Å; C276-I279 PolarHBondContact O-N 3.03Å; I279-I282 PolarHBondContact O-N 2.79Å; I279-V283 WeakPolarHBondContact O-CG2 3.42Å; I279-V283 PolarHBondContact O-N 2.85Å; I279-F365 HydrophobicContact CD1-CE1 4.3Å; I279-F365 HydrophobicContact CD1-CZ 4.1Å; I279-F365 HydrophobicContact CG1-CD1 4.37Å; I279-F365 HydrophobicContact CG1-CE1 3.48Å; I279-F365 VanDerWaalsContact CG1-CE1 3.48Å; I279-F365 HydrophobicContact CG1-CZ 3.68Å; I279-L368 HydrophobicContact CB-CD2 4.16Å; I279-L368 HydrophobicContact CG1-CD2 3.94Å; I279-L368 HydrophobicContact CG2-CD2 3.9Å
280	I	92.7	Very high	89	Confident	92 Å²	92	28.8 Å²	28.8	47%	0.472	16%	0.158	S	C	.	.	H	α-helix	trans	-61.8	-44.5	175.8	-64.9	166.1	0	0	0	110.8	V173 L177 C276 A277 I278 I282 V283 Q284	V173-I280 HydrophobicContact CG1-CG2 4.35Å; L177-I280 HydrophobicContact CD1-CG2 4.33Å; L177-I280 HydrophobicContact CD2-CB 4.18Å; L177-I280 HydrophobicContact CD2-CD1 4.5Å; L177-I280 HydrophobicContact CD2-CG2 4.04Å; L177-I280 HydrophobicContact CG-CG2 4.42Å; C276-I280 WeakPolarHBondContact O-CG1 3.4Å; C276-I280 PolarHBondContact O-N 3.1Å; C276-I280 VanDerWaalsContact O-N 3.09Å; A277-I280 PolarHBondContact O-N 2.91Å; I278-I280 VanDerWaalsContact C-N 3.34Å; I278-I280 PolarHBondContact O-N 3.2Å; I280-I282 VanDerWaalsContact C-N 3.31Å; I280-I282 PolarHBondContact O-N 3.1Å; I280-V283 PolarHBondContact O-N 3.22Å; I280-Q284 PolarHBondContact O-N 3.43Å; I280-Q284 VanDerWaalsContact O-N 3.09Å
281	A	91.8	Very high	89.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.7	-33.9	176	0	0	0	0	0	113.2	L177 P252 A253 A277 I278 Q284 Y285	L177-A281 HydrophobicContact CD1-CB 4.17Å; P252-A281 HydrophobicContact CB-CB 4.34Å; A253-A281 HydrophobicContact CB-CB 4.25Å; A277-A281 PolarHBondContact O-N 3.34Å; I278-A281 CarbonylContact O-C 3.56Å; I278-A281 PolarHBondContact O-N 3.27Å; A281-Q284 WeakPolarHBondContact O-CB 3.44Å; A281-Q284 PolarHBondContact O-N 3.47Å; A281-Y285 WeakPolarHBondContact O-CD2 3.49Å; A281-Y285 WeakPolarHBondContact O-CE2 3.4Å
282	I	93.3	Very high	89.7	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.2	-41.1	175.1	-73.8	168.2	0	0	0	111.1	I278 I279 I280 Q284 Y285 V303 F365 L368 L369 V372	I278-I282 HydrophobicContact CG2-CD1 3.77Å; I278-I282 HydrophobicContact CG2-CG1 4.19Å; I278-I282 WeakPolarHBondContact O-CB 3.4Å; I278-I282 VanDerWaalsContact O-CG1 3.28Å; I278-I282 WeakPolarHBondContact O-CG1 3.36Å; I278-I282 PolarHBondContact O-N 2.59Å; I279-I282 PolarHBondContact O-N 2.79Å; I280-I282 VanDerWaalsContact C-N 3.31Å; I280-I282 PolarHBondContact O-N 3.1Å; I282-Q284 PolarHBondContact O-N 3.39Å; I282-Y285 WeakPolarHBondContact O-CB 3.45Å; I282-Y285 PolarHBondContact O-N 3.5Å; I282-Y285 VanDerWaalsContact O-N 3.16Å; I282-V303 HydrophobicContact CD1-CG1 4.42Å; I282-V303 HydrophobicContact CG1-CG1 3.97Å; I282-F365 HydrophobicContact CD1-CD1 4.03Å; I282-F365 HydrophobicContact CD1-CE1 3.95Å; I282-L368 HydrophobicContact CB-CD2 4.06Å; I282-L368 HydrophobicContact CD1-CD2 4.35Å; I282-L368 HydrophobicContact CG2-CD2 3.7Å; I282-L368 HydrophobicContact CG2-CG 3.9Å; I282-L369 HydrophobicContact CG2-CD2 4.33Å; I282-V372 HydrophobicContact CG2-CG2 4.05Å
283	V	92.9	Very high	90	Very high	76 Å²	76	25.4 Å²	25.4	46%	0.461	14%	0.144	S	C	.	.	H	α-helix	trans	-60	-36.9	174.7	171.6	0	0	0	0	111	I279 I280 Y285 C286 L368	I279-V283 WeakPolarHBondContact O-CG2 3.42Å; I279-V283 PolarHBondContact O-N 2.85Å; I280-V283 PolarHBondContact O-N 3.22Å; V283-Y285 PolarHBondContact O-N 3.05Å; V283-Y285 VanDerWaalsContact O-N 3.09Å; V283-C286 VanDerWaalsContact O-CB 3.31Å; V283-C286 WeakPolarHBondContact O-CB 3.35Å; V283-C286 PolarHBondContact O-N 2.92Å; V283-C286 PolarHBondContact O-SG 3.33Å; V283-C286 VanDerWaalsContact O-SG 3.33Å; V283-L368 HydrophobicContact CG2-CD1 3.94Å
284	Q	92.3	Very high	90.2	Very high	14 Å²	14	28 Å²	28	7%	0.065	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-60.2	-19.2	178.1	-175.5	56.9	16.8	0	0	114.1	C170 V173 P252 I280 A281 I282 C286 N287	C170-Q284 VanDerWaalsContact CA-NE2 3.34Å; V173-Q284 HydrophobicContact CG1-CB 4.39Å; V173-Q284 HydrophobicContact CG1-CG 4.2Å; P252-Q284 HydrophobicContact CG-CG 3.99Å; I280-Q284 PolarHBondContact O-N 3.43Å; I280-Q284 VanDerWaalsContact O-N 3.09Å; A281-Q284 WeakPolarHBondContact O-CB 3.44Å; A281-Q284 PolarHBondContact O-N 3.47Å; I282-Q284 PolarHBondContact O-N 3.39Å; Q284-C286 PolarHBondContact O-N 3.31Å; Q284-C286 VanDerWaalsContact O-N 3.16Å; Q284-N287 PolarHBondContact NE2-ND2 2.94Å; Q284-N287 VanDerWaalsContact O-CB 3.27Å; Q284-N287 WeakPolarHBondContact O-CB 3.4Å; Q284-N287 PolarHBondContact O-N 3.29Å
285	Y	93.4	Very high	90.5	Very high	1 Å²	1	29.7 Å²	29.7	0%	0.004	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-63.5	-16.4	171.1	-76.5	-101.6	0	0	0	113.5	V249 S250 A281 I282 V283 N287 R296 I299 A300 V303	V249-Y285 HydrophobicContact CB-CD1 4.43Å; V249-Y285 HydrophobicContact CB-CE1 4.37Å; V249-Y285 HydrophobicContact CG1-CD1 3.3Å; V249-Y285 HydrophobicContact CG1-CD2 4.26Å; V249-Y285 HydrophobicContact CG1-CE1 3.6Å; V249-Y285 HydrophobicContact CG1-CG 3.65Å; S250-Y285 WeakPolarHBondContact CA-OH 3.47Å; S250-Y285 PolarHBondContact OG-OH 2.86Å; A281-Y285 WeakPolarHBondContact O-CD2 3.49Å; A281-Y285 WeakPolarHBondContact O-CE2 3.4Å; I282-Y285 WeakPolarHBondContact O-CB 3.45Å; I282-Y285 PolarHBondContact O-N 3.5Å; I282-Y285 VanDerWaalsContact O-N 3.16Å; V283-Y285 PolarHBondContact O-N 3.05Å; V283-Y285 VanDerWaalsContact O-N 3.09Å; Y285-N287 VanDerWaalsContact C-N 3.35Å; Y285-R296 WeakPolarHBondContact CD1-O 3.22Å; Y285-R296 WeakPolarHBondContact O-CD 3.28Å; Y285-I299 HydrophobicContact CD1-CB 4.49Å; Y285-I299 HydrophobicContact CE1-CB 3.81Å; Y285-I299 HydrophobicContact CE1-CG2 3.52Å; Y285-A300 HydrophobicContact CD1-CB 3.9Å; Y285-A300 HydrophobicContact CD2-CB 4.16Å; Y285-A300 HydrophobicContact CE1-CB 4.49Å; Y285-A300 HydrophobicContact CG-CB 3.75Å; Y285-V303 WeakPolarHBondContact OH-CG2 3.26Å
286	C	92.3	Very high	90.7	Very high	16 Å²	16	29.1 Å²	29.1	11%	0.108	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-74.9	-24.1	176.9	-56.8	0	0	0	0	113.6	V283 Q284 R296 N376 F379	V283-C286 VanDerWaalsContact O-CB 3.31Å; V283-C286 WeakPolarHBondContact O-CB 3.35Å; V283-C286 PolarHBondContact O-N 2.92Å; V283-C286 PolarHBondContact O-SG 3.33Å; V283-C286 VanDerWaalsContact O-SG 3.33Å; Q284-C286 PolarHBondContact O-N 3.31Å; Q284-C286 VanDerWaalsContact O-N 3.16Å; C286-R296 PolarHBondContact O-NH1 2.84Å; C286-R296 VanDerWaalsContact O-NH1 3.16Å; C286-N376 VanDerWaalsContact CA-OD1 3.32Å; C286-N376 WeakPolarHBondContact CA-OD1 3.21Å; C286-F379 HydrophobicContact CB-CE2 4.36Å
287	N	90.4	Very high	90.9	Very high	23 Å²	23	25.8 Å²	25.8	12%	0.123	13%	0.133	C	C	.	.	S	Bend	trans	-56.5	-58.3	-169	-174.2	38.4	0	0	0	113.6	D166 Q284 Y285 C289	D166-N287 PolarHBondContact O-ND2 3.47Å; Q284-N287 PolarHBondContact NE2-ND2 2.94Å; Q284-N287 VanDerWaalsContact O-CB 3.27Å; Q284-N287 WeakPolarHBondContact O-CB 3.4Å; Q284-N287 PolarHBondContact O-N 3.29Å; Y285-N287 VanDerWaalsContact C-N 3.35Å; N287-C289 VanDerWaalsContact C-N 3.33Å; N287-C289 PolarHBondContact O-N 2.84Å; N287-C289 PolarHBondContact O-SG 3.36Å
288	F	89	Confident	91.1	Very high	7 Å²	7	27.6 Å²	27.6	3%	0.031	14%	0.144	C	C	.	.			trans	-75.6	76	-170.8	-69	-81.2	0	0	0	113.6	D166 M167 C170 V249 H290 L291 R296	D166-F288 HydrophobicContact CB-CD1 3.58Å; D166-F288 HydrophobicContact CB-CE1 3.46Å; D166-F288 VanDerWaalsContact CB-CE1 3.46Å; D166-F288 HydrophobicContact CB-CG 4.36Å; D166-F288 HydrophobicContact CB-CZ 4.19Å; M167-F288 HydrophobicContact CE-CD1 4.21Å; M167-F288 HydrophobicContact CE-CE1 3.36Å; M167-F288 HydrophobicContact CE-CZ 3.83Å; M167-F288 HydrophobicContact CG-CE1 3.98Å; M167-F288 HydrophobicContact CG-CZ 4.34Å; M167-F288 HydrophobicContact SD-CE1 3.56Å; M167-F288 VanDerWaalsContact SD-CE1 3.56Å; M167-F288 HydrophobicContact SD-CZ 3.54Å; M167-F288 VanDerWaalsContact SD-CZ 3.54Å; C170-F288 HydrophobicContact CB-CE2 4Å; C170-F288 HydrophobicContact CB-CZ 3.88Å; V249-F288 HydrophobicContact CB-CD2 4.43Å; V249-F288 HydrophobicContact CG2-CB 4.2Å; V249-F288 HydrophobicContact CG2-CD2 3.37Å; V249-F288 HydrophobicContact CG2-CE2 3.99Å; V249-F288 HydrophobicContact CG2-CG 3.99Å; F288-H290 PolarHBondContact O-N 2.82Å; F288-H290 VanDerWaalsContact O-N 3.15Å; F288-L291 HydrophobicContact CB-CD1 3.69Å; F288-L291 HydrophobicContact CB-CG 4.13Å; F288-L291 HydrophobicContact CG-CD1 4.34Å; F288-L291 PolarHBondContact O-N 3.1Å; F288-R296 VanDerWaalsContact O-CD 3.3Å; F288-R296 WeakPolarHBondContact O-CD 3.46Å; F288-R296 PolarHBondContact O-NE 2.95Å; F288-R296 VanDerWaalsContact O-NE 3.14Å; F288-R296 PolarHBondContact O-NH1 2.9Å
289	C	83.6	Confident	91.2	Very high	32 Å²	32	29.4 Å²	29.4	22%	0.216	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.7	-171.6	-68.6	0	0	0	0	114	N287 L291 R296 F379	N287-C289 VanDerWaalsContact C-N 3.33Å; N287-C289 PolarHBondContact O-N 2.84Å; N287-C289 PolarHBondContact O-SG 3.36Å; C289-L291 PolarHBondContact O-N 3.36Å; C289-R296 PolarHBondContact O-NH2 3.01Å; C289-F379 HydrophobicContact CB-CB 4.46Å
290	H	82.6	Confident	91.3	Very high	17 Å²	17	26.7 Å²	26.7	8%	0.079	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-2.4	-178.8	-56.1	178.7	0	0	0	114.3	P159 R241 F288 Y383	P159-H290 PolarHBondContact O-CE1 2.91Å; P159-H290 VanDerWaalsContact O-CE1 3.24Å; R241-H290 PolarHBondContact NH2-O 3.17Å; F288-H290 PolarHBondContact O-N 2.82Å; F288-H290 VanDerWaalsContact O-N 3.15Å; H290-Y383 AromaticContact CD2-CD2 3.7Å; H290-Y383 AromaticContact CD2-CE2 3.24Å; H290-Y383 WeakPolarHBondContact CD2-CE2 3.07Å; H290-Y383 AromaticContact CD2-CZ 3.46Å; H290-Y383 VanDerWaalsContact CD2-CZ 3.46Å; H290-Y383 AromaticContact CG-CZ 3.92Å; H290-Y383 AromaticContact NE2-CD2 3.9Å; H290-Y383 AromaticContact NE2-CE2 3.18Å; H290-Y383 WeakPolarHBondContact NE2-CE2 3.48Å; H290-Y383 AromaticContact NE2-CZ 3.66Å
291	L	88.1	Confident	91.4	Very high	8 Å²	8	24.3 Å²	24.3	4%	0.042	13%	0.129	C	C	.	.	S	Bend	trans	-102.7	146.1	177.9	-59.2	177.2	0	0	0	110.5	R241 V249 F288 C289 Y293 M295 R296	R241-L291 HydrophobicContact CG-CD2 4.32Å; V249-L291 HydrophobicContact CG2-CD1 4.09Å; F288-L291 HydrophobicContact CB-CD1 3.69Å; F288-L291 HydrophobicContact CB-CG 4.13Å; F288-L291 HydrophobicContact CG-CD1 4.34Å; F288-L291 PolarHBondContact O-N 3.1Å; C289-L291 PolarHBondContact O-N 3.36Å; L291-Y293 PolarHBondContact O-N 3.34Å; L291-M295 HydrophobicContact CB-CE 3.95Å; L291-M295 HydrophobicContact CD1-CE 3.87Å; L291-M295 HydrophobicContact CD2-CE 4.39Å; L291-M295 HydrophobicContact CG-CE 4.3Å; L291-R296 HydrophobicContact CB-CG 4.21Å; L291-R296 PolarHBondContact O-NE 3.14Å; L291-R296 PolarHBondContact O-NH2 3.26Å
292	S	90.5	Very high	91.5	Very high	26 Å²	26	31.3 Å²	31.3	18%	0.182	16%	0.16	C	C	.	.			trans	-55.5	131.8	-179	-175	0	0	0	0	113	H242 W294 M295 R296 E380	H242-S292 PolarHBondContact NE2-N 3.19Å; S292-W294 VanDerWaalsContact C-N 3.26Å; S292-W294 PolarHBondContact O-N 3.34Å; S292-M295 PolarHBondContact O-N 3.06Å; S292-M295 VanDerWaalsContact O-N 3.17Å; S292-R296 PolarHBondContact O-N 3.19Å; S292-E380 VanDerWaalsContact CA-OE2 3.29Å; S292-E380 WeakPolarHBondContact CA-OE2 3.34Å
293	Y	91.7	Very high	91.5	Very high	9 Å²	9	32.1 Å²	32.1	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-61.1	-33.8	-178.7	90	-86	0	0	0	112.5	L126 L128 L291 M295 R296 S297 W373 N376 R377 E380	L126-Y293 PolarHBondContact O-OH 2.97Å; L128-Y293 HydrophobicContact CD1-CD1 3.53Å; L128-Y293 HydrophobicContact CD1-CE1 3.54Å; L128-Y293 HydrophobicContact CD1-CG 4.43Å; L128-Y293 HydrophobicContact CG-CD1 4.18Å; L128-Y293 HydrophobicContact CG-CE1 3.71Å; L291-Y293 PolarHBondContact O-N 3.34Å; Y293-M295 VanDerWaalsContact C-N 3.35Å; Y293-M295 PolarHBondContact O-N 2.94Å; Y293-R296 PolarHBondContact O-N 3.4Å; Y293-S297 WeakPolarHBondContact O-CB 3.34Å; Y293-S297 PolarHBondContact O-N 3Å; Y293-S297 PolarHBondContact O-OG 3.29Å; Y293-W373 HydrophobicContact CE2-CE3 4.18Å; Y293-W373 AromaticContact CE2-CZ3 4Å; Y293-W373 HydrophobicContact CE2-CZ3 4Å; Y293-N376 WeakPolarHBondContact CB-O 3.25Å; Y293-R377 HydrophobicContact CD2-CB 3.88Å; Y293-R377 HydrophobicContact CD2-CG 4.41Å; Y293-R377 HydrophobicContact CE2-CB 4.07Å; Y293-R377 HydrophobicContact CE2-CG 4.21Å; Y293-R377 HydrophobicContact CG-CB 4.33Å; Y293-E380 WeakPolarHBondContact CD1-OE2 3.29Å; Y293-E380 PolarHBondContact N-OE2 3.33Å
294	W	91	Very high	91.4	Very high	115 Å²	115	28.6 Å²	28.6	44%	0.436	14%	0.143	S	C	.	.	H	α-helix	trans	-58.6	-46.9	175.7	-87.7	99.5	0	0	0	111.2	L126 S292 T298 W373	L126-W294 PolarHBondContact O-NE1 3.07Å; S292-W294 VanDerWaalsContact C-N 3.26Å; S292-W294 PolarHBondContact O-N 3.34Å; W294-T298 HydrophobicContact CE3-CG2 4.48Å; W294-T298 WeakPolarHBondContact O-CB 3.47Å; W294-T298 VanDerWaalsContact O-CG2 3.23Å; W294-T298 WeakPolarHBondContact O-CG2 3.45Å; W294-T298 PolarHBondContact O-N 3.11Å; W294-T298 PolarHBondContact O-OG1 2.86Å; W294-W373 HydrophobicContact CD2-CH2 4.49Å; W294-W373 AromaticContact CE3-CH2 3.81Å; W294-W373 HydrophobicContact CE3-CH2 3.81Å; W294-W373 HydrophobicContact CE3-CZ3 4.38Å; W294-W373 HydrophobicContact CH2-CH2 4.28Å; W294-W373 HydrophobicContact CH2-CZ3 4.49Å; W294-W373 AromaticContact CZ3-CH2 3.7Å; W294-W373 HydrophobicContact CZ3-CH2 3.7Å; W294-W373 HydrophobicContact CZ3-CZ3 4.3Å
295	M	91.9	Very high	91.3	Very high	39 Å²	39	32.5 Å²	32.5	19%	0.192	16%	0.164	C	C	.	.	H	α-helix	trans	-65.6	-50.7	179.7	-175.4	-174.3	82.8	0	0	111.1	H242 A246 L291 S292 Y293 S297 T298 I299	H242-M295 HydrophobicContact CB-SD 3.92Å; H242-M295 WeakPolarHBondContact O-CE 3.45Å; A246-M295 HydrophobicContact CB-CE 4.04Å; A246-M295 HydrophobicContact CB-CG 4.4Å; A246-M295 HydrophobicContact CB-SD 3.9Å; L291-M295 HydrophobicContact CB-CE 3.95Å; L291-M295 HydrophobicContact CD1-CE 3.87Å; L291-M295 HydrophobicContact CD2-CE 4.39Å; L291-M295 HydrophobicContact CG-CE 4.3Å; S292-M295 PolarHBondContact O-N 3.06Å; S292-M295 VanDerWaalsContact O-N 3.17Å; Y293-M295 VanDerWaalsContact C-N 3.35Å; Y293-M295 PolarHBondContact O-N 2.94Å; M295-S297 PolarHBondContact O-N 3.19Å; M295-T298 PolarHBondContact O-OG1 3.29Å; M295-T298 VanDerWaalsContact O-OG1 3.11Å; M295-I299 HydrophobicContact CG-CD1 3.95Å; M295-I299 VanDerWaalsContact O-CG1 3.28Å; M295-I299 WeakPolarHBondContact O-CG1 3.49Å; M295-I299 PolarHBondContact O-N 2.9Å; M295-I299 VanDerWaalsContact O-N 3.15Å
296	R	92.9	Very high	91.1	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-61	-46.5	-179.1	-68.3	-174.4	-76	148.9	-12.1	111.9	Y285 C286 F288 C289 L291 S292 Y293 A300 N376	Y285-R296 WeakPolarHBondContact CD1-O 3.22Å; Y285-R296 WeakPolarHBondContact O-CD 3.28Å; C286-R296 PolarHBondContact O-NH1 2.84Å; C286-R296 VanDerWaalsContact O-NH1 3.16Å; F288-R296 VanDerWaalsContact O-CD 3.3Å; F288-R296 WeakPolarHBondContact O-CD 3.46Å; F288-R296 PolarHBondContact O-NE 2.95Å; F288-R296 VanDerWaalsContact O-NE 3.14Å; F288-R296 PolarHBondContact O-NH1 2.9Å; C289-R296 PolarHBondContact O-NH2 3.01Å; L291-R296 HydrophobicContact CB-CG 4.21Å; L291-R296 PolarHBondContact O-NE 3.14Å; L291-R296 PolarHBondContact O-NH2 3.26Å; S292-R296 PolarHBondContact O-N 3.19Å; Y293-R296 PolarHBondContact O-N 3.4Å; R296-A300 WeakPolarHBondContact O-CB 3.44Å; R296-A300 PolarHBondContact O-N 3.08Å; R296-N376 PolarHBondContact NH1-OD1 3Å; R296-N376 VanDerWaalsContact NH1-OD1 3.13Å
297	S	94.6	Very high	90.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-74.3	-32.7	-175.2	-45.2	0	0	0	0	112.8	Y293 M295 T301 W373 N376	Y293-S297 WeakPolarHBondContact O-CB 3.34Å; Y293-S297 PolarHBondContact O-N 3Å; Y293-S297 PolarHBondContact O-OG 3.29Å; M295-S297 PolarHBondContact O-N 3.19Å; S297-T301 WeakPolarHBondContact O-CG2 3.45Å; S297-T301 PolarHBondContact O-N 2.91Å; S297-T301 PolarHBondContact O-OG1 2.94Å; S297-W373 VanDerWaalsContact CB-CE2 3.49Å; S297-W373 PolarHBondContact O-NE1 3.23Å; S297-N376 WeakPolarHBondContact OG-CB 3.32Å; S297-N376 PolarHBondContact OG-ND2 3.03Å
298	T	94.1	Very high	90.6	Very high	45 Å²	45	34.6 Å²	34.6	28%	0.276	18%	0.18	S	C	.	.	H	α-helix	trans	-68.6	-45	174	50.4	0	0	0	0	111.8	W294 M295 A300 T301 F302 W373	W294-T298 HydrophobicContact CE3-CG2 4.48Å; W294-T298 WeakPolarHBondContact O-CB 3.47Å; W294-T298 VanDerWaalsContact O-CG2 3.23Å; W294-T298 WeakPolarHBondContact O-CG2 3.45Å; W294-T298 PolarHBondContact O-N 3.11Å; W294-T298 PolarHBondContact O-OG1 2.86Å; M295-T298 PolarHBondContact O-OG1 3.29Å; M295-T298 VanDerWaalsContact O-OG1 3.11Å; T298-A300 PolarHBondContact O-N 3.23Å; T298-T301 WeakPolarHBondContact CA-OG1 3.23Å; T298-T301 PolarHBondContact O-N 3.48Å; T298-T301 PolarHBondContact O-OG1 3.5Å; T298-F302 WeakPolarHBondContact O-CD2 3.25Å; T298-F302 PolarHBondContact O-N 3.15Å; T298-W373 HydrophobicContact CG2-CZ2 4.17Å
299	I	94.3	Very high	90.4	Very high	39 Å²	39	37.9 Å²	37.9	20%	0.2	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-42.1	176.5	-57.5	165.4	0	0	0	110.6	A246 S250 Y285 M295 T301 F302 V303	A246-I299 HydrophobicContact CB-CD1 3.73Å; S250-I299 WeakPolarHBondContact OG-CG2 3.38Å; Y285-I299 HydrophobicContact CD1-CB 4.49Å; Y285-I299 HydrophobicContact CE1-CB 3.81Å; Y285-I299 HydrophobicContact CE1-CG2 3.52Å; M295-I299 HydrophobicContact CG-CD1 3.95Å; M295-I299 VanDerWaalsContact O-CG1 3.28Å; M295-I299 WeakPolarHBondContact O-CG1 3.49Å; M295-I299 PolarHBondContact O-N 2.9Å; M295-I299 VanDerWaalsContact O-N 3.15Å; I299-T301 VanDerWaalsContact C-N 3.31Å; I299-T301 PolarHBondContact O-N 2.97Å; I299-F302 PolarHBondContact O-N 2.92Å; I299-F302 VanDerWaalsContact O-N 3.14Å; I299-V303 PolarHBondContact O-N 2.77Å
300	A	94.3	Very high	90.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-41.9	173	0	0	0	0	0	112.4	Y285 R296 T298 V303 G304 V372	Y285-A300 HydrophobicContact CD1-CB 3.9Å; Y285-A300 HydrophobicContact CD2-CB 4.16Å; Y285-A300 HydrophobicContact CE1-CB 4.49Å; Y285-A300 HydrophobicContact CG-CB 3.75Å; R296-A300 WeakPolarHBondContact O-CB 3.44Å; R296-A300 PolarHBondContact O-N 3.08Å; T298-A300 PolarHBondContact O-N 3.23Å; A300-V303 PolarHBondContact O-N 3.4Å; A300-G304 PolarHBondContact O-N 2.99Å; A300-V372 HydrophobicContact CB-CG1 4.19Å
301	T	94.4	Very high	90	Very high	41 Å²	41	39.2 Å²	39.2	25%	0.252	21%	0.206	S	C	.	.	H	α-helix	trans	-66.2	-37	174.7	50.7	0	0	0	0	113.4	S297 T298 I299 G304 L305 L369 W373	S297-T301 WeakPolarHBondContact O-CG2 3.45Å; S297-T301 PolarHBondContact O-N 2.91Å; S297-T301 PolarHBondContact O-OG1 2.94Å; T298-T301 WeakPolarHBondContact CA-OG1 3.23Å; T298-T301 PolarHBondContact O-N 3.48Å; T298-T301 PolarHBondContact O-OG1 3.5Å; I299-T301 VanDerWaalsContact C-N 3.31Å; I299-T301 PolarHBondContact O-N 2.97Å; T301-G304 PolarHBondContact O-N 3.42Å; T301-L305 WeakPolarHBondContact O-CB 3.28Å; T301-L305 PolarHBondContact O-N 3.34Å; T301-L369 HydrophobicContact CG2-CB 4.4Å; T301-L369 HydrophobicContact CG2-CD1 4.22Å; T301-L369 HydrophobicContact CG2-CD2 3.94Å; T301-L369 HydrophobicContact CG2-CG 4.41Å; T301-W373 VanDerWaalsContact CG2-NE1 3.32Å
302	F	94.4	Very high	89.4	Confident	148 Å²	148	42.3 Å²	42.3	65%	0.649	23%	0.227	S	C	*	.	H	α-helix	trans	-65.5	-41.3	174.1	-75.5	-63.8	0	0	0	111.8	T298 I299 L305 A306	T298-F302 WeakPolarHBondContact O-CD2 3.25Å; T298-F302 PolarHBondContact O-N 3.15Å; I299-F302 PolarHBondContact O-N 2.92Å; I299-F302 VanDerWaalsContact O-N 3.14Å; F302-L305 PolarHBondContact O-N 2.86Å; F302-A306 WeakPolarHBondContact O-CB 3.5Å; F302-A306 PolarHBondContact O-N 2.8Å
303	V	93.3	Very high	88.5	Confident	17 Å²	17	44.4 Å²	44.4	10%	0.103	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-44.4	174.9	162.4	0	0	0	0	111.8	A253 Y257 I278 I282 Y285 I299 A300 L307	A253-V303 HydrophobicContact CB-CG1 3.85Å; A253-V303 HydrophobicContact CB-CG2 4.08Å; Y257-V303 HydrophobicContact CE2-CG1 4.16Å; Y257-V303 PolarHBondContact OH-O 3.4Å; I278-V303 HydrophobicContact CG2-CG1 4.39Å; I282-V303 HydrophobicContact CD1-CG1 4.42Å; I282-V303 HydrophobicContact CG1-CG1 3.97Å; Y285-V303 WeakPolarHBondContact OH-CG2 3.26Å; I299-V303 PolarHBondContact O-N 2.77Å; A300-V303 PolarHBondContact O-N 3.4Å; V303-L307 PolarHBondContact O-N 3.48Å
304	G	90.6	Very high	87.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-41.4	175.8	0	0	0	0	0	113.3	A300 T301 L307 L308	A300-G304 PolarHBondContact O-N 2.99Å; T301-G304 PolarHBondContact O-N 3.42Å; G304-L307 PolarHBondContact O-N 3.43Å; G304-L308 PolarHBondContact O-N 2.91Å
305	L	90.8	Very high	85.7	Confident	96 Å²	96	42.4 Å²	42.4	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-68.9	-34.5	179	-175.1	63.1	0	0	0	112.6	T301 F302 L308 T309	T301-L305 WeakPolarHBondContact O-CB 3.28Å; T301-L305 PolarHBondContact O-N 3.34Å; F302-L305 PolarHBondContact O-N 2.86Å; L305-L308 PolarHBondContact O-N 3.11Å; L305-T309 WeakPolarHBondContact O-CB 3.41Å; L305-T309 PolarHBondContact O-N 3.46Å; L305-T309 PolarHBondContact O-OG1 3.34Å
306	A	89.4	Confident	83.9	Confident	42 Å²	42	43 Å²	43	35%	0.347	25%	0.252	S	S	.	.	H	α-helix	trans	-60.5	-47.7	173.5	0	0	0	0	0	111.3	F302 L308 T309 L310	F302-A306 WeakPolarHBondContact O-CB 3.5Å; F302-A306 PolarHBondContact O-N 2.8Å; A306-L308 PolarHBondContact O-N 3.15Å; A306-T309 PolarHBondContact O-N 2.91Å; A306-L310 WeakPolarHBondContact O-CG 3.38Å; A306-L310 PolarHBondContact O-N 3.07Å
307	L	86.4	Confident	82	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.2	-45.1	174.7	176	60.7	0	0	0	111.3	Y257 I278 V303 G304 T309 L310 L311 F365	Y257-L307 WeakPolarHBondContact OH-CB 3.39Å; Y257-L307 PolarHBondContact OH-N 3.42Å; I278-L307 HydrophobicContact CB-CD2 3.85Å; I278-L307 HydrophobicContact CD1-CB 4.26Å; I278-L307 HydrophobicContact CD1-CD1 3.81Å; I278-L307 HydrophobicContact CD1-CD2 3.81Å; I278-L307 HydrophobicContact CD1-CG 4.17Å; I278-L307 HydrophobicContact CG1-CD2 4.4Å; I278-L307 HydrophobicContact CG2-CB 4.44Å; I278-L307 HydrophobicContact CG2-CD2 3.68Å; V303-L307 PolarHBondContact O-N 3.48Å; G304-L307 PolarHBondContact O-N 3.43Å; L307-T309 VanDerWaalsContact C-N 3.27Å; L307-T309 PolarHBondContact O-N 3.14Å; L307-L310 PolarHBondContact O-N 3.31Å; L307-L311 WeakPolarHBondContact O-CB 3.3Å; L307-L311 PolarHBondContact O-N 3Å; L307-F365 HydrophobicContact CD2-CE1 3.91Å; L307-F365 HydrophobicContact CD2-CE2 3.68Å; L307-F365 HydrophobicContact CD2-CZ 3.27Å; L307-F365 HydrophobicContact CG-CZ 4.5Å
308	L	85.1	Confident	80	Confident	43 Å²	43	49.7 Å²	49.7	23%	0.225	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-39.5	-179.1	-165	65.2	0	0	0	111.8	G304 L305 A306 L311 C312 C362	G304-L308 PolarHBondContact O-N 2.91Å; L305-L308 PolarHBondContact O-N 3.11Å; A306-L308 PolarHBondContact O-N 3.15Å; L308-L311 PolarHBondContact O-N 2.58Å; L308-C312 WeakPolarHBondContact O-CB 3.36Å; L308-C312 PolarHBondContact O-N 3.23Å; L308-C312 PolarHBondContact O-SG 3.32Å; L308-C362 HydrophobicContact CD1-CB 4.32Å
309	T	84.2	Confident	78	Confident	76 Å²	76	51.4 Å²	51.4	47%	0.466	31%	0.306	S	S	.	.	H	α-helix	trans	-65.3	-44.1	175.4	-54.2	0	0	0	0	111.2	L305 A306 L307 L311 C312 C313	L305-T309 WeakPolarHBondContact O-CB 3.41Å; L305-T309 PolarHBondContact O-N 3.46Å; L305-T309 PolarHBondContact O-OG1 3.34Å; A306-T309 PolarHBondContact O-N 2.91Å; L307-T309 VanDerWaalsContact C-N 3.27Å; L307-T309 PolarHBondContact O-N 3.14Å; T309-L311 VanDerWaalsContact C-N 3.29Å; T309-L311 PolarHBondContact O-N 3.41Å; T309-C312 PolarHBondContact O-N 3.1Å; T309-C313 WeakPolarHBondContact O-CB 3.48Å; T309-C313 PolarHBondContact O-N 2.94Å
310	L	80.6	Confident	75.8	Confident	53 Å²	53	54.6 Å²	54.6	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-65.8	-28.3	175.6	-72.4	167.9	0	0	0	113.4	Y257 F260 A306 L307 P315	Y257-L310 HydrophobicContact CD1-CD1 4.43Å; Y257-L310 HydrophobicContact CE1-CD1 3.96Å; F260-L310 HydrophobicContact CD2-CD1 4.33Å; F260-L310 HydrophobicContact CE1-CD1 4.48Å; F260-L310 HydrophobicContact CE1-CD2 4.16Å; F260-L310 HydrophobicContact CE2-CB 4.18Å; F260-L310 HydrophobicContact CE2-CD1 4.01Å; F260-L310 HydrophobicContact CZ-CB 3.78Å; F260-L310 HydrophobicContact CZ-CD1 4.1Å; F260-L310 HydrophobicContact CZ-CD2 4.24Å; F260-L310 HydrophobicContact CZ-CG 4.27Å; A306-L310 WeakPolarHBondContact O-CG 3.38Å; A306-L310 PolarHBondContact O-N 3.07Å; L307-L310 PolarHBondContact O-N 3.31Å; L310-P315 HydrophobicContact CD2-CG 4.38Å
311	L	78.1	Confident	73.7	Confident	24 Å²	24	58 Å²	58	13%	0.126	34%	0.344	C	S	.	.	H	α-helix	trans	-79.9	-34.2	176.8	-169.4	69	0	0	0	112.1	T271 L307 L308 T309 I358 A361	T271-L311 HydrophobicContact CG2-CD1 3.46Å; T271-L311 VanDerWaalsContact CG2-CD1 3.46Å; L307-L311 WeakPolarHBondContact O-CB 3.3Å; L307-L311 PolarHBondContact O-N 3Å; L308-L311 PolarHBondContact O-N 2.58Å; T309-L311 VanDerWaalsContact C-N 3.29Å; T309-L311 PolarHBondContact O-N 3.41Å; L311-I358 HydrophobicContact CD2-CG1 4.45Å; L311-I358 HydrophobicContact CG-CG1 4.18Å; L311-A361 HydrophobicContact CD2-CB 3.72Å
312	C	75.1	Confident	71.7	Confident	72 Å²	72	62.9 Å²	62.9	49%	0.486	36%	0.362	S	S	.	.	H	α-helix	trans	-81.1	-34.1	177.2	-64.6	0	0	0	0	113.1	L308 T309	L308-C312 WeakPolarHBondContact O-CB 3.36Å; L308-C312 PolarHBondContact O-N 3.23Å; L308-C312 PolarHBondContact O-SG 3.32Å; T309-C312 PolarHBondContact O-N 3.1Å
313	C	71.6	Confident	69.7	Low	70 Å²	70	63.1 Å²	63.1	47%	0.473	36%	0.363	S	S	.	.	S	Bend	trans	-117	103.2	-177.7	-63.8	0	0	0	0	110	T309 P315	T309-C313 WeakPolarHBondContact O-CB 3.48Å; T309-C313 PolarHBondContact O-N 2.94Å; C313-P315 VanDerWaalsContact O-CD 3.27Å; C313-P315 WeakPolarHBondContact O-CD 3.42Å; C313-P315 VanDerWaalsContact O-N 3.12Å
314	S	64.8	Low	67.5	Low	38 Å²	38	69.4 Å²	69.4	27%	0.266	39%	0.385	S	S	.	.			trans	-59.3	115.2	175.1	178.1	0	0	0	0	110.2	C316 S317 V318	S314-C316 PolarHBondContact O-N 3.11Å; S314-S317 PolarHBondContact O-N 2.93Å; S314-S317 VanDerWaalsContact O-N 3.1Å; S314-S317 PolarHBondContact O-OG 3.31Å; S314-V318 PolarHBondContact O-N 2.96Å
315	P	58.4	Low	65.7	Low	44 Å²	44	77 Å²	77	29%	0.286	42%	0.418	S	S	.	.	H	α-helix	trans	-65.5	-29.3	-174	23.2	-31.7	0	0	0	112.1	F260 L310 C313 V318 V319	F260-P315 HydrophobicContact CE1-CG 4.06Å; L310-P315 HydrophobicContact CD2-CG 4.38Å; C313-P315 VanDerWaalsContact O-CD 3.27Å; C313-P315 WeakPolarHBondContact O-CD 3.42Å; C313-P315 VanDerWaalsContact O-N 3.12Å; P315-V318 PolarHBondContact O-N 2.87Å; P315-V319 WeakPolarHBondContact O-CG2 3.38Å; P315-V319 PolarHBondContact O-N 3.21Å
316	C	53.7	Low	63.7	Low	51 Å²	51	78 Å²	78	35%	0.345	42%	0.42	S	S	.	.	H	α-helix	trans	-67.9	-33.3	175.5	-102.5	0	0	0	0	112.8	C262 S314 V318 E320	C262-C316 HydrophobicContact CB-CB 3.97Å; C262-C316 WeakPolarHBondContact CB-SG 3.24Å; C262-C316 WeakPolarHBondContact SG-CB 3.35Å; C262-C316 CovalentContact SG-SG 2.04Å; C262-C316 PolarHBondContact SG-SG 2.96Å; S314-C316 PolarHBondContact O-N 3.11Å; C316-V318 VanDerWaalsContact C-N 3.31Å; C316-V318 PolarHBondContact O-N 3.41Å; C316-E320 WeakPolarHBondContact O-CB 3.47Å; C316-E320 PolarHBondContact O-N 3.44Å
317	S	53.9	Low	61.8	Low	60 Å²	60	78.8 Å²	78.8	42%	0.42	43%	0.426	S	S	.	.	H	α-helix	trans	-69.8	-30.6	176.2	70.2	0	0	0	0	112.4	S314 S321	S314-S317 PolarHBondContact O-N 2.93Å; S314-S317 VanDerWaalsContact O-N 3.1Å; S314-S317 PolarHBondContact O-OG 3.31Å; S317-S321 VanDerWaalsContact O-CB 3.22Å; S317-S321 WeakPolarHBondContact O-CB 3.31Å; S317-S321 PolarHBondContact O-N 2.93Å; S317-S321 PolarHBondContact O-OG 3.02Å
318	V	51.8	Low	60	Low	83 Å²	83	86.1 Å²	86.1	50%	0.503	46%	0.461	S	S	.	.	H	α-helix	trans	-74	-47.1	175.1	-179.1	0	0	0	0	111	S314 P315 C316 S321 F322	S314-V318 PolarHBondContact O-N 2.96Å; P315-V318 PolarHBondContact O-N 2.87Å; C316-V318 VanDerWaalsContact C-N 3.31Å; C316-V318 PolarHBondContact O-N 3.41Å; V318-S321 PolarHBondContact O-N 2.86Å; V318-F322 WeakPolarHBondContact O-CB 3.47Å; V318-F322 PolarHBondContact O-N 3.41Å
319	V	51.9	Low	58.4	Low	81 Å²	81	87.7 Å²	87.7	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-43.1	176.5	172.2	0	0	0	0	111.1	P315 F322 F323	P315-V319 WeakPolarHBondContact O-CG2 3.38Å; P315-V319 PolarHBondContact O-N 3.21Å; V319-F322 PolarHBondContact O-N 2.81Å; V319-F323 HydrophobicContact CG1-CD2 3.9Å; V319-F323 HydrophobicContact CG1-CE2 4.17Å; V319-F323 PolarHBondContact O-N 3.18Å
320	E	48.8	Very low	56.7	Low	107 Å²	107	90.7 Å²	90.7	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-65.1	-39.7	175.8	-162.7	-167	155.7	0	0	111.5	C316 F322 F323 R324	C316-E320 WeakPolarHBondContact O-CB 3.47Å; C316-E320 PolarHBondContact O-N 3.44Å; E320-F322 VanDerWaalsContact C-N 3.34Å; E320-F322 PolarHBondContact O-N 3.47Å; E320-F323 PolarHBondContact O-N 3.46Å; E320-R324 WeakPolarHBondContact O-CB 3.47Å; E320-R324 PolarHBondContact O-N 3.44Å; E320-R324 IonicContact OE1-CZ 3.29Å; E320-R324 IonicContact OE1-NH2 3.88Å; E320-R324 PolarHBondContact OE1-NH2 2.77Å
321	S	51.1	Low	55.2	Low	71 Å²	71	94.8 Å²	94.8	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-37.3	172.9	-63	0	0	0	0	112.5	S317 V318 R324 F325	S317-S321 VanDerWaalsContact O-CB 3.22Å; S317-S321 WeakPolarHBondContact O-CB 3.31Å; S317-S321 PolarHBondContact O-N 2.93Å; S317-S321 PolarHBondContact O-OG 3.02Å; V318-S321 PolarHBondContact O-N 2.86Å; S321-R324 PolarHBondContact O-N 3.15Å; S321-F325 VanDerWaalsContact O-CB 3.27Å; S321-F325 WeakPolarHBondContact O-CB 3.23Å; S321-F325 PolarHBondContact O-N 3.08Å
322	F	51.8	Low	53.5	Low	143 Å²	143	99.5 Å²	99.5	63%	0.627	54%	0.539	S	S	*	.	H	α-helix	trans	-68.5	-44	177.7	-144.8	-90.8	0	0	0	111.5	V318 V319 E320 F325 H326	V318-F322 WeakPolarHBondContact O-CB 3.47Å; V318-F322 PolarHBondContact O-N 3.41Å; V319-F322 PolarHBondContact O-N 2.81Å; E320-F322 VanDerWaalsContact C-N 3.34Å; E320-F322 PolarHBondContact O-N 3.47Å; F322-F325 PolarHBondContact O-N 3.4Å; F322-H326 PolarHBondContact O-N 3.32Å
323	F	51.7	Low	51.8	Low	154 Å²	154	103.5 Å²	103.5	68%	0.675	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-39.8	172.8	-94.4	-80.3	0	0	0	112.4	V319 E320 H326 A327	V319-F323 HydrophobicContact CG1-CD2 3.9Å; V319-F323 HydrophobicContact CG1-CE2 4.17Å; V319-F323 PolarHBondContact O-N 3.18Å; E320-F323 PolarHBondContact O-N 3.46Å; F323-H326 PolarHBondContact O-N 3.47Å; F323-A327 WeakPolarHBondContact O-CB 3.19Å; F323-A327 PolarHBondContact O-N 3.16Å
324	R	48.5	Very low	50.1	Low	148 Å²	148	103.6 Å²	103.6	56%	0.558	57%	0.568	S	S	*	*	H	α-helix	trans	-66.9	-38	177.4	-159.7	-175	-62.1	-178	0.2	111.3	E320 S321 A327 Q328	E320-R324 WeakPolarHBondContact O-CB 3.47Å; E320-R324 PolarHBondContact O-N 3.44Å; E320-R324 IonicContact OE1-CZ 3.29Å; E320-R324 IonicContact OE1-NH2 3.88Å; E320-R324 PolarHBondContact OE1-NH2 2.77Å; S321-R324 PolarHBondContact O-N 3.15Å; R324-A327 PolarHBondContact O-N 3.47Å; R324-Q328 WeakPolarHBondContact O-CB 3.48Å; R324-Q328 PolarHBondContact O-N 3.31Å
325	F	51.1	Low	48.7	Very low	162 Å²	162	107.1 Å²	107.1	71%	0.711	59%	0.593	S	S	*	*	H	α-helix	trans	-63.3	-44.3	172	-172.1	-97.8	0	0	0	111.9	S321 F322 Q328 S329	S321-F325 VanDerWaalsContact O-CB 3.27Å; S321-F325 WeakPolarHBondContact O-CB 3.23Å; S321-F325 PolarHBondContact O-N 3.08Å; F322-F325 PolarHBondContact O-N 3.4Å; F325-Q328 PolarHBondContact O-N 2.83Å; F325-S329 PolarHBondContact O-N 3.14Å
326	H	50.1	Low	47.8	Very low	116 Å²	116	111 Å²	111	54%	0.537	62%	0.615	S	S	.	*	H	α-helix	trans	-67.1	-34.3	175	-112.6	-53.5	0	0	0	113.4	F322 F323 S329	F322-H326 PolarHBondContact O-N 3.32Å; F323-H326 PolarHBondContact O-N 3.47Å; H326-S329 PolarHBondContact O-N 3.12Å; H326-S329 PolarHBondContact O-OG 2.85Å
327	A	48.9	Very low	46.9	Very low	58 Å²	58	115.6 Å²	115.6	48%	0.479	64%	0.635	S	S	.	*	H	α-helix	trans	-67.8	-40.4	173.7	0	0	0	0	0	111.7	F323 R324 S329 N330	F323-A327 WeakPolarHBondContact O-CB 3.19Å; F323-A327 PolarHBondContact O-N 3.16Å; R324-A327 PolarHBondContact O-N 3.47Å; A327-S329 PolarHBondContact O-N 2.9Å; A327-N330 PolarHBondContact O-N 3.26Å
328	Q	49.6	Very low	46.1	Very low	155 Å²	155	119.5 Å²	119.5	72%	0.724	65%	0.65	S	S	*	*	H	α-helix	trans	-61.2	-31.9	175.2	-157.8	85	33.5	0	0	112.1	R324 F325 N330	R324-Q328 WeakPolarHBondContact O-CB 3.48Å; R324-Q328 PolarHBondContact O-N 3.31Å; F325-Q328 PolarHBondContact O-N 2.83Å; Q328-N330 VanDerWaalsContact C-N 3.26Å; Q328-N330 PolarHBondContact O-N 3.3Å
329	S	50.4	Low	45.1	Very low	76 Å²	76	121.3 Å²	121.3	53%	0.531	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	-8.4	178.9	65	0	0	0	0	115.5	F325 H326 A327	F325-S329 PolarHBondContact O-N 3.14Å; H326-S329 PolarHBondContact O-N 3.12Å; H326-S329 PolarHBondContact O-OG 2.85Å; A327-S329 PolarHBondContact O-N 2.9Å
330	N	49	Very low	44	Very low	139 Å²	139	123.6 Å²	123.6	74%	0.743	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	7.2	-174.8	-95.7	-7.6	0	0	0	114.9	A327 Q328	A327-N330 PolarHBondContact O-N 3.26Å; Q328-N330 VanDerWaalsContact C-N 3.26Å; Q328-N330 PolarHBondContact O-N 3.3Å
331	I	48.3	Very low	43.2	Very low	138 Å²	138	124.8 Å²	124.8	71%	0.708	69%	0.686	S	S	*	*			trans	-129.3	82.3	173.7	-52	-179.2	0	0	0	110.2
332	T	43.8	Very low	42.1	Very low	124 Å²	124	126.3 Å²	126.3	76%	0.761	70%	0.697	S	S	*	*			trans	-85.5	139.3	152.3	38.4	0	0	0	0	109.5
333	N	39.5	Very low	41	Very low	156 Å²	156	125.4 Å²	125.4	83%	0.834	70%	0.703	S	S	*	*			trans	84.7	112.2	174.9	-44.9	-31.7	0	0	0	116.5
334	G	35.4	Very low	39.8	Very low	71 Å²	71	122.8 Å²	122.8	73%	0.732	70%	0.704	S	S	*	*			trans	154.4	85.5	162.2	0	0	0	0	0	117
335	S	34.5	Very low	38.8	Very low	112 Å²	112	120.7 Å²	120.7	78%	0.783	71%	0.712	S	S	*	*			trans	49	117.7	155	56.5	0	0	0	0	121.3
336	V	39.9	Very low	37.6	Very low	126 Å²	126	120.3 Å²	120.3	76%	0.764	72%	0.717	S	S	*	*			trans	-55.6	135.4	152.3	173.6	0	0	0	0	111.2	L338	V336-L338 HydrophobicContact CG1-CD1 4.14Å
337	I	34.8	Very low	36.9	Very low	148 Å²	148	124.3 Å²	124.3	76%	0.759	74%	0.736	S	S	*	*			trans	-133	125.4	153.5	-66.1	-174.9	0	0	0	108.4
338	L	37.1	Very low	36.1	Very low	141 Å²	141	129.6 Å²	129.6	74%	0.738	75%	0.751	S	S	*	*			trans	-84	142.8	164	-85.3	99.8	0	0	0	110.1	V336	V336-L338 HydrophobicContact CG1-CD1 4.14Å
339	S	31.5	Very low	35.6	Very low	121 Å²	121	127.1 Å²	127.1	85%	0.846	75%	0.748	S	S	*	*			trans	-148.4	140.5	148.2	31.8	0	0	0	0	109.9
340	D	28.7	Very low	34.9	Very low	129 Å²	129	130.2 Å²	130.2	69%	0.69	76%	0.759	S	S	*	*			trans	-113.6	151.1	-152.5	-130.1	-6.4	0	0	0	113.1
341	N	32.5	Very low	34.7	Very low	132 Å²	132	130.7 Å²	130.7	71%	0.706	76%	0.755	S	S	*	*			trans	74.4	145.5	142.6	-80.2	-45	0	0	0	125.8
342	S	27.9	Very low	35.2	Very low	103 Å²	103	127.6 Å²	127.6	72%	0.72	74%	0.739	S	S	*	*			trans	82.1	136	151.5	77.9	0	0	0	0	117.8
343	T	27.3	Very low	35.9	Very low	124 Å²	124	125 Å²	125	76%	0.761	73%	0.725	S	S	*	*			cis	-159.5	146.3	-3.4	-1.6	0	0	0	0	112.6
344	S	27	Very low	36.9	Very low	99 Å²	99	119 Å²	119	69%	0.692	69%	0.692	S	S	*	*			trans	22.1	145.8	149.4	58.1	0	0	0	0	125.1
345	S	27.9	Very low	38.4	Very low	104 Å²	104	122.5 Å²	122.5	73%	0.727	69%	0.687	S	S	*	*			trans	63.1	120.5	154.3	52.1	0	0	0	0	118
346	D	26	Very low	40.3	Very low	155 Å²	155	124.9 Å²	124.9	83%	0.829	68%	0.679	S	S	*	*				-145.4	154.2	53.8	-115.5	-28.8	0	0	0	114.8
347	Q	35.9	Very low	42	Very low	199 Å²	199	120.6 Å²	120.6	93%	0.93	65%	0.651	S	S	*	*			trans	-93.3	107.3	173.8	-81.5	-173.5	-16.2	0	0	111.5
348	Q	30.3	Very low	44.2	Very low	169 Å²	169	115.9 Å²	115.9	79%	0.79	63%	0.627	S	S	*	*			trans	-125.2	131.4	168.1	-155.9	159.6	-23.6	0	0	108.4	N350	Q348-N350 PolarHBondContact O-N 3.24Å
349	P	39.8	Very low	46.4	Very low	103 Å²	103	112.4 Å²	112.4	67%	0.669	61%	0.613	S	S	*	*			trans	-72.7	97.8	-176.3	28.5	-33.4	0	0	0	109.6	F351	P349-F351 VanDerWaalsContact O-CD2 3.32Å; P349-F351 WeakPolarHBondContact O-CD2 3.43Å; P349-F351 PolarHBondContact O-N 3.47Å
350	N	35.4	Very low	49	Very low	141 Å²	141	112.8 Å²	112.8	75%	0.754	60%	0.601	S	S	*	*			trans	-59.5	110.1	171.9	-88.5	-12.1	0	0	0	109.5	Q348 D352	Q348-N350 PolarHBondContact O-N 3.24Å; N350-D352 VanDerWaalsContact C-N 3.3Å; N350-D352 PolarHBondContact O-N 3.41Å
351	F	45.8	Very low	51.7	Low	149 Å²	149	107.1 Å²	107.1	65%	0.654	57%	0.573	S	S	*	*			trans	-72.5	81.9	173.5	-83.2	-99.3	0	0	0	109.6	P349 P353	P349-F351 VanDerWaalsContact O-CD2 3.32Å; P349-F351 WeakPolarHBondContact O-CD2 3.43Å; P349-F351 PolarHBondContact O-N 3.47Å; F351-P353 WeakPolarHBondContact O-CD 3.34Å; F351-P353 VanDerWaalsContact O-N 3.17Å
352	D	57.6	Low	54.3	Low	73 Å²	73	102.8 Å²	102.8	39%	0.39	55%	0.552	S	S	.	*			trans	-64.5	108.3	171.9	-68.6	-36.4	0	0	0	110.2	N350 H354 K355	N350-D352 VanDerWaalsContact C-N 3.3Å; N350-D352 PolarHBondContact O-N 3.41Å; D352-H354 VanDerWaalsContact C-N 3.25Å; D352-H354 PolarHBondContact O-N 2.98Å; D352-K355 HydrophobicContact CB-CB 4.34Å; D352-K355 HydrophobicContact CB-CD 3.91Å; D352-K355 HydrophobicContact CB-CG 3.96Å; D352-K355 PolarHBondContact O-N 3.48Å; D352-K355 VanDerWaalsContact O-N 3.14Å; D352-K355 VanDerWaalsContact OD2-CE 3.23Å; D352-K355 WeakPolarHBondContact OD2-CE 2.83Å; D352-K355 IonicContact OD2-NZ 3.19Å; D352-K355 PolarHBondContact OD2-NZ 3.05Å
353	P	58.8	Low	57.3	Low	70 Å²	70	102.1 Å²	102.1	46%	0.455	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-30	-173.4	-19.8	35.4	0	0	0	111.7	I268 F351 K355 R356 L357	I268-P353 HydrophobicContact CD1-CB 3.61Å; I268-P353 HydrophobicContact CD1-CG 3.72Å; F351-P353 WeakPolarHBondContact O-CD 3.34Å; F351-P353 VanDerWaalsContact O-N 3.17Å; P353-K355 PolarHBondContact O-N 3.27Å; P353-R356 PolarHBondContact O-N 3.49Å; P353-L357 PolarHBondContact O-N 3.08Å
354	H	61.9	Low	60.3	Low	29 Å²	29	98.5 Å²	98.5	13%	0.134	53%	0.526	C	S	.	.	H	α-helix	trans	-57.8	-32.1	175.2	-68.5	-87.2	0	0	0	113.1	I268 D352 R356 L357 I358	I268-H354 VanDerWaalsContact CG1-NE2 3.25Å; I268-H354 WeakPolarHBondContact CG1-NE2 3.38Å; D352-H354 VanDerWaalsContact C-N 3.25Å; D352-H354 PolarHBondContact O-N 2.98Å; H354-R356 VanDerWaalsContact C-N 3.29Å; H354-R356 PolarHBondContact O-N 3.3Å; H354-L357 PolarHBondContact O-N 3.2Å; H354-I358 WeakPolarHBondContact O-CG1 3.48Å; H354-I358 PolarHBondContact O-N 3.49Å
355	K	66.6	Low	63.3	Low	146 Å²	146	94 Å²	94	64%	0.635	49%	0.494	S	S	*	.	H	α-helix	trans	-70.9	-21.4	-179.8	-72	-179.5	-179.3	153.2	0	113.6	D352 P353 P359	D352-K355 HydrophobicContact CB-CB 4.34Å; D352-K355 HydrophobicContact CB-CD 3.91Å; D352-K355 HydrophobicContact CB-CG 3.96Å; D352-K355 PolarHBondContact O-N 3.48Å; D352-K355 VanDerWaalsContact O-N 3.14Å; D352-K355 VanDerWaalsContact OD2-CE 3.23Å; D352-K355 WeakPolarHBondContact OD2-CE 2.83Å; D352-K355 IonicContact OD2-NZ 3.19Å; D352-K355 PolarHBondContact OD2-NZ 3.05Å; P353-K355 PolarHBondContact O-N 3.27Å; K355-P359 WeakPolarHBondContact O-CD 3.25Å
356	R	73.3	Confident	66.4	Low	162 Å²	162	95.5 Å²	95.5	61%	0.611	49%	0.488	S	S	*	.	H	α-helix	trans	-91.9	-34.3	173.7	-68.5	-172.1	178.3	-170.4	-1.2	112.8	P353 H354 I358 P359	P353-R356 PolarHBondContact O-N 3.49Å; H354-R356 VanDerWaalsContact C-N 3.29Å; H354-R356 PolarHBondContact O-N 3.3Å; R356-I358 VanDerWaalsContact C-N 3.34Å; R356-I358 PolarHBondContact O-N 3.38Å; R356-P359 VanDerWaalsContact O-CD 3.25Å; R356-P359 WeakPolarHBondContact O-CD 3.41Å; R356-P359 VanDerWaalsContact O-CG 3.32Å; R356-P359 WeakPolarHBondContact O-CG 3.34Å
357	L	77	Confident	69.6	Low	36 Å²	36	93 Å²	93	19%	0.188	47%	0.474	C	S	.	.	H	α-helix	trans	-63	-37	-179.4	-175	64.5	0	0	0	113.1	I268 T271 M272 P353 H354 A361	I268-L357 HydrophobicContact CG2-CD2 4.41Å; T271-L357 HydrophobicContact CG2-CD2 4.23Å; M272-L357 HydrophobicContact CG-CD1 4.42Å; M272-L357 HydrophobicContact CG-CD2 4.28Å; P353-L357 PolarHBondContact O-N 3.08Å; H354-L357 PolarHBondContact O-N 3.2Å; L357-A361 VanDerWaalsContact O-CB 3.31Å; L357-A361 WeakPolarHBondContact O-CB 3.39Å; L357-A361 PolarHBondContact O-N 3Å
358	I	79.6	Confident	72.4	Confident	48 Å²	48	84.6 Å²	84.6	25%	0.246	44%	0.435	C	S	.	.	H	α-helix	trans	-59.1	-58.1	-178.4	-63.7	165.6	0	0	0	112.3	L311 H354 R356 E360 A361 C362	L311-I358 HydrophobicContact CD2-CG1 4.45Å; L311-I358 HydrophobicContact CG-CG1 4.18Å; H354-I358 WeakPolarHBondContact O-CG1 3.48Å; H354-I358 PolarHBondContact O-N 3.49Å; R356-I358 VanDerWaalsContact C-N 3.34Å; R356-I358 PolarHBondContact O-N 3.38Å; I358-E360 VanDerWaalsContact C-N 3.32Å; I358-E360 PolarHBondContact O-N 2.8Å; I358-A361 WeakPolarHBondContact O-CB 3.43Å; I358-A361 PolarHBondContact O-N 3.34Å; I358-C362 PolarHBondContact O-N 3.41Å; I358-C362 PolarHBondContact O-SG 3.48Å
359	P	84	Confident	75.4	Confident	69 Å²	69	78 Å²	78	45%	0.448	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-33.5	-179.4	23.6	-34.3	0	0	0	113.6	K355 R356 C362 V363	K355-P359 WeakPolarHBondContact O-CD 3.25Å; R356-P359 VanDerWaalsContact O-CD 3.25Å; R356-P359 WeakPolarHBondContact O-CD 3.41Å; R356-P359 VanDerWaalsContact O-CG 3.32Å; R356-P359 WeakPolarHBondContact O-CG 3.34Å; P359-C362 WeakPolarHBondContact O-CB 3.5Å; P359-C362 PolarHBondContact O-N 3Å; P359-V363 WeakPolarHBondContact O-CG2 3.43Å; P359-V363 PolarHBondContact O-N 3.08Å; P359-V363 VanDerWaalsContact O-N 3.13Å
360	E	86.6	Confident	78	Confident	128 Å²	128	78 Å²	78	60%	0.598	40%	0.399	S	S	*	.	H	α-helix	trans	-63.7	-44.4	173.6	-69.6	174.2	-171.3	0	0	111.1	I358 V363 A364	I358-E360 VanDerWaalsContact C-N 3.32Å; I358-E360 PolarHBondContact O-N 2.8Å; E360-V363 PolarHBondContact O-N 2.92Å; E360-A364 WeakPolarHBondContact O-CB 3.35Å; E360-A364 PolarHBondContact O-N 3.45Å
361	A	84.6	Confident	80.8	Confident	11 Å²	11	75.5 Å²	75.5	9%	0.091	39%	0.385	C	S	.	.	H	α-helix	trans	-63.1	-42.6	173.3	0	0	0	0	0	112.2	L311 L357 I358 V363 A364 F365	L311-A361 HydrophobicContact CD2-CB 3.72Å; L357-A361 VanDerWaalsContact O-CB 3.31Å; L357-A361 WeakPolarHBondContact O-CB 3.39Å; L357-A361 PolarHBondContact O-N 3Å; I358-A361 WeakPolarHBondContact O-CB 3.43Å; I358-A361 PolarHBondContact O-N 3.34Å; A361-V363 VanDerWaalsContact C-N 3.31Å; A361-V363 PolarHBondContact O-N 3.5Å; A361-A364 PolarHBondContact O-N 2.87Å; A361-F365 HydrophobicContact CB-CD2 4.33Å; A361-F365 HydrophobicContact CB-CE2 4.39Å; A361-F365 WeakPolarHBondContact O-CD2 3.22Å; A361-F365 PolarHBondContact O-N 3.14Å
362	C	87.2	Confident	83.1	Confident	41 Å²	41	68.6 Å²	68.6	28%	0.277	36%	0.355	S	S	.	.	H	α-helix	trans	-52.9	-48.4	175.1	-64.4	0	0	0	0	111.7	L308 I358 P359 F366	L308-C362 HydrophobicContact CD1-CB 4.32Å; I358-C362 PolarHBondContact O-N 3.41Å; I358-C362 PolarHBondContact O-SG 3.48Å; P359-C362 WeakPolarHBondContact O-CB 3.5Å; P359-C362 PolarHBondContact O-N 3Å; C362-F366 VanDerWaalsContact O-CB 3.31Å; C362-F366 WeakPolarHBondContact O-CB 3.38Å; C362-F366 PolarHBondContact O-N 2.94Å
363	V	90.8	Very high	84.9	Confident	88 Å²	88	68.7 Å²	68.7	53%	0.533	35%	0.35	S	S	.	.	H	α-helix	trans	-68.4	-43	-179.9	175	0	0	0	0	111.1	P359 E360 A361 F366 L367	P359-V363 WeakPolarHBondContact O-CG2 3.43Å; P359-V363 PolarHBondContact O-N 3.08Å; P359-V363 VanDerWaalsContact O-N 3.13Å; E360-V363 PolarHBondContact O-N 2.92Å; A361-V363 VanDerWaalsContact C-N 3.31Å; A361-V363 PolarHBondContact O-N 3.5Å; V363-F366 PolarHBondContact O-N 2.87Å; V363-L367 HydrophobicContact CG1-CD1 4.04Å; V363-L367 HydrophobicContact CG1-CG 4.45Å; V363-L367 WeakPolarHBondContact O-CG 3.18Å; V363-L367 PolarHBondContact O-N 3.36Å
364	A	89.8	Confident	86.6	Confident	48 Å²	48	71 Å²	71	40%	0.397	35%	0.353	S	S	.	.	H	α-helix	trans	-61.2	-46.4	177.9	0	0	0	0	0	112.4	E360 A361 L367 L368	E360-A364 WeakPolarHBondContact O-CB 3.35Å; E360-A364 PolarHBondContact O-N 3.45Å; A361-A364 PolarHBondContact O-N 2.87Å; A364-L367 PolarHBondContact O-N 3.22Å; A364-L368 WeakPolarHBondContact O-CB 3.26Å; A364-L368 PolarHBondContact O-N 2.95Å
365	F	90.7	Very high	88	Confident	6 Å²	6	71.9 Å²	71.9	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-67.9	-36	176.5	-77.7	-67.6	0	0	0	112.5	C275 I278 I279 I282 L307 A361 L368 L369	C275-F365 HydrophobicContact CB-CE2 4.44Å; C275-F365 HydrophobicContact CB-CZ 4.31Å; I278-F365 HydrophobicContact CG2-CE1 4.45Å; I279-F365 HydrophobicContact CD1-CE1 4.3Å; I279-F365 HydrophobicContact CD1-CZ 4.1Å; I279-F365 HydrophobicContact CG1-CD1 4.37Å; I279-F365 HydrophobicContact CG1-CE1 3.48Å; I279-F365 VanDerWaalsContact CG1-CE1 3.48Å; I279-F365 HydrophobicContact CG1-CZ 3.68Å; I282-F365 HydrophobicContact CD1-CD1 4.03Å; I282-F365 HydrophobicContact CD1-CE1 3.95Å; L307-F365 HydrophobicContact CD2-CE1 3.91Å; L307-F365 HydrophobicContact CD2-CE2 3.68Å; L307-F365 HydrophobicContact CD2-CZ 3.27Å; L307-F365 HydrophobicContact CG-CZ 4.5Å; A361-F365 HydrophobicContact CB-CD2 4.33Å; A361-F365 HydrophobicContact CB-CE2 4.39Å; A361-F365 WeakPolarHBondContact O-CD2 3.22Å; A361-F365 PolarHBondContact O-N 3.14Å; F365-L368 HydrophobicContact CD1-CD2 4.26Å; F365-L368 HydrophobicContact CE1-CD2 4.46Å; F365-L368 PolarHBondContact O-N 3.37Å; F365-L369 WeakPolarHBondContact O-CB 3.21Å; F365-L369 VanDerWaalsContact O-CG 3.24Å; F365-L369 WeakPolarHBondContact O-CG 3.49Å; F365-L369 PolarHBondContact O-N 3.5Å
366	F	92.1	Very high	89.3	Confident	135 Å²	135	65 Å²	65	59%	0.592	33%	0.329	S	S	*	.	H	α-helix	trans	-60.9	-48.6	173.6	175.2	-98.3	0	0	0	112	C362 V363 L369 L370	C362-F366 VanDerWaalsContact O-CB 3.31Å; C362-F366 WeakPolarHBondContact O-CB 3.38Å; C362-F366 PolarHBondContact O-N 2.94Å; V363-F366 PolarHBondContact O-N 2.87Å; F366-L369 PolarHBondContact O-N 2.75Å; F366-L370 HydrophobicContact CE1-CD1 4.38Å; F366-L370 HydrophobicContact CZ-CD1 4.41Å; F366-L370 WeakPolarHBondContact O-CB 3.42Å; F366-L370 PolarHBondContact O-N 3.18Å
367	L	94	Very high	90.1	Very high	102 Å²	102	62.1 Å²	62.1	53%	0.534	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-39.8	177.9	-68.4	174.8	0	0	0	112.1	V363 A364 L370 L371	V363-L367 HydrophobicContact CG1-CD1 4.04Å; V363-L367 HydrophobicContact CG1-CG 4.45Å; V363-L367 WeakPolarHBondContact O-CG 3.18Å; V363-L367 PolarHBondContact O-N 3.36Å; A364-L367 PolarHBondContact O-N 3.22Å; L367-L370 PolarHBondContact O-N 3.32Å; L367-L371 WeakPolarHBondContact O-CB 3.36Å; L367-L371 PolarHBondContact O-N 3.39Å
368	L	94.1	Very high	90.7	Very high	23 Å²	23	65.1 Å²	65.1	12%	0.12	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-46.4	175.4	178.8	64.1	0	0	0	112	I279 I282 V283 A364 F365 L370 L371 V372	I279-L368 HydrophobicContact CB-CD2 4.16Å; I279-L368 HydrophobicContact CG1-CD2 3.94Å; I279-L368 HydrophobicContact CG2-CD2 3.9Å; I282-L368 HydrophobicContact CB-CD2 4.06Å; I282-L368 HydrophobicContact CD1-CD2 4.35Å; I282-L368 HydrophobicContact CG2-CD2 3.7Å; I282-L368 HydrophobicContact CG2-CG 3.9Å; V283-L368 HydrophobicContact CG2-CD1 3.94Å; A364-L368 WeakPolarHBondContact O-CB 3.26Å; A364-L368 PolarHBondContact O-N 2.95Å; F365-L368 HydrophobicContact CD1-CD2 4.26Å; F365-L368 HydrophobicContact CE1-CD2 4.46Å; F365-L368 PolarHBondContact O-N 3.37Å; L368-L370 VanDerWaalsContact C-N 3.34Å; L368-L370 PolarHBondContact O-N 3.25Å; L368-L371 PolarHBondContact O-N 3.37Å; L368-V372 HydrophobicContact CD1-CG2 4.35Å; L368-V372 WeakPolarHBondContact O-CG2 3.47Å; L368-V372 PolarHBondContact O-N 3.02Å
369	L	93.6	Very high	91.3	Very high	30 Å²	30	66.6 Å²	66.6	16%	0.157	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-38.3	178.9	-71.2	172.6	0	0	0	111.7	I282 T301 F365 F366 V372 W373	I282-L369 HydrophobicContact CG2-CD2 4.33Å; T301-L369 HydrophobicContact CG2-CB 4.4Å; T301-L369 HydrophobicContact CG2-CD1 4.22Å; T301-L369 HydrophobicContact CG2-CD2 3.94Å; T301-L369 HydrophobicContact CG2-CG 4.41Å; F365-L369 WeakPolarHBondContact O-CB 3.21Å; F365-L369 VanDerWaalsContact O-CG 3.24Å; F365-L369 WeakPolarHBondContact O-CG 3.49Å; F365-L369 PolarHBondContact O-N 3.5Å; F366-L369 PolarHBondContact O-N 2.75Å; L369-V372 PolarHBondContact O-N 3.33Å; L369-W373 WeakPolarHBondContact O-CB 3.35Å; L369-W373 VanDerWaalsContact O-CD1 3.31Å; L369-W373 PolarHBondContact O-N 2.93Å
370	L	94.5	Very high	91.5	Very high	104 Å²	104	63.4 Å²	63.4	55%	0.545	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-43.9	173.3	-173.7	152.9	0	0	0	111.5	F366 L367 L368 W373 F374	F366-L370 HydrophobicContact CE1-CD1 4.38Å; F366-L370 HydrophobicContact CZ-CD1 4.41Å; F366-L370 WeakPolarHBondContact O-CB 3.42Å; F366-L370 PolarHBondContact O-N 3.18Å; L367-L370 PolarHBondContact O-N 3.32Å; L368-L370 VanDerWaalsContact C-N 3.34Å; L368-L370 PolarHBondContact O-N 3.25Å; L370-W373 PolarHBondContact O-N 2.98Å; L370-F374 PolarHBondContact O-N 2.91Å; L370-F374 VanDerWaalsContact O-N 3.07Å
371	L	94.7	Very high	91.6	Very high	88 Å²	88	59.1 Å²	59.1	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-62.7	-45.8	175.8	178.7	63.2	0	0	0	112	L367 L368 W373 F374 L375	L367-L371 WeakPolarHBondContact O-CB 3.36Å; L367-L371 PolarHBondContact O-N 3.39Å; L368-L371 PolarHBondContact O-N 3.37Å; L371-W373 PolarHBondContact O-N 2.95Å; L371-F374 PolarHBondContact O-N 2.87Å; L371-L375 HydrophobicContact CD1-CD1 3.95Å; L371-L375 HydrophobicContact CD1-CG 4.02Å; L371-L375 HydrophobicContact CD2-CD1 4.47Å; L371-L375 HydrophobicContact CG-CD1 3.85Å; L371-L375 HydrophobicContact CG-CG 4.32Å; L371-L375 WeakPolarHBondContact O-CG 3.43Å; L371-L375 PolarHBondContact O-N 3.29Å
372	V	94.7	Very high	91.8	Very high	3 Å²	3	62 Å²	62	2%	0.018	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-41.1	178	169.3	0	0	0	0	111.5	I282 A300 L368 L369 F374 N376	I282-V372 HydrophobicContact CG2-CG2 4.05Å; A300-V372 HydrophobicContact CB-CG1 4.19Å; L368-V372 HydrophobicContact CD1-CG2 4.35Å; L368-V372 WeakPolarHBondContact O-CG2 3.47Å; L368-V372 PolarHBondContact O-N 3.02Å; L369-V372 PolarHBondContact O-N 3.33Å; V372-F374 VanDerWaalsContact C-N 3.33Å; V372-F374 PolarHBondContact O-N 3.33Å; V372-N376 WeakPolarHBondContact CG1-ND2 3.34Å; V372-N376 VanDerWaalsContact O-CB 3.25Å; V372-N376 WeakPolarHBondContact O-CB 3.42Å; V372-N376 VanDerWaalsContact O-CG 3.25Å; V372-N376 PolarHBondContact O-N 3.27Å; V372-N376 PolarHBondContact O-ND2 3.43Å
373	W	94.4	Very high	91.7	Very high	75 Å²	75	62.2 Å²	62.2	28%	0.284	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-40	173.5	-95.4	82.3	0	0	0	112.6	Y293 W294 S297 T298 T301 L369 L370 L371 R377	Y293-W373 HydrophobicContact CE2-CE3 4.18Å; Y293-W373 AromaticContact CE2-CZ3 4Å; Y293-W373 HydrophobicContact CE2-CZ3 4Å; W294-W373 HydrophobicContact CD2-CH2 4.49Å; W294-W373 AromaticContact CE3-CH2 3.81Å; W294-W373 HydrophobicContact CE3-CH2 3.81Å; W294-W373 HydrophobicContact CE3-CZ3 4.38Å; W294-W373 HydrophobicContact CH2-CH2 4.28Å; W294-W373 HydrophobicContact CH2-CZ3 4.49Å; W294-W373 AromaticContact CZ3-CH2 3.7Å; W294-W373 HydrophobicContact CZ3-CH2 3.7Å; W294-W373 HydrophobicContact CZ3-CZ3 4.3Å; S297-W373 VanDerWaalsContact CB-CE2 3.49Å; S297-W373 PolarHBondContact O-NE1 3.23Å; T298-W373 HydrophobicContact CG2-CZ2 4.17Å; T301-W373 VanDerWaalsContact CG2-NE1 3.32Å; L369-W373 WeakPolarHBondContact O-CB 3.35Å; L369-W373 VanDerWaalsContact O-CD1 3.31Å; L369-W373 PolarHBondContact O-N 2.93Å; L370-W373 PolarHBondContact O-N 2.98Å; L371-W373 PolarHBondContact O-N 2.95Å; W373-R377 VanDerWaalsContact O-CB 3.32Å; W373-R377 WeakPolarHBondContact O-CB 3.38Å; W373-R377 PolarHBondContact O-N 3.47Å
374	F	93.6	Very high	91.6	Very high	119 Å²	119	58.2 Å²	58.2	52%	0.522	29%	0.288	S	S	.	.	H	α-helix	trans	-67.8	-52.8	177	-177.5	-91.3	0	0	0	111.7	L370 L371 V372 N376 R377 E378	L370-F374 PolarHBondContact O-N 2.91Å; L370-F374 VanDerWaalsContact O-N 3.07Å; L371-F374 PolarHBondContact O-N 2.87Å; V372-F374 VanDerWaalsContact C-N 3.33Å; V372-F374 PolarHBondContact O-N 3.33Å; F374-N376 PolarHBondContact O-N 2.99Å; F374-R377 WeakPolarHBondContact O-CB 3.31Å; F374-R377 PolarHBondContact O-N 3.05Å; F374-E378 VanDerWaalsContact CE1-OE2 3.29Å; F374-E378 WeakPolarHBondContact CE1-OE2 3.24Å; F374-E378 PolarHBondContact O-N 3.02Å
375	L	92.9	Very high	91.4	Very high	48 Å²	48	58.3 Å²	58.3	25%	0.251	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-46.8	-178.7	-70.4	174	0	0	0	112.2	L371 R377 E378 F379	L371-L375 HydrophobicContact CD1-CD1 3.95Å; L371-L375 HydrophobicContact CD1-CG 4.02Å; L371-L375 HydrophobicContact CD2-CD1 4.47Å; L371-L375 HydrophobicContact CG-CD1 3.85Å; L371-L375 HydrophobicContact CG-CG 4.32Å; L371-L375 WeakPolarHBondContact O-CG 3.43Å; L371-L375 PolarHBondContact O-N 3.29Å; L375-R377 VanDerWaalsContact C-N 3.26Å; L375-R377 PolarHBondContact O-N 2.91Å; L375-E378 PolarHBondContact O-N 3.18Å; L375-F379 HydrophobicContact CB-CD2 4.35Å; L375-F379 HydrophobicContact CB-CE2 3.99Å; L375-F379 HydrophobicContact CD2-CZ 4.46Å; L375-F379 WeakPolarHBondContact O-CD2 3.32Å; L375-F379 WeakPolarHBondContact O-CG 3.36Å; L375-F379 PolarHBondContact O-N 2.76Å
376	N	92.6	Very high	91.1	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.3	-38.7	178	-76.5	-24	0	0	0	112.2	C286 Y293 R296 S297 V372 F374 E380	C286-N376 VanDerWaalsContact CA-OD1 3.32Å; C286-N376 WeakPolarHBondContact CA-OD1 3.21Å; Y293-N376 WeakPolarHBondContact CB-O 3.25Å; R296-N376 PolarHBondContact NH1-OD1 3Å; R296-N376 VanDerWaalsContact NH1-OD1 3.13Å; S297-N376 WeakPolarHBondContact OG-CB 3.32Å; S297-N376 PolarHBondContact OG-ND2 3.03Å; V372-N376 WeakPolarHBondContact CG1-ND2 3.34Å; V372-N376 VanDerWaalsContact O-CB 3.25Å; V372-N376 WeakPolarHBondContact O-CB 3.42Å; V372-N376 VanDerWaalsContact O-CG 3.25Å; V372-N376 PolarHBondContact O-N 3.27Å; V372-N376 PolarHBondContact O-ND2 3.43Å; F374-N376 PolarHBondContact O-N 2.99Å; N376-E380 PolarHBondContact O-N 2.81Å; N376-E380 VanDerWaalsContact O-N 3.16Å
377	R	90.9	Very high	90.8	Very high	102 Å²	102	57.3 Å²	57.3	39%	0.385	28%	0.277	S	S	.	.	H	α-helix	trans	-68.6	-43.5	177	-177.3	-177.4	174.6	-82.9	-5.2	111.4	L128 Y293 W373 F374 L375 V381	L128-R377 HydrophobicContact CD1-CG 4.24Å; Y293-R377 HydrophobicContact CD2-CB 3.88Å; Y293-R377 HydrophobicContact CD2-CG 4.41Å; Y293-R377 HydrophobicContact CE2-CB 4.07Å; Y293-R377 HydrophobicContact CE2-CG 4.21Å; Y293-R377 HydrophobicContact CG-CB 4.33Å; W373-R377 VanDerWaalsContact O-CB 3.32Å; W373-R377 WeakPolarHBondContact O-CB 3.38Å; W373-R377 PolarHBondContact O-N 3.47Å; F374-R377 WeakPolarHBondContact O-CB 3.31Å; F374-R377 PolarHBondContact O-N 3.05Å; L375-R377 VanDerWaalsContact C-N 3.26Å; L375-R377 PolarHBondContact O-N 2.91Å; R377-V381 WeakPolarHBondContact O-CG2 3.48Å; R377-V381 PolarHBondContact O-N 3.28Å; R377-V381 VanDerWaalsContact O-N 3.12Å
378	E	90.5	Very high	90.4	Very high	100 Å²	100	53.3 Å²	53.3	47%	0.467	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-45.7	177.5	-172.9	176.4	-170	0	0	111.6	F374 L375 E380 V381 S382	F374-E378 VanDerWaalsContact CE1-OE2 3.29Å; F374-E378 WeakPolarHBondContact CE1-OE2 3.24Å; F374-E378 PolarHBondContact O-N 3.02Å; L375-E378 PolarHBondContact O-N 3.18Å; E378-E380 PolarHBondContact O-N 2.95Å; E378-V381 PolarHBondContact O-N 3.18Å; E378-S382 WeakPolarHBondContact O-CB 3.47Å; E378-S382 PolarHBondContact O-N 3.06Å
379	F	90.8	Very high	90	Very high	78 Å²	78	53.2 Å²	53.2	34%	0.342	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-40.8	177.8	-66.3	-43.1	0	0	0	113	C286 C289 L375 S382 Y383	C286-F379 HydrophobicContact CB-CE2 4.36Å; C289-F379 HydrophobicContact CB-CB 4.46Å; L375-F379 HydrophobicContact CB-CD2 4.35Å; L375-F379 HydrophobicContact CB-CE2 3.99Å; L375-F379 HydrophobicContact CD2-CZ 4.46Å; L375-F379 WeakPolarHBondContact O-CD2 3.32Å; L375-F379 WeakPolarHBondContact O-CG 3.36Å; L375-F379 PolarHBondContact O-N 2.76Å; F379-S382 PolarHBondContact O-N 2.81Å; F379-Y383 WeakPolarHBondContact O-CB 3.41Å; F379-Y383 PolarHBondContact O-N 2.74Å
380	E	89.4	Confident	89.5	Confident	3 Å²	3	55.3 Å²	55.3	1%	0.014	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-38.7	174.8	-178.2	171.1	172	0	0	112.1	L128 S292 Y293 N376 E378 Y383 R384	L128-E380 HydrophobicContact CD1-CB 3.98Å; L128-E380 HydrophobicContact CD1-CG 3.96Å; S292-E380 VanDerWaalsContact CA-OE2 3.29Å; S292-E380 WeakPolarHBondContact CA-OE2 3.34Å; Y293-E380 WeakPolarHBondContact CD1-OE2 3.29Å; Y293-E380 PolarHBondContact N-OE2 3.33Å; N376-E380 PolarHBondContact O-N 2.81Å; N376-E380 VanDerWaalsContact O-N 3.16Å; E378-E380 PolarHBondContact O-N 2.95Å; E380-Y383 PolarHBondContact O-N 2.76Å; E380-R384 HydrophobicContact CG-CG 4.32Å; E380-R384 WeakPolarHBondContact O-CB 3.4Å; E380-R384 WeakPolarHBondContact O-CG 3.18Å; E380-R384 PolarHBondContact O-N 2.79Å; E380-R384 IonicContact OE1-CZ 2.73Å; E380-R384 IonicContact OE1-NE 2.65Å; E380-R384 PolarHBondContact OE1-NE 2.95Å; E380-R384 IonicContact OE1-NH2 3.94Å; E380-R384 PolarHBondContact OE1-NH2 2.89Å
381	V	88	Confident	89	Confident	37 Å²	37	52.1 Å²	52.1	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-46.7	174.1	170.4	0	0	0	0	110.8	L123 L128 R377 E378 R384 L385	L123-V381 HydrophobicContact CD1-CG1 4.34Å; L128-V381 HydrophobicContact CD1-CG2 3.81Å; L128-V381 HydrophobicContact CD2-CG2 3.67Å; L128-V381 HydrophobicContact CG-CG2 4.38Å; R377-V381 WeakPolarHBondContact O-CG2 3.48Å; R377-V381 PolarHBondContact O-N 3.28Å; R377-V381 VanDerWaalsContact O-N 3.12Å; E378-V381 PolarHBondContact O-N 3.18Å; V381-R384 PolarHBondContact O-N 2.79Å; V381-L385 WeakPolarHBondContact O-CB 3.46Å; V381-L385 PolarHBondContact O-N 3.41Å
382	S	87.6	Confident	88.5	Confident	72 Å²	72	49.8 Å²	49.8	50%	0.503	24%	0.243	S	C	.	.	H	α-helix	trans	-60.3	-47.3	178.4	-173.9	0	0	0	0	111.8	E378 F379 R384 L385 H386	E378-S382 WeakPolarHBondContact O-CB 3.47Å; E378-S382 PolarHBondContact O-N 3.06Å; F379-S382 PolarHBondContact O-N 2.81Å; S382-R384 PolarHBondContact O-N 2.89Å; S382-L385 PolarHBondContact O-N 2.89Å; S382-H386 PolarHBondContact O-N 3.13Å
383	Y	86.4	Confident	87.8	Confident	45 Å²	45	52.3 Å²	52.3	18%	0.176	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-40.5	179.5	-172.4	-98.1	0	0	0	112.8	Y139 P159 H290 F379 E380 H386 Y387	Y139-Y383 HydrophobicContact CE2-CD1 4.04Å; Y139-Y383 AromaticContact CE2-CE1 3.78Å; Y139-Y383 HydrophobicContact CE2-CE1 3.78Å; Y139-Y383 WeakPolarHBondContact OH-CD1 3.36Å; P159-Y383 WeakPolarHBondContact CB-OH 3.4Å; P159-Y383 WeakPolarHBondContact CG-OH 3.4Å; H290-Y383 AromaticContact CD2-CD2 3.7Å; H290-Y383 AromaticContact CD2-CE2 3.24Å; H290-Y383 WeakPolarHBondContact CD2-CE2 3.07Å; H290-Y383 AromaticContact CD2-CZ 3.46Å; H290-Y383 VanDerWaalsContact CD2-CZ 3.46Å; H290-Y383 AromaticContact CG-CZ 3.92Å; H290-Y383 AromaticContact NE2-CD2 3.9Å; H290-Y383 AromaticContact NE2-CE2 3.18Å; H290-Y383 WeakPolarHBondContact NE2-CE2 3.48Å; H290-Y383 AromaticContact NE2-CZ 3.66Å; F379-Y383 WeakPolarHBondContact O-CB 3.41Å; F379-Y383 PolarHBondContact O-N 2.74Å; E380-Y383 PolarHBondContact O-N 2.76Å; Y383-H386 PolarHBondContact O-N 3.35Å; Y383-Y387 PolarHBondContact O-N 3.37Å
384	R	87.8	Confident	87.3	Confident	5 Å²	5	52.9 Å²	52.9	2%	0.019	27%	0.272	C	S	.	.	H	α-helix	trans	-67.3	-38.3	175.2	-74.7	175.9	171.5	-91.2	10.2	112.5	L123 L128 F130 E136 Y139 E380 V381 S382 Y387 H388	L123-R384 HydrophobicContact CD1-CB 4.43Å; L123-R384 HydrophobicContact CD2-CB 4.32Å; L128-R384 WeakPolarHBondContact O-CD 3.34Å; L128-R384 PolarHBondContact O-NE 3.44Å; L128-R384 PolarHBondContact O-NH1 2.79Å; F130-R384 HydrophobicContact CE1-CB 4.33Å; F130-R384 HydrophobicContact CE2-CB 4.47Å; F130-R384 HydrophobicContact CE2-CG 4.4Å; F130-R384 HydrophobicContact CZ-CB 3.82Å; F130-R384 HydrophobicContact CZ-CG 4.23Å; F130-R384 WeakPolarHBondContact CZ-O 3.39Å; E136-R384 IonicContact OE1-NH1 3.78Å; E136-R384 IonicContact OE1-NH2 2.71Å; E136-R384 IonicContact OE2-CZ 3.99Å; E136-R384 IonicContact OE2-NH1 2.64Å; E136-R384 PolarHBondContact OE2-NH1 3.47Å; E136-R384 IonicContact OE2-NH2 3.69Å; Y139-R384 HydrophobicContact CE1-CG 4.29Å; Y139-R384 VanDerWaalsContact CE1-CZ 3.49Å; Y139-R384 HydrophobicContact CE2-CG 4.34Å; E380-R384 HydrophobicContact CG-CG 4.32Å; E380-R384 WeakPolarHBondContact O-CB 3.4Å; E380-R384 WeakPolarHBondContact O-CG 3.18Å; E380-R384 PolarHBondContact O-N 2.79Å; E380-R384 IonicContact OE1-CZ 2.73Å; E380-R384 IonicContact OE1-NE 2.65Å; E380-R384 PolarHBondContact OE1-NE 2.95Å; E380-R384 IonicContact OE1-NH2 3.94Å; E380-R384 PolarHBondContact OE1-NH2 2.89Å; V381-R384 PolarHBondContact O-N 2.79Å; S382-R384 PolarHBondContact O-N 2.89Å; R384-Y387 PolarHBondContact O-N 2.69Å; R384-H388 WeakPolarHBondContact O-CB 3.38Å; R384-H388 PolarHBondContact O-N 3.29Å
385	L	85.9	Confident	86.7	Confident	49 Å²	49	53 Å²	53	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-65.5	-39.3	173.6	177	58.6	0	0	0	111.5	P121 V381 S382 H388 G389	P121-L385 HydrophobicContact CB-CD1 4.3Å; V381-L385 WeakPolarHBondContact O-CB 3.46Å; V381-L385 PolarHBondContact O-N 3.41Å; S382-L385 PolarHBondContact O-N 2.89Å; L385-H388 PolarHBondContact O-N 3.43Å; L385-G389 PolarHBondContact O-N 2.93Å
386	H	85.1	Confident	86.1	Confident	88 Å²	88	53.1 Å²	53.1	41%	0.407	27%	0.274	S	S	.	.	H	α-helix	trans	-61.3	-46.4	173.8	-178.2	63.3	0	0	0	112	S382 Y383 H388 G389 N390	S382-H386 PolarHBondContact O-N 3.13Å; Y383-H386 PolarHBondContact O-N 3.35Å; H386-H388 PolarHBondContact O-N 3.12Å; H386-G389 PolarHBondContact O-N 3.02Å; H386-N390 PolarHBondContact CE1-ND2 3.42Å; H386-N390 PolarHBondContact CE1-OD1 3.4Å; H386-N390 PolarHBondContact NE2-ND2 2.88Å; H386-N390 VanDerWaalsContact O-CG 3.3Å; H386-N390 PolarHBondContact O-N 2.78Å; H386-N390 PolarHBondContact O-OD1 3.3Å
387	Y	86	Confident	85.5	Confident	32 Å²	32	59.8 Å²	59.8	13%	0.125	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-46.5	175	178.6	-100.2	0	0	0	112.4	F130 L135 A138 Y139 S142 Y383 R384 G389 N390 V391	F130-Y387 HydrophobicContact CE2-CD1 4.24Å; F130-Y387 HydrophobicContact CZ-CD1 4.17Å; L135-Y387 HydrophobicContact CD1-CE1 4.02Å; A138-Y387 VanDerWaalsContact C-OH 3.28Å; Y139-Y387 AromaticContact CD2-CD1 3.57Å; Y139-Y387 HydrophobicContact CD2-CD1 3.57Å; Y139-Y387 HydrophobicContact CD2-CD2 4.09Å; Y139-Y387 AromaticContact CD2-CE1 3.98Å; Y139-Y387 HydrophobicContact CD2-CE1 3.98Å; Y139-Y387 HydrophobicContact CD2-CE2 4.48Å; Y139-Y387 AromaticContact CD2-CG 3.62Å; Y139-Y387 HydrophobicContact CD2-CG 3.62Å; Y139-Y387 HydrophobicContact CE2-CG 4.26Å; Y139-Y387 HydrophobicContact CG-CD1 4.19Å; Y139-Y387 HydrophobicContact CG-CE1 4.29Å; Y139-Y387 PolarHBondContact N-OH 3.38Å; S142-Y387 WeakPolarHBondContact OG-CE2 3.35Å; Y383-Y387 PolarHBondContact O-N 3.37Å; R384-Y387 PolarHBondContact O-N 2.69Å; Y387-G389 PolarHBondContact O-N 3.31Å; Y387-N390 PolarHBondContact O-N 2.8Å; Y387-V391 HydrophobicContact CD1-CG2 4.26Å; Y387-V391 HydrophobicContact CD2-CG2 4.41Å; Y387-V391 HydrophobicContact CE1-CG2 3.78Å; Y387-V391 HydrophobicContact CE2-CG2 3.92Å; Y387-V391 WeakPolarHBondContact O-CG2 3.3Å; Y387-V391 PolarHBondContact O-N 3.48Å
388	H	85.8	Confident	85.1	Confident	19 Å²	19	59.1 Å²	59.1	9%	0.088	30%	0.302	C	S	.	.	H	α-helix	trans	-57.4	-50	177	-170.6	-74.3	0	0	0	111.9	P122 F130 R384 L385 H386 N390 V391 E392	P122-H388 WeakPolarHBondContact CD-NE2 3.34Å; P122-H388 WeakPolarHBondContact CG-NE2 3.41Å; F130-H388 HydrophobicContact CE1-CB 4.19Å; F130-H388 AromaticContact CE1-CD2 3.92Å; R384-H388 WeakPolarHBondContact O-CB 3.38Å; R384-H388 PolarHBondContact O-N 3.29Å; L385-H388 PolarHBondContact O-N 3.43Å; H386-H388 PolarHBondContact O-N 3.12Å; H388-N390 VanDerWaalsContact C-N 3.33Å; H388-N390 PolarHBondContact O-N 2.99Å; H388-V391 PolarHBondContact O-N 3.48Å; H388-E392 IonicContact CE1-OE1 2.76Å; H388-E392 PolarHBondContact CE1-OE1 3.2Å; H388-E392 IonicContact CE1-OE2 2.81Å; H388-E392 PolarHBondContact CE1-OE2 3.12Å; H388-E392 VanDerWaalsContact ND1-CD 3.28Å; H388-E392 IonicContact ND1-OE1 2.79Å; H388-E392 IonicContact ND1-OE2 3.21Å; H388-E392 PolarHBondContact ND1-OE2 2.92Å; H388-E392 PolarHBondContact O-N 2.99Å
389	G	84.2	Confident	84.7	Confident	20 Å²	20	59.9 Å²	59.9	21%	0.206	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-37.2	179.6	0	0	0	0	0	113.2	L385 H386 Y387 A393	L385-G389 PolarHBondContact O-N 2.93Å; H386-G389 PolarHBondContact O-N 3.02Å; Y387-G389 PolarHBondContact O-N 3.31Å; G389-A393 WeakPolarHBondContact O-CB 3.24Å; G389-A393 PolarHBondContact O-N 3.38Å
390	N	83.9	Confident	84.3	Confident	74 Å²	74	61.3 Å²	61.3	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-67.1	-45.6	174.9	-67.6	-9	0	0	0	111.6	H386 Y387 H388 E392 A393 D394	H386-N390 PolarHBondContact CE1-ND2 3.42Å; H386-N390 PolarHBondContact CE1-OD1 3.4Å; H386-N390 PolarHBondContact NE2-ND2 2.88Å; H386-N390 VanDerWaalsContact O-CG 3.3Å; H386-N390 PolarHBondContact O-N 2.78Å; H386-N390 PolarHBondContact O-OD1 3.3Å; Y387-N390 PolarHBondContact O-N 2.8Å; H388-N390 VanDerWaalsContact C-N 3.33Å; H388-N390 PolarHBondContact O-N 2.99Å; N390-E392 PolarHBondContact O-N 3.43Å; N390-A393 PolarHBondContact O-N 3.29Å; N390-D394 PolarHBondContact O-N 3.13Å
391	V	84.6	Confident	83.8	Confident	37 Å²	37	65.4 Å²	65.4	22%	0.224	33%	0.333	C	S	.	.	H	α-helix	trans	-61.9	-43.9	179.3	170.6	0	0	0	0	111.5	L135 Y387 H388 Q395	L135-V391 HydrophobicContact CD1-CG1 4.28Å; Y387-V391 HydrophobicContact CD1-CG2 4.26Å; Y387-V391 HydrophobicContact CD2-CG2 4.41Å; Y387-V391 HydrophobicContact CE1-CG2 3.78Å; Y387-V391 HydrophobicContact CE2-CG2 3.92Å; Y387-V391 WeakPolarHBondContact O-CG2 3.3Å; Y387-V391 PolarHBondContact O-N 3.48Å; H388-V391 PolarHBondContact O-N 3.48Å; V391-Q395 WeakPolarHBondContact O-CG 3.35Å; V391-Q395 PolarHBondContact O-N 3.47Å; V391-Q395 VanDerWaalsContact O-N 3.08Å
392	E	82.7	Confident	83.6	Confident	40 Å²	40	68.2 Å²	68.2	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-65.1	-46	174.7	-72.5	179.6	138.4	0	0	111.4	H388 N390 D394 Q395 H396	H388-E392 IonicContact CE1-OE1 2.76Å; H388-E392 PolarHBondContact CE1-OE1 3.2Å; H388-E392 IonicContact CE1-OE2 2.81Å; H388-E392 PolarHBondContact CE1-OE2 3.12Å; H388-E392 VanDerWaalsContact ND1-CD 3.28Å; H388-E392 IonicContact ND1-OE1 2.79Å; H388-E392 IonicContact ND1-OE2 3.21Å; H388-E392 PolarHBondContact ND1-OE2 2.92Å; H388-E392 PolarHBondContact O-N 2.99Å; N390-E392 PolarHBondContact O-N 3.43Å; E392-D394 VanDerWaalsContact C-N 3.29Å; E392-D394 PolarHBondContact O-N 3.08Å; E392-Q395 WeakPolarHBondContact O-CB 3.34Å; E392-Q395 PolarHBondContact O-N 3.23Å; E392-Q395 VanDerWaalsContact O-N 3.12Å; E392-H396 PolarHBondContact O-CD2 2.81Å; E392-H396 VanDerWaalsContact O-CD2 3.26Å; E392-H396 PolarHBondContact O-N 3.15Å
393	A	81.1	Confident	83.3	Confident	55 Å²	55	70.3 Å²	70.3	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-57.4	-40.7	178	0	0	0	0	0	112.3	G389 N390 H396 R397	G389-A393 WeakPolarHBondContact O-CB 3.24Å; G389-A393 PolarHBondContact O-N 3.38Å; N390-A393 PolarHBondContact O-N 3.29Å; A393-H396 PolarHBondContact O-N 3.48Å; A393-R397 WeakPolarHBondContact O-CB 3.38Å; A393-R397 PolarHBondContact O-N 3.24Å
394	D	82.7	Confident	83.1	Confident	87 Å²	87	76 Å²	76	47%	0.465	37%	0.371	S	S	.	.	H	α-helix	trans	-68	-39.6	175.2	-85.4	-34.5	0	0	0	112.8	N390 E392 R397 I398	N390-D394 PolarHBondContact O-N 3.13Å; E392-D394 VanDerWaalsContact C-N 3.29Å; E392-D394 PolarHBondContact O-N 3.08Å; D394-R397 WeakPolarHBondContact O-CB 3.36Å; D394-R397 PolarHBondContact O-N 3.11Å; D394-R397 IonicContact OD1-NE 3.45Å; D394-I398 VanDerWaalsContact O-CG1 3.31Å; D394-I398 WeakPolarHBondContact O-CG1 3.37Å; D394-I398 PolarHBondContact O-N 3.13Å
395	Q	82.4	Confident	82.9	Confident	123 Å²	123	79.8 Å²	79.8	58%	0.575	39%	0.392	S	S	*	.	H	α-helix	trans	-60.5	-46	173	-72.5	177.6	17.3	0	0	111.6	V391 E392 I398 K399	V391-Q395 WeakPolarHBondContact O-CG 3.35Å; V391-Q395 PolarHBondContact O-N 3.47Å; V391-Q395 VanDerWaalsContact O-N 3.08Å; E392-Q395 WeakPolarHBondContact O-CB 3.34Å; E392-Q395 PolarHBondContact O-N 3.23Å; E392-Q395 VanDerWaalsContact O-N 3.12Å; Q395-I398 PolarHBondContact O-N 2.99Å; Q395-K399 WeakPolarHBondContact O-CB 3.29Å; Q395-K399 PolarHBondContact O-N 3.21Å
396	H	80.3	Confident	82.8	Confident	50 Å²	50	83.4 Å²	83.4	23%	0.231	41%	0.407	C	S	.	.	H	α-helix	trans	-62.8	-40.6	174.3	-80.9	-94.5	0	0	0	111.5	E392 A393 I398 K399 I400	E392-H396 PolarHBondContact O-CD2 2.81Å; E392-H396 VanDerWaalsContact O-CD2 3.26Å; E392-H396 PolarHBondContact O-N 3.15Å; A393-H396 PolarHBondContact O-N 3.48Å; H396-I398 PolarHBondContact O-N 3.43Å; H396-K399 PolarHBondContact O-N 2.98Å; H396-I400 WeakPolarHBondContact O-CB 3.35Å; H396-I400 VanDerWaalsContact O-CG1 3.26Å; H396-I400 WeakPolarHBondContact O-CG1 3.3Å; H396-I400 PolarHBondContact O-N 3.46Å
397	R	79.7	Confident	82.7	Confident	139 Å²	139	81.9 Å²	81.9	53%	0.525	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-46.4	176.7	-163.1	-173.1	77.3	69.3	-2.9	111.8	A393 D394 Q401	A393-R397 WeakPolarHBondContact O-CB 3.38Å; A393-R397 PolarHBondContact O-N 3.24Å; D394-R397 WeakPolarHBondContact O-CB 3.36Å; D394-R397 PolarHBondContact O-N 3.11Å; D394-R397 IonicContact OD1-NE 3.45Å; R397-Q401 WeakPolarHBondContact O-CB 3.29Å; R397-Q401 PolarHBondContact O-N 3.46Å
398	I	82.4	Confident	82.5	Confident	88 Å²	88	82 Å²	82	45%	0.451	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-44.5	177.7	-67.1	164.1	0	0	0	110.7	D394 Q395 H396 I400 Q401 N402	D394-I398 VanDerWaalsContact O-CG1 3.31Å; D394-I398 WeakPolarHBondContact O-CG1 3.37Å; D394-I398 PolarHBondContact O-N 3.13Å; Q395-I398 PolarHBondContact O-N 2.99Å; H396-I398 PolarHBondContact O-N 3.43Å; I398-I400 PolarHBondContact O-N 2.93Å; I398-Q401 PolarHBondContact O-N 3.19Å; I398-N402 VanDerWaalsContact O-CG 3.31Å; I398-N402 PolarHBondContact O-N 3.5Å
399	K	82.9	Confident	82.5	Confident	116 Å²	116	88.6 Å²	88.6	50%	0.504	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-47.2	177.5	-175.3	-177.5	176.1	-170	0	111.7	Q395 H396 Q401 N402 M403	Q395-K399 WeakPolarHBondContact O-CB 3.29Å; Q395-K399 PolarHBondContact O-N 3.21Å; H396-K399 PolarHBondContact O-N 2.98Å; K399-Q401 VanDerWaalsContact C-N 3.35Å; K399-N402 PolarHBondContact O-N 3.17Å; K399-M403 HydrophobicContact CG-SD 4.21Å; K399-M403 WeakPolarHBondContact O-CB 3.45Å; K399-M403 WeakPolarHBondContact O-CG 3.48Å; K399-M403 PolarHBondContact O-N 3.07Å
400	I	80.8	Confident	82.6	Confident	109 Å²	109	91.6 Å²	91.6	56%	0.559	45%	0.448	S	S	*	.	H	α-helix	trans	-63.8	-40.6	177.5	-69.2	166.2	0	0	0	110.9	H396 I398 M403 R404	H396-I400 WeakPolarHBondContact O-CB 3.35Å; H396-I400 VanDerWaalsContact O-CG1 3.26Å; H396-I400 WeakPolarHBondContact O-CG1 3.3Å; H396-I400 PolarHBondContact O-N 3.46Å; I398-I400 PolarHBondContact O-N 2.93Å; I400-M403 PolarHBondContact O-N 3.26Å; I400-R404 VanDerWaalsContact O-CB 3.31Å; I400-R404 WeakPolarHBondContact O-CB 3.28Å; I400-R404 PolarHBondContact O-N 3.43Å
401	Q	80.3	Confident	82.7	Confident	88 Å²	88	90.7 Å²	90.7	41%	0.411	44%	0.443	S	S	.	.	H	α-helix	trans	-62.1	-50	176.4	-175.2	169	-13	0	0	111.3	R397 I398 K399 M403 R404 D405	R397-Q401 WeakPolarHBondContact O-CB 3.29Å; R397-Q401 PolarHBondContact O-N 3.46Å; I398-Q401 PolarHBondContact O-N 3.19Å; K399-Q401 VanDerWaalsContact C-N 3.35Å; Q401-M403 PolarHBondContact O-N 3.29Å; Q401-R404 WeakPolarHBondContact O-CB 3.49Å; Q401-R404 PolarHBondContact O-N 3.35Å; Q401-R404 VanDerWaalsContact O-N 3.15Å; Q401-D405 VanDerWaalsContact O-CG 3.28Å; Q401-D405 PolarHBondContact O-N 3.22Å
402	N	83.8	Confident	82.6	Confident	97 Å²	97	95.9 Å²	95.9	52%	0.519	46%	0.459	S	S	.	.	H	α-helix	trans	-60.1	-43.1	177.4	-68.4	-14	0	0	0	112.5	I398 K399 R404 D405 Q406	I398-N402 VanDerWaalsContact O-CG 3.31Å; I398-N402 PolarHBondContact O-N 3.5Å; K399-N402 PolarHBondContact O-N 3.17Å; N402-R404 VanDerWaalsContact C-N 3.34Å; N402-R404 PolarHBondContact O-N 2.94Å; N402-D405 PolarHBondContact O-N 2.88Å; N402-Q406 WeakPolarHBondContact O-CB 3.46Å; N402-Q406 PolarHBondContact O-N 3.48Å
403	M	80.1	Confident	82.7	Confident	115 Å²	115	98.6 Å²	98.6	57%	0.567	47%	0.474	S	S	*	.	H	α-helix	trans	-63.8	-39	176.2	-74.3	178.1	65.2	0	0	112.1	K399 I400 Q401 A407	K399-M403 HydrophobicContact CG-SD 4.21Å; K399-M403 WeakPolarHBondContact O-CB 3.45Å; K399-M403 WeakPolarHBondContact O-CG 3.48Å; K399-M403 PolarHBondContact O-N 3.07Å; I400-M403 PolarHBondContact O-N 3.26Å; Q401-M403 PolarHBondContact O-N 3.29Å; M403-A407 WeakPolarHBondContact O-CB 3.29Å; M403-A407 PolarHBondContact O-N 2.68Å
404	R	81.8	Confident	83	Confident	164 Å²	164	100.9 Å²	100.9	62%	0.619	48%	0.478	S	S	*	.	H	α-helix	trans	-65.9	-47.3	175.6	177.8	178.1	177.1	162.7	-2.4	111.5	I400 Q401 N402 Q406 A407 D408	I400-R404 VanDerWaalsContact O-CB 3.31Å; I400-R404 WeakPolarHBondContact O-CB 3.28Å; I400-R404 PolarHBondContact O-N 3.43Å; Q401-R404 WeakPolarHBondContact O-CB 3.49Å; Q401-R404 PolarHBondContact O-N 3.35Å; Q401-R404 VanDerWaalsContact O-N 3.15Å; N402-R404 VanDerWaalsContact C-N 3.34Å; N402-R404 PolarHBondContact O-N 2.94Å; R404-Q406 VanDerWaalsContact C-N 3.29Å; R404-Q406 PolarHBondContact O-N 3.16Å; R404-A407 PolarHBondContact O-N 2.89Å; R404-A407 VanDerWaalsContact O-N 3.11Å; R404-D408 IonicContact NE-OD2 3.34Å; R404-D408 PolarHBondContact O-N 3.48Å
405	D	83.8	Confident	83.4	Confident	85 Å²	85	96.9 Å²	96.9	46%	0.455	46%	0.456	S	S	.	.	H	α-helix	trans	-63.5	-38.6	-178.9	-66.7	-20.7	0	0	0	110.7	Q401 N402 W409	Q401-D405 VanDerWaalsContact O-CG 3.28Å; Q401-D405 PolarHBondContact O-N 3.22Å; N402-D405 PolarHBondContact O-N 2.88Å; D405-W409 VanDerWaalsContact O-CB 3.27Å; D405-W409 WeakPolarHBondContact O-CB 3.15Å; D405-W409 PolarHBondContact O-N 3.17Å
406	Q	84.4	Confident	83.7	Confident	125 Å²	125	91.6 Å²	91.6	58%	0.584	43%	0.433	S	S	*	.	H	α-helix	trans	-63.6	-41.7	171.6	-172.2	179.4	13.9	0	0	112.5	N402 R404 W409 L410	N402-Q406 WeakPolarHBondContact O-CB 3.46Å; N402-Q406 PolarHBondContact O-N 3.48Å; R404-Q406 VanDerWaalsContact C-N 3.29Å; R404-Q406 PolarHBondContact O-N 3.16Å; Q406-W409 PolarHBondContact O-N 3.02Å; Q406-L410 HydrophobicContact CG-CD1 4.41Å; Q406-L410 WeakPolarHBondContact O-CB 3.34Å; Q406-L410 WeakPolarHBondContact O-CG 3.49Å; Q406-L410 PolarHBondContact O-N 2.69Å
407	A	82.7	Confident	84	Confident	57 Å²	57	93.3 Å²	93.3	47%	0.471	44%	0.443	S	S	.	.	H	α-helix	trans	-70.3	-43.9	178.8	0	0	0	0	0	112.8	M403 R404 W409 L410 L411	M403-A407 WeakPolarHBondContact O-CB 3.29Å; M403-A407 PolarHBondContact O-N 2.68Å; R404-A407 PolarHBondContact O-N 2.89Å; R404-A407 VanDerWaalsContact O-N 3.11Å; A407-W409 VanDerWaalsContact C-N 3.31Å; A407-W409 PolarHBondContact O-N 3.46Å; A407-L410 PolarHBondContact O-N 3.48Å; A407-L411 WeakPolarHBondContact O-CB 3.49Å; A407-L411 PolarHBondContact O-N 3.19Å
408	D	83.1	Confident	84.3	Confident	35 Å²	35	87.5 Å²	87.5	19%	0.187	42%	0.421	C	S	.	.	H	α-helix	trans	-64.7	-34.4	174.2	-91.2	-48.3	0	0	0	110.5	R404 R412 K424	R404-D408 IonicContact NE-OD2 3.34Å; R404-D408 PolarHBondContact O-N 3.48Å; D408-R412 WeakPolarHBondContact O-CB 3.32Å; D408-R412 WeakPolarHBondContact O-CG 3.43Å; D408-R412 PolarHBondContact O-N 3.06Å; D408-K424 IonicContact OD1-NZ 3.87Å; D408-K424 PolarHBondContact OD1-NZ 3.34Å
409	W	85.2	Confident	84.6	Confident	157 Å²	157	83.3 Å²	83.3	60%	0.595	40%	0.4	S	S	*	.	H	α-helix	trans	-65.4	-50.4	172	178.5	78.5	0	0	0	112.5	D405 Q406 A407 L411 R412 N413	D405-W409 VanDerWaalsContact O-CB 3.27Å; D405-W409 WeakPolarHBondContact O-CB 3.15Å; D405-W409 PolarHBondContact O-N 3.17Å; Q406-W409 PolarHBondContact O-N 3.02Å; A407-W409 VanDerWaalsContact C-N 3.31Å; A407-W409 PolarHBondContact O-N 3.46Å; W409-L411 VanDerWaalsContact C-N 3.28Å; W409-L411 PolarHBondContact O-N 2.9Å; W409-R412 PolarHBondContact O-N 3.22Å; W409-N413 VanDerWaalsContact CH2-ND2 3.34Å; W409-N413 WeakPolarHBondContact CH2-ND2 3.25Å; W409-N413 WeakPolarHBondContact CZ2-ND2 3.41Å; W409-N413 PolarHBondContact O-N 2.91Å; W409-N413 VanDerWaalsContact O-N 3.08Å
410	L	86.6	Confident	84.8	Confident	82 Å²	82	78 Å²	78	43%	0.429	38%	0.378	S	S	.	.	H	α-helix	trans	-58.8	-39.8	176.3	-75.7	171.8	0	0	0	112	Q406 A407 N413 I414	Q406-L410 HydrophobicContact CG-CD1 4.41Å; Q406-L410 WeakPolarHBondContact O-CB 3.34Å; Q406-L410 WeakPolarHBondContact O-CG 3.49Å; Q406-L410 PolarHBondContact O-N 2.69Å; A407-L410 PolarHBondContact O-N 3.48Å; L410-N413 PolarHBondContact O-N 3.3Å; L410-I414 WeakPolarHBondContact O-CG1 3.35Å; L410-I414 PolarHBondContact O-N 3.32Å
411	L	85	Confident	85	Confident	55 Å²	55	78.3 Å²	78.3	29%	0.288	38%	0.377	S	S	.	.	H	α-helix	trans	-64.1	-46.1	177.8	-172.4	65.9	0	0	0	111.5	A407 W409 N413 I414 I415 A420	A407-L411 WeakPolarHBondContact O-CB 3.49Å; A407-L411 PolarHBondContact O-N 3.19Å; W409-L411 VanDerWaalsContact C-N 3.28Å; W409-L411 PolarHBondContact O-N 2.9Å; L411-N413 PolarHBondContact O-N 3.14Å; L411-I414 PolarHBondContact O-N 3.17Å; L411-I414 VanDerWaalsContact O-N 3.12Å; L411-I415 HydrophobicContact CD1-CD1 3.68Å; L411-I415 HydrophobicContact CD1-CG1 3.92Å; L411-I415 HydrophobicContact CG-CD1 4.06Å; L411-I415 HydrophobicContact CG-CG1 4.1Å; L411-I415 VanDerWaalsContact O-CG1 3.3Å; L411-I415 WeakPolarHBondContact O-CG1 3.38Å; L411-I415 PolarHBondContact O-N 3.15Å; L411-A420 HydrophobicContact CD2-CB 4.28Å; L411-A420 HydrophobicContact CG-CB 4.45Å
412	R	83.1	Confident	85.2	Confident	147 Å²	147	78.1 Å²	78.1	56%	0.555	38%	0.376	S	S	*	.	H	α-helix	trans	-64.4	-25	177.6	-72	172.2	-176.4	-155	0.9	113.7	D408 W409 I417	D408-R412 WeakPolarHBondContact O-CB 3.32Å; D408-R412 WeakPolarHBondContact O-CG 3.43Å; D408-R412 PolarHBondContact O-N 3.06Å; W409-R412 PolarHBondContact O-N 3.22Å; R412-I417 HydrophobicContact CG-CG1 4.26Å
413	N	85.5	Confident	85.2	Confident	96 Å²	96	75.3 Å²	75.3	51%	0.513	36%	0.361	S	S	.	.	H	α-helix	trans	-77.6	-23	174.2	-69.4	-14.7	0	0	0	113.5	W409 L410 L411	W409-N413 VanDerWaalsContact CH2-ND2 3.34Å; W409-N413 WeakPolarHBondContact CH2-ND2 3.25Å; W409-N413 WeakPolarHBondContact CZ2-ND2 3.41Å; W409-N413 PolarHBondContact O-N 2.91Å; W409-N413 VanDerWaalsContact O-N 3.08Å; L410-N413 PolarHBondContact O-N 3.3Å; L411-N413 PolarHBondContact O-N 3.14Å
414	I	86.6	Confident	85.2	Confident	103 Å²	103	75.8 Å²	75.8	53%	0.528	36%	0.36	S	S	.	.	H	α-helix	trans	-98.9	-33.9	-176.1	-62.8	169.2	0	0	0	111.5	L410 L411	L410-I414 WeakPolarHBondContact O-CG1 3.35Å; L410-I414 PolarHBondContact O-N 3.32Å; L411-I414 PolarHBondContact O-N 3.17Å; L411-I414 VanDerWaalsContact O-N 3.12Å
415	I	90.2	Very high	85.1	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.021	37%	0.368	C	S	.	.	S	Bend	trans	-135	142.7	179.9	55.1	169.5	0	0	0	111.5	L411 A420 L423 V555	L411-I415 HydrophobicContact CD1-CD1 3.68Å; L411-I415 HydrophobicContact CD1-CG1 3.92Å; L411-I415 HydrophobicContact CG-CD1 4.06Å; L411-I415 HydrophobicContact CG-CG1 4.1Å; L411-I415 VanDerWaalsContact O-CG1 3.3Å; L411-I415 WeakPolarHBondContact O-CG1 3.38Å; L411-I415 PolarHBondContact O-N 3.15Å; I415-A420 HydrophobicContact CD1-CB 3.62Å; I415-A420 HydrophobicContact CG1-CB 4Å; I415-L423 HydrophobicContact CD1-CD1 3.81Å; I415-V555 HydrophobicContact CG2-CG2 4.47Å
416	P	89.6	Confident	84.8	Confident	11 Å²	11	72.5 Å²	72.5	7%	0.071	36%	0.363	C	S	.	.			trans	-57.2	150.3	175.3	-26.9	35.2	0	0	0	113.3	H418 V419 A420 Y563	P416-H418 VanDerWaalsContact C-N 3.33Å; P416-H418 PolarHBondContact O-N 2.54Å; P416-V419 HydrophobicContact CB-CB 4.42Å; P416-V419 HydrophobicContact CB-CG2 3.98Å; P416-V419 HydrophobicContact CG-CG2 4.15Å; P416-V419 WeakPolarHBondContact O-CA 3.18Å; P416-V419 WeakPolarHBondContact O-CB 3.24Å; P416-V419 PolarHBondContact O-N 2.92Å; P416-A420 PolarHBondContact O-N 3.2Å; P416-Y563 HydrophobicContact CG-CD1 3.69Å; P416-Y563 HydrophobicContact CG-CE1 3.63Å; P416-Y563 HydrophobicContact CG-CE2 4.45Å; P416-Y563 HydrophobicContact CG-CG 4.14Å
417	I	86.4	Confident	84.3	Confident	86 Å²	86	71.6 Å²	71.6	44%	0.441	36%	0.359	S	S	.	.	H	α-helix	trans	-56.6	-46.6	-174.9	-60.4	173	0	0	0	111.4	R412 V419 A420 E421	R412-I417 HydrophobicContact CG-CG1 4.26Å; I417-V419 PolarHBondContact O-N 3.24Å; I417-A420 WeakPolarHBondContact O-CB 3.23Å; I417-A420 PolarHBondContact O-N 2.87Å; I417-A420 VanDerWaalsContact O-N 3.14Å; I417-E421 PolarHBondContact O-N 3.1Å
418	H	85.9	Confident	84.3	Confident	17 Å²	17	72.5 Å²	72.5	8%	0.079	36%	0.362	C	S	.	.	H	α-helix	trans	-65	-25	-179.5	68.7	-93.3	0	0	0	113.2	P416 E484	P416-H418 VanDerWaalsContact C-N 3.33Å; P416-H418 PolarHBondContact O-N 2.54Å; H418-E484 IonicContact CE1-OE1 3.66Å; H418-E484 PolarHBondContact CE1-OE1 3.22Å; H418-E484 VanDerWaalsContact CE1-OE1 3.29Å; H418-E484 IonicContact ND1-OE1 2.63Å; H418-E484 PolarHBondContact ND1-OE1 2.9Å
419	V	89.4	Confident	84.7	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-80.6	-43.3	173.5	-179.9	0	0	0	0	110.2	P416 I417 E421 Q422 L423 Y429 V555 Y563	P416-V419 HydrophobicContact CB-CB 4.42Å; P416-V419 HydrophobicContact CB-CG2 3.98Å; P416-V419 HydrophobicContact CG-CG2 4.15Å; P416-V419 WeakPolarHBondContact O-CA 3.18Å; P416-V419 WeakPolarHBondContact O-CB 3.24Å; P416-V419 PolarHBondContact O-N 2.92Å; I417-V419 PolarHBondContact O-N 3.24Å; V419-E421 VanDerWaalsContact C-N 3.32Å; V419-E421 PolarHBondContact O-N 3.07Å; V419-Q422 PolarHBondContact O-N 3.2Å; V419-L423 HydrophobicContact CG1-CD1 4.04Å; V419-L423 HydrophobicContact CG1-CG 4.36Å; V419-L423 PolarHBondContact O-N 3.38Å; V419-Y429 HydrophobicContact CB-CE2 4.45Å; V419-Y429 HydrophobicContact CG1-CD1 3.85Å; V419-Y429 HydrophobicContact CG1-CD2 4Å; V419-Y429 HydrophobicContact CG1-CE1 4.26Å; V419-Y429 HydrophobicContact CG1-CE2 4.37Å; V419-Y429 HydrophobicContact CG1-CG 3.72Å; V419-Y429 HydrophobicContact CG2-CD1 4.34Å; V419-Y429 HydrophobicContact CG2-CE1 3.91Å; V419-Y429 HydrophobicContact CG2-CE2 4.16Å; V419-V555 HydrophobicContact CG1-CG2 3.55Å; V419-Y563 HydrophobicContact CG1-CD2 4.26Å; V419-Y563 HydrophobicContact CG2-CD2 3.9Å; V419-Y563 HydrophobicContact CG2-CE2 3.56Å
420	A	87.3	Confident	84.9	Confident	6 Å²	6	68.4 Å²	68.4	5%	0.05	36%	0.358	C	S	.	.	H	α-helix	trans	-59.9	-39.6	178.3	0	0	0	0	0	112.4	L411 I415 P416 I417 L423 K424	L411-A420 HydrophobicContact CD2-CB 4.28Å; L411-A420 HydrophobicContact CG-CB 4.45Å; I415-A420 HydrophobicContact CD1-CB 3.62Å; I415-A420 HydrophobicContact CG1-CB 4Å; P416-A420 PolarHBondContact O-N 3.2Å; I417-A420 WeakPolarHBondContact O-CB 3.23Å; I417-A420 PolarHBondContact O-N 2.87Å; I417-A420 VanDerWaalsContact O-N 3.14Å; A420-L423 PolarHBondContact O-N 3.2Å; A420-K424 VanDerWaalsContact O-CG 3.3Å; A420-K424 WeakPolarHBondContact O-CG 3.37Å; A420-K424 PolarHBondContact O-N 3.11Å
421	E	84.9	Confident	85.2	Confident	114 Å²	114	66.6 Å²	66.6	53%	0.533	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-39	175.8	-71.9	179.5	176.1	0	0	112.7	I417 V419 K424	I417-E421 PolarHBondContact O-N 3.1Å; V419-E421 VanDerWaalsContact C-N 3.32Å; V419-E421 PolarHBondContact O-N 3.07Å; E421-K424 PolarHBondContact O-N 2.86Å
422	Q	84.4	Confident	85.6	Confident	84 Å²	84	69.4 Å²	69.4	39%	0.393	36%	0.362	S	S	.	.	H	α-helix	trans	-71.3	-36.4	174.1	-65.7	-166.9	15.5	0	0	112.1	V419 K424 V425 S426 Y429	V419-Q422 PolarHBondContact O-N 3.2Å; Q422-K424 VanDerWaalsContact C-N 3.29Å; Q422-K424 PolarHBondContact O-N 3.15Å; Q422-V425 VanDerWaalsContact O-CG2 3.22Å; Q422-V425 WeakPolarHBondContact O-CG2 3.2Å; Q422-V425 PolarHBondContact O-N 3.3Å; Q422-S426 WeakPolarHBondContact O-CB 3.33Å; Q422-S426 PolarHBondContact O-N 3.48Å; Q422-Y429 HydrophobicContact CB-CD2 3.93Å; Q422-Y429 HydrophobicContact CB-CE2 4.3Å; Q422-Y429 HydrophobicContact CG-CE2 4.44Å
423	L	83.3	Confident	86.2	Confident	39 Å²	39	62.8 Å²	62.8	20%	0.204	34%	0.338	C	S	.	.	H	α-helix	trans	-71	-20	174.3	-74.1	-179.9	0	0	0	113.9	I415 V419 A420 V425 S426 V555	I415-L423 HydrophobicContact CD1-CD1 3.81Å; V419-L423 HydrophobicContact CG1-CD1 4.04Å; V419-L423 HydrophobicContact CG1-CG 4.36Å; V419-L423 PolarHBondContact O-N 3.38Å; A420-L423 PolarHBondContact O-N 3.2Å; L423-V425 VanDerWaalsContact C-N 3.26Å; L423-V425 PolarHBondContact O-N 3.03Å; L423-S426 CarbonylContact C-O 3.55Å; L423-S426 VanDerWaalsContact CA-O 3.26Å; L423-S426 WeakPolarHBondContact CA-O 3.49Å; L423-V555 HydrophobicContact CD1-CB 4.4Å; L423-V555 HydrophobicContact CD1-CG1 4.32Å; L423-V555 HydrophobicContact CD1-CG2 4.08Å
424	K	80	Confident	86.5	Confident	124 Å²	124	64.9 Å²	64.9	54%	0.539	35%	0.349	S	S	.	.	H	α-helix	trans	-68.2	-25.2	170.3	-79.3	171.1	-179.6	-174.6	0	112.3	D408 A420 E421 Q422	D408-K424 IonicContact OD1-NZ 3.87Å; D408-K424 PolarHBondContact OD1-NZ 3.34Å; A420-K424 VanDerWaalsContact O-CG 3.3Å; A420-K424 WeakPolarHBondContact O-CG 3.37Å; A420-K424 PolarHBondContact O-N 3.11Å; E421-K424 PolarHBondContact O-N 2.86Å; Q422-K424 VanDerWaalsContact C-N 3.29Å; Q422-K424 PolarHBondContact O-N 3.15Å
425	V	80.6	Confident	86.7	Confident	130 Å²	130	62 Å²	62	79%	0.788	34%	0.335	S	S	*	.	H	α-helix	trans	-107.9	-24.8	178.6	-61.7	0	0	0	0	114.3	Q422 L423	Q422-V425 VanDerWaalsContact O-CG2 3.22Å; Q422-V425 WeakPolarHBondContact O-CG2 3.2Å; Q422-V425 PolarHBondContact O-N 3.3Å; L423-V425 VanDerWaalsContact C-N 3.26Å; L423-V425 PolarHBondContact O-N 3.03Å
426	S	76.6	Confident	87	Confident	51 Å²	51	61.9 Å²	61.9	36%	0.357	33%	0.334	S	S	.	.			trans	-123.3	142.7	-178.3	175.8	0	0	0	0	111.2	Q422 L423 S428	Q422-S426 WeakPolarHBondContact O-CB 3.33Å; Q422-S426 PolarHBondContact O-N 3.48Å; L423-S426 CarbonylContact C-O 3.55Å; L423-S426 VanDerWaalsContact CA-O 3.26Å; L423-S426 WeakPolarHBondContact CA-O 3.49Å; S426-S428 PolarHBondContact O-N 3.22Å; S426-S428 PolarHBondContact OG-N 3.17Å; S426-S428 PolarHBondContact OG-O 2.9Å
427	Q	73.1	Confident	87.4	Confident	105 Å²	105	61.3 Å²	61.3	49%	0.491	33%	0.33	S	S	.	.	S	Bend	trans	-71.3	-18.2	176.2	-160.4	-173	13.9	0	0	113.3
428	S	84.3	Confident	87.9	Confident	76 Å²	76	57.2 Å²	57.2	53%	0.531	31%	0.309	S	S	.	.			trans	-135.7	143.8	-174.4	57	0	0	0	0	111.8	S426	S426-S428 PolarHBondContact O-N 3.22Å; S426-S428 PolarHBondContact OG-N 3.17Å; S426-S428 PolarHBondContact OG-O 2.9Å
429	Y	89.6	Confident	88.5	Confident	9 Å²	9	56.4 Å²	56.4	4%	0.035	31%	0.306	C	S	.	.			trans	-120.4	124.9	174.7	-179.1	-90.4	0	0	0	110.6	V419 Q422 K431 A553 G554 V555 Y563	V419-Y429 HydrophobicContact CB-CE2 4.45Å; V419-Y429 HydrophobicContact CG1-CD1 3.85Å; V419-Y429 HydrophobicContact CG1-CD2 4Å; V419-Y429 HydrophobicContact CG1-CE1 4.26Å; V419-Y429 HydrophobicContact CG1-CE2 4.37Å; V419-Y429 HydrophobicContact CG1-CG 3.72Å; V419-Y429 HydrophobicContact CG2-CD1 4.34Å; V419-Y429 HydrophobicContact CG2-CE1 3.91Å; V419-Y429 HydrophobicContact CG2-CE2 4.16Å; Q422-Y429 HydrophobicContact CB-CD2 3.93Å; Q422-Y429 HydrophobicContact CB-CE2 4.3Å; Q422-Y429 HydrophobicContact CG-CE2 4.44Å; Y429-K431 HydrophobicContact CE1-CB 4.17Å; Y429-K431 HydrophobicContact CE2-CB 4.4Å; Y429-K431 WeakPolarHBondContact OH-CD 3.34Å; Y429-A553 HydrophobicContact CE1-CB 4.18Å; Y429-G554 WeakPolarHBondContact O-CA 3.48Å; Y429-V555 HydrophobicContact CD1-CG2 4.22Å; Y429-V555 PolarHBondContact O-N 3.24Å; Y429-Y563 HydrophobicContact CE1-CE2 4.1Å
430	S	91.4	Very high	89	Confident	97 Å²	97	57.1 Å²	57.1	68%	0.678	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.2	126.9	170.5	179	0	0	0	0	107.6	A553	S430-A553 WeakPolarHBondContact CA-O 3.39Å
431	K	92	Very high	89.5	Confident	45 Å²	45	56.9 Å²	56.9	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	132.6	-174	-172	174.6	175	-173.2	0	110.8	Y429 H433 T501 T552 A553	Y429-K431 HydrophobicContact CE1-CB 4.17Å; Y429-K431 HydrophobicContact CE2-CB 4.4Å; Y429-K431 WeakPolarHBondContact OH-CD 3.34Å; K431-H433 PolarHBondContact O-CD2 3.36Å; K431-T501 VanDerWaalsContact NZ-CG2 3.27Å; K431-T501 PolarHBondContact NZ-OG1 2.98Å; K431-T552 CarbonylContact O-C 3.51Å; K431-T552 WeakPolarHBondContact O-CA 3.37Å; K431-A553 PolarHBondContact N-O 2.85Å; K431-A553 PolarHBondContact O-N 2.86Å
432	N	94.3	Very high	90.1	Very high	114 Å²	114	51.9 Å²	51.9	61%	0.61	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	142.1	169.9	-66.2	-10.4	0	0	0	109.7	T552	N432-T552 WeakPolarHBondContact OD1-CG2 3.33Å; N432-T552 PolarHBondContact OD1-OG1 3.19Å; N432-T552 VanDerWaalsContact OD1-OG1 3.12Å
433	H	94	Very high	90.6	Very high	8 Å²	8	48.5 Å²	48.5	4%	0.037	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125.1	176.6	-61	-107.7	0	0	0	107.9	K431 V436 L499 P550 L551	K431-H433 PolarHBondContact O-CD2 3.36Å; H433-V436 HydrophobicContact CB-CG2 3.33Å; H433-L499 PolarHBondContact CE1-O 3.32Å; H433-P550 CarbonylContact O-C 3.42Å; H433-P550 VanDerWaalsContact O-CA 3.28Å; H433-P550 WeakPolarHBondContact O-CA 3.36Å; H433-L551 HydrophobicContact CB-CD1 4.31Å; H433-L551 PolarHBondContact N-O 3.36Å; H433-L551 PolarHBondContact O-N 3.13Å; H433-L551 VanDerWaalsContact O-O 3.13Å
434	D	91.8	Very high	91.1	Very high	140 Å²	140	49.2 Å²	49.2	75%	0.749	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	-22.9	-171.1	-55.7	-48.4	0	0	0	113.4	G549 P550	D434-G549 CarbonylContact O-C 3.59Å; D434-P550 WeakPolarHBondContact O-CA 3.27Å
435	N	92.3	Very high	91.7	Very high	43 Å²	43	43.8 Å²	43.8	23%	0.23	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	102.1	-176.1	-176.3	35.4	0	0	0	110.4	Q511 H513 H548	N435-Q511 PolarHBondContact ND2-NE2 2.97Å; N435-Q511 PolarHBondContact ND2-OE1 3.48Å; N435-H513 PolarHBondContact ND2-CE1 3.12Å; N435-H548 PolarHBondContact OD1-CD2 3.39Å
436	V	95.9	Very high	92.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.1	178.7	-174.9	0	0	0	0	108.5	H433 V438 A496 A497 L499 H548 G549 L551	H433-V436 HydrophobicContact CB-CG2 3.33Å; V436-V438 HydrophobicContact CG1-CG2 4.47Å; V436-A496 HydrophobicContact CG1-CB 4.12Å; V436-A497 WeakPolarHBondContact CA-O 3.37Å; V436-A497 WeakPolarHBondContact CG1-O 3.41Å; V436-L499 HydrophobicContact CG1-CD2 4.04Å; V436-L499 HydrophobicContact CG1-CG 4.02Å; V436-L499 HydrophobicContact CG2-CD2 4.3Å; V436-H548 CarbonylContact O-C 3.6Å; V436-H548 VanDerWaalsContact O-CA 3.24Å; V436-H548 WeakPolarHBondContact O-CA 3.29Å; V436-G549 PolarHBondContact N-O 2.94Å; V436-G549 PolarHBondContact O-N 3.37Å; V436-G549 VanDerWaalsContact O-N 3.09Å; V436-L551 HydrophobicContact CB-CD1 4.3Å; V436-L551 HydrophobicContact CB-CD2 3.79Å; V436-L551 HydrophobicContact CB-CG 3.88Å; V436-L551 HydrophobicContact CG1-CD1 4.43Å; V436-L551 HydrophobicContact CG1-CD2 3.84Å; V436-L551 HydrophobicContact CG1-CG 4.31Å; V436-L551 HydrophobicContact CG2-CD1 3.98Å; V436-L551 HydrophobicContact CG2-CD2 4.37Å; V436-L551 HydrophobicContact CG2-CG 3.95Å
437	G	97.1	Very high	92.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	140	169.4	0	0	0	0	0	110.6	A496 A497 L517	G437-A496 CarbonylContact O-C 3.51Å; G437-A496 WeakPolarHBondContact O-CA 3.26Å; G437-A496 VanDerWaalsContact O-CB 3.31Å; G437-A496 WeakPolarHBondContact O-CB 3.46Å; G437-A497 PolarHBondContact N-O 3.5Å; G437-A497 PolarHBondContact O-N 3.35Å; G437-L517 VanDerWaalsContact O-CD2 3.3Å; G437-L517 WeakPolarHBondContact O-CD2 3.43Å
438	V	98.4	Very high	93.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	133.3	178.9	-176.2	0	0	0	0	109.6	V436 F440 M494 A496 N547 L551 I565 T569 V570 A573	V436-V438 HydrophobicContact CG1-CG2 4.47Å; V438-F440 HydrophobicContact CG1-CD2 4.25Å; V438-F440 HydrophobicContact CG1-CE2 3.89Å; V438-M494 HydrophobicContact CG1-CE 4.43Å; V438-A496 HydrophobicContact CG2-CB 4.19Å; V438-N547 PolarHBondContact N-O 2.94Å; V438-N547 PolarHBondContact O-N 3.4Å; V438-N547 VanDerWaalsContact O-N 3.11Å; V438-L551 HydrophobicContact CG2-CD2 3.59Å; V438-I565 HydrophobicContact CG1-CD1 4.41Å; V438-I565 HydrophobicContact CG2-CD1 4.03Å; V438-T569 HydrophobicContact CG2-CG2 4.18Å; V438-V570 HydrophobicContact CG2-CG2 4.35Å; V438-A573 HydrophobicContact CB-CB 4.11Å; V438-A573 HydrophobicContact CG1-CB 4.02Å
439	I	98.5	Very high	94	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	145.9	171.2	63.1	176	0	0	0	112.4	A495 L517 F520 A521 M524 I544 G545 F546	I439-A495 HydrophobicContact CD1-CB 4.28Å; I439-A495 HydrophobicContact CG1-CB 4.01Å; I439-A495 PolarHBondContact N-O 3.16Å; I439-A495 PolarHBondContact O-N 3Å; I439-L517 HydrophobicContact CD1-CD1 3.94Å; I439-L517 HydrophobicContact CD1-CG 4.5Å; I439-L517 HydrophobicContact CG1-CD1 4.03Å; I439-L517 HydrophobicContact CG2-CD1 4.41Å; I439-L517 HydrophobicContact CG2-CD2 4.05Å; I439-L517 HydrophobicContact CG2-CG 3.95Å; I439-F520 HydrophobicContact CD1-CD1 3.8Å; I439-F520 HydrophobicContact CD1-CE1 4.04Å; I439-A521 HydrophobicContact CD1-CB 4.37Å; I439-M524 HydrophobicContact CD1-SD 4.15Å; I439-I544 HydrophobicContact CB-CG2 4.15Å; I439-I544 HydrophobicContact CG2-CG2 4.33Å; I439-G545 VanDerWaalsContact CA-O 3.28Å; I439-G545 WeakPolarHBondContact CA-O 3.4Å; I439-F546 HydrophobicContact CG2-CB 4.26Å; I439-F546 HydrophobicContact CG2-CD2 3.47Å; I439-F546 VanDerWaalsContact CG2-CD2 3.47Å; I439-F546 HydrophobicContact CG2-CE2 4.21Å; I439-F546 HydrophobicContact CG2-CG 4.21Å
440	F	98.6	Very high	94	Very high	15 Å²	15	44.7 Å²	44.7	7%	0.066	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.6	163.4	-76.2	-103.4	0	0	0	107.5	V438 I489 T492 M494 I544 G545 V570 A573 D577	V438-F440 HydrophobicContact CG1-CD2 4.25Å; V438-F440 HydrophobicContact CG1-CE2 3.89Å; F440-I489 HydrophobicContact CE1-CD1 4.44Å; F440-T492 HydrophobicContact CB-CG2 4.34Å; F440-T492 HydrophobicContact CD1-CG2 3.99Å; F440-M494 HydrophobicContact CD1-CB 4.5Å; F440-M494 HydrophobicContact CD1-CG 4.4Å; F440-M494 HydrophobicContact CE1-CB 4.38Å; F440-M494 HydrophobicContact CE1-CG 3.99Å; F440-M494 HydrophobicContact CE1-SD 3.84Å; F440-M494 HydrophobicContact CE2-CE 4.17Å; F440-M494 HydrophobicContact CE2-CG 4.26Å; F440-M494 HydrophobicContact CE2-SD 4.4Å; F440-M494 HydrophobicContact CZ-CE 3.75Å; F440-M494 HydrophobicContact CZ-CG 3.91Å; F440-M494 HydrophobicContact CZ-SD 3.62Å; F440-I544 CarbonylContact O-C 3.57Å; F440-I544 WeakPolarHBondContact O-CA 3.28Å; F440-G545 PolarHBondContact N-O 3.08Å; F440-G545 PolarHBondContact O-N 3.45Å; F440-V570 HydrophobicContact CE2-CG1 3.91Å; F440-V570 HydrophobicContact CZ-CG1 3.88Å; F440-A573 HydrophobicContact CD2-CB 3.81Å; F440-A573 HydrophobicContact CE2-CB 4.06Å; F440-D577 HydrophobicContact CB-CB 3.62Å
441	A	98	Very high	93.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.6	180	0	0	0	0	0	109.4	T492 Y493 M524 L542 R543 I544	A441-T492 CarbonylContact O-C 3.45Å; A441-T492 WeakPolarHBondContact O-CA 3.47Å; A441-Y493 PolarHBondContact N-O 3.02Å; A441-Y493 PolarHBondContact O-N 3.41Å; A441-M524 HydrophobicContact CB-CE 3.74Å; A441-M524 HydrophobicContact CB-SD 4.3Å; A441-L542 HydrophobicContact CB-CD1 4.19Å; A441-R543 CarbonylContact C-O 3.58Å; A441-R543 WeakPolarHBondContact CA-O 3.21Å; A441-I544 HydrophobicContact CB-CD1 4.28Å; A441-I544 HydrophobicContact CB-CG1 3.85Å; A441-I544 HydrophobicContact CB-CG2 4.35Å
442	S	97.5	Very high	93.9	Very high	8 Å²	8	49.4 Å²	49.4	6%	0.056	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.1	-174.8	-76.9	0	0	0	0	111.7	V444 T492 R543 D577	S442-V444 PolarHBondContact O-N 3.31Å; S442-T492 WeakPolarHBondContact OG-CG2 3.45Å; S442-T492 PolarHBondContact OG-OG1 3.44Å; S442-R543 PolarHBondContact N-O 3.47Å; S442-R543 PolarHBondContact O-N 3.01Å; S442-D577 VanDerWaalsContact CB-OD1 3.26Å; S442-D577 WeakPolarHBondContact CB-OD1 3.38Å; S442-D577 VanDerWaalsContact OG-CG 3.31Å; S442-D577 PolarHBondContact OG-OD1 3.25Å; S442-D577 PolarHBondContact OG-OD2 3.08Å
443	I	96.3	Very high	93.6	Very high	13 Å²	13	48.9 Å²	48.9	7%	0.067	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.7	167	-55	169.7	0	0	0	108.4	F446 L464 L467 A491 F540 L542	I443-F446 HydrophobicContact CB-CB 4.29Å; I443-F446 HydrophobicContact CG2-CB 3.95Å; I443-L464 HydrophobicContact CD1-CD1 3.57Å; I443-L467 HydrophobicContact CD1-CD2 3.62Å; I443-L467 HydrophobicContact CG1-CD2 4.48Å; I443-A491 HydrophobicContact CB-CB 4.22Å; I443-A491 PolarHBondContact N-O 3.42Å; I443-A491 VanDerWaalsContact N-O 3.15Å; I443-F540 HydrophobicContact CG2-CB 4.04Å; I443-F540 HydrophobicContact CG2-CD1 3.51Å; I443-F540 HydrophobicContact CG2-CE1 4.35Å; I443-F540 HydrophobicContact CG2-CG 4.08Å; I443-L542 HydrophobicContact CG1-CD1 4.18Å
444	V	93.3	Very high	93.1	Very high	55 Å²	55	55.1 Å²	55.1	33%	0.333	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-47.7	-168.9	-179	0	0	0	0	112.2	S442 K541 R543 E582	S442-V444 PolarHBondContact O-N 3.31Å; V444-K541 HydrophobicContact CB-CB 4.48Å; V444-K541 PolarHBondContact N-O 3.34Å; V444-R543 HydrophobicContact CG2-CB 4.02Å; V444-R543 HydrophobicContact CG2-CG 3.61Å; V444-E582 HydrophobicContact CG2-CB 4.34Å
445	N	93	Very high	92.7	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.053	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	19.3	-172.9	61.6	-25.3	0	0	0	114	S447 E448 F449 F538 G539 F540 K541	N445-S447 PolarHBondContact O-N 3.26Å; N445-E448 HydrophobicContact CB-CB 4.47Å; N445-E448 HydrophobicContact CB-CG 4.34Å; N445-E448 WeakPolarHBondContact O-CB 3.46Å; N445-E448 PolarHBondContact O-N 2.96Å; N445-F449 PolarHBondContact O-N 3.41Å; N445-F538 HydrophobicContact CB-CZ 4.29Å; N445-F538 VanDerWaalsContact ND2-CZ 3.27Å; N445-F538 WeakPolarHBondContact ND2-CZ 3.44Å; N445-G539 PolarHBondContact ND2-O 3.02Å; N445-F540 WeakPolarHBondContact OD1-CA 3.38Å; N445-K541 PolarHBondContact OD1-N 3.47Å
446	F	92.2	Very high	92.5	Very high	21 Å²	21	54.1 Å²	54.1	9%	0.092	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-30.9	176.8	-173.2	-98.3	0	0	0	112.6	I443 E448 F449 Y450 C460 L464 A491 F540	I443-F446 HydrophobicContact CB-CB 4.29Å; I443-F446 HydrophobicContact CG2-CB 3.95Å; F446-E448 VanDerWaalsContact C-N 3.29Å; F446-E448 PolarHBondContact O-N 3.44Å; F446-F449 HydrophobicContact CD2-CD1 4.3Å; F446-F449 HydrophobicContact CE2-CD1 4.01Å; F446-F449 PolarHBondContact O-N 2.88Å; F446-Y450 HydrophobicContact CE1-CD2 4.47Å; F446-Y450 PolarHBondContact O-N 3.49Å; F446-C460 HydrophobicContact CZ-CB 4.26Å; F446-L464 HydrophobicContact CD2-CD1 4.35Å; F446-L464 HydrophobicContact CE1-CD2 4.29Å; F446-L464 HydrophobicContact CE2-CB 3.8Å; F446-L464 HydrophobicContact CE2-CD1 4.22Å; F446-L464 HydrophobicContact CE2-CD2 4.18Å; F446-L464 HydrophobicContact CE2-CG 4.29Å; F446-L464 HydrophobicContact CZ-CB 4.05Å; F446-L464 HydrophobicContact CZ-CD2 3.92Å; F446-L464 HydrophobicContact CZ-CG 4.46Å; F446-A491 HydrophobicContact CB-CB 3.94Å; F446-A491 HydrophobicContact CD1-CB 4.08Å; F446-A491 HydrophobicContact CG-CB 3.94Å; F446-F540 AromaticContact CD2-CE1 3.89Å; F446-F540 HydrophobicContact CD2-CE1 3.89Å; F446-F540 HydrophobicContact CD2-CZ 4.44Å
447	S	90	Very high	92.1	Very high	96 Å²	96	54.2 Å²	54.2	67%	0.671	28%	0.284	S	S	*	.	H	α-helix	trans	-68.8	-23.6	174.8	52.4	0	0	0	0	114.2	N445	N445-S447 PolarHBondContact O-N 3.26Å
448	E	91.6	Very high	91.8	Very high	150 Å²	150	61.1 Å²	61.1	70%	0.701	31%	0.314	S	S	*	.	H	α-helix	trans	-79	-26.5	173.9	-60.2	174.1	-177	0	0	111.4	N445 F446 F538	N445-E448 HydrophobicContact CB-CB 4.47Å; N445-E448 HydrophobicContact CB-CG 4.34Å; N445-E448 WeakPolarHBondContact O-CB 3.46Å; N445-E448 PolarHBondContact O-N 2.96Å; F446-E448 VanDerWaalsContact C-N 3.29Å; F446-E448 PolarHBondContact O-N 3.44Å; E448-F538 HydrophobicContact CB-CE2 4.44Å
449	F	88.7	Confident	91.4	Very high	47 Å²	47	64.1 Å²	64.1	21%	0.206	33%	0.328	C	S	.	.	H	α-helix	trans	-84.8	-20	176	-179.4	-106.7	0	0	0	113.6	N445 F446 E451 C460 V463 M535 F538 F540	N445-F449 PolarHBondContact O-N 3.41Å; F446-F449 HydrophobicContact CD2-CD1 4.3Å; F446-F449 HydrophobicContact CE2-CD1 4.01Å; F446-F449 PolarHBondContact O-N 2.88Å; F449-E451 PolarHBondContact O-N 2.97Å; F449-C460 HydrophobicContact CD1-CB 4.26Å; F449-C460 HydrophobicContact CE1-CB 4.06Å; F449-C460 PolarHBondContact O-SG 3.37Å; F449-V463 HydrophobicContact CE1-CB 4.11Å; F449-V463 HydrophobicContact CE1-CG1 4.06Å; F449-V463 HydrophobicContact CZ-CB 4.26Å; F449-V463 HydrophobicContact CZ-CG1 4.07Å; F449-V463 HydrophobicContact CZ-CG2 4.25Å; F449-M535 HydrophobicContact CD2-CE 4.47Å; F449-M535 HydrophobicContact CE2-CE 3.7Å; F449-M535 HydrophobicContact CZ-CE 3.99Å; F449-F538 HydrophobicContact CB-CE1 3.89Å; F449-F538 HydrophobicContact CB-CE2 4.2Å; F449-F538 HydrophobicContact CB-CZ 3.71Å; F449-F538 AromaticContact CD2-CD1 4Å; F449-F538 HydrophobicContact CD2-CD1 4Å; F449-F538 HydrophobicContact CD2-CD2 4.47Å; F449-F538 HydrophobicContact CD2-CE1 4.2Å; F449-F538 HydrophobicContact CD2-CG 4.15Å; F449-F538 HydrophobicContact CG-CE1 4.3Å; F449-F540 HydrophobicContact CB-CE1 3.96Å; F449-F540 HydrophobicContact CB-CZ 4.39Å; F449-F540 AromaticContact CD1-CE1 3.87Å; F449-F540 HydrophobicContact CD1-CE1 3.87Å; F449-F540 AromaticContact CD1-CZ 3.57Å; F449-F540 HydrophobicContact CD1-CZ 3.57Å; F449-F540 HydrophobicContact CD2-CZ 4.18Å; F449-F540 AromaticContact CE1-CZ 3.78Å; F449-F540 HydrophobicContact CE1-CZ 3.78Å; F449-F540 HydrophobicContact CE2-CZ 4.38Å; F449-F540 AromaticContact CG-CE1 3.85Å; F449-F540 HydrophobicContact CG-CE1 3.85Å; F449-F540 AromaticContact CG-CZ 3.78Å; F449-F540 HydrophobicContact CG-CZ 3.78Å; F449-F540 HydrophobicContact CZ-CZ 4.19Å
450	Y	90.1	Very high	91.1	Very high	75 Å²	75	64.8 Å²	64.8	29%	0.294	33%	0.332	S	S	.	.			trans	-78.5	115.5	-175.3	180	-99.4	0	0	0	112	F446 E452 C460 Y461	F446-Y450 HydrophobicContact CE1-CD2 4.47Å; F446-Y450 PolarHBondContact O-N 3.49Å; Y450-E452 HydrophobicContact CE1-CB 3.89Å; Y450-C460 HydrophobicContact CD2-CB 4.01Å; Y450-Y461 HydrophobicContact CE2-CD2 4.48Å; Y450-Y461 AromaticContact CE2-CE2 3.77Å; Y450-Y461 HydrophobicContact CE2-CE2 3.77Å
451	E	89.3	Confident	90.8	Very high	109 Å²	109	70.3 Å²	70.3	51%	0.509	35%	0.353	S	S	.	.			trans	-121.6	107.8	174.4	-172.5	-179.2	166	0	0	111.1	F449 S453 G457	F449-E451 PolarHBondContact O-N 2.97Å; E451-S453 VanDerWaalsContact C-N 3.35Å; E451-S453 WeakPolarHBondContact CG-OG 3.47Å; E451-S453 PolarHBondContact OE1-OG 2.89Å; E451-G457 WeakPolarHBondContact O-CA 3.4Å
452	E	91.1	Very high	90.6	Very high	133 Å²	133	76.2 Å²	76.2	62%	0.621	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-25.6	178.8	-168.7	169.8	-161	0	0	113.1	Y450 Y454 G456	Y450-E452 HydrophobicContact CE1-CB 3.89Å; E452-Y454 PolarHBondContact O-N 3.13Å; E452-G456 VanDerWaalsContact O-CA 3.25Å; E452-G456 WeakPolarHBondContact O-CA 3.39Å; E452-G456 PolarHBondContact O-N 3.42Å
453	S	87.9	Confident	90.4	Very high	103 Å²	103	76.7 Å²	76.7	72%	0.72	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-25.9	178.7	21.4	0	0	0	0	113.7	E451	E451-S453 VanDerWaalsContact C-N 3.35Å; E451-S453 WeakPolarHBondContact CG-OG 3.47Å; E451-S453 PolarHBondContact OE1-OG 2.89Å
454	Y	83.6	Confident	90.3	Very high	139 Å²	139	76.7 Å²	76.7	55%	0.545	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	111.3	177.6	-168.2	-90	0	0	0	111.2	E452 G456 G457 E459	E452-Y454 PolarHBondContact O-N 3.13Å; Y454-G456 PolarHBondContact O-N 3.32Å; Y454-G457 PolarHBondContact O-N 3.33Å; Y454-E459 HydrophobicContact CD1-CG 4.49Å; Y454-E459 HydrophobicContact CE1-CG 4.15Å
455	E	84.3	Confident	90.4	Very high	119 Å²	119	79.8 Å²	79.8	56%	0.556	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	19.9	178.2	-60.9	-167.5	158.8	0	0	116.1	K458	E455-K458 WeakPolarHBondContact O-CD 3.45Å; E455-K458 WeakPolarHBondContact O-CG 3.35Å
456	G	86.9	Confident	90.5	Very high	43 Å²	43	84 Å²	84	44%	0.443	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	31.5	-174.9	0	0	0	0	0	113.4	E452 Y454 K458	E452-G456 VanDerWaalsContact O-CA 3.25Å; E452-G456 WeakPolarHBondContact O-CA 3.39Å; E452-G456 PolarHBondContact O-N 3.42Å; Y454-G456 PolarHBondContact O-N 3.32Å; G456-K458 PolarHBondContact O-N 2.97Å; G456-K458 VanDerWaalsContact O-N 3.15Å
457	G	88.9	Confident	90.7	Very high	1 Å²	1	83 Å²	83	1%	0.01	41%	0.408	C	S	.	.	S	Bend	trans	70.5	5.7	177.7	0	0	0	0	0	115.4	E451 Y454 E459 C460 Y461	E451-G457 WeakPolarHBondContact O-CA 3.4Å; Y454-G457 PolarHBondContact O-N 3.33Å; G457-E459 VanDerWaalsContact C-N 3.34Å; G457-E459 PolarHBondContact O-N 3.38Å; G457-C460 WeakPolarHBondContact O-CB 3.44Å; G457-C460 PolarHBondContact O-N 3.16Å; G457-Y461 WeakPolarHBondContact O-CD2 3.31Å; G457-Y461 PolarHBondContact O-N 3.18Å
458	K	90.3	Very high	91	Very high	146 Å²	146	79.3 Å²	79.3	64%	0.635	38%	0.38	S	S	*	.	H	α-helix	trans	-62	-39.1	-174.8	-67.1	176.8	-172	169.5	0	113	E455 G456 C460 Y461 R462	E455-K458 WeakPolarHBondContact O-CD 3.45Å; E455-K458 WeakPolarHBondContact O-CG 3.35Å; G456-K458 PolarHBondContact O-N 2.97Å; G456-K458 VanDerWaalsContact O-N 3.15Å; K458-C460 VanDerWaalsContact C-N 3.31Å; K458-C460 PolarHBondContact O-N 3.28Å; K458-Y461 CarbonylContact O-C 3.57Å; K458-Y461 WeakPolarHBondContact O-CB 3.24Å; K458-Y461 PolarHBondContact O-N 3.01Å; K458-Y461 VanDerWaalsContact O-N 3.12Å; K458-R462 PolarHBondContact O-N 3.11Å
459	E	90.1	Very high	91.2	Very high	63 Å²	63	73.4 Å²	73.4	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-66.9	-33.4	179.5	-70.2	-61.1	98.7	0	0	112.1	Y454 G457 Y461 R462 V463	Y454-E459 HydrophobicContact CD1-CG 4.49Å; Y454-E459 HydrophobicContact CE1-CG 4.15Å; G457-E459 VanDerWaalsContact C-N 3.34Å; G457-E459 PolarHBondContact O-N 3.38Å; E459-Y461 VanDerWaalsContact C-N 3.29Å; E459-Y461 PolarHBondContact O-N 3.16Å; E459-R462 WeakPolarHBondContact O-CB 3.38Å; E459-R462 PolarHBondContact O-N 2.81Å; E459-R462 VanDerWaalsContact O-N 3.15Å; E459-R462 IonicContact OE1-NE 3.58Å; E459-R462 PolarHBondContact OE1-NE 3.21Å; E459-R462 IonicContact OE2-CZ 2.83Å; E459-R462 IonicContact OE2-NE 3.08Å; E459-R462 PolarHBondContact OE2-NE 2.88Å; E459-R462 IonicContact OE2-NH2 3.14Å; E459-R462 PolarHBondContact OE2-NH2 3.46Å; E459-V463 WeakPolarHBondContact O-CG2 3.37Å; E459-V463 PolarHBondContact O-N 2.69Å
460	C	91.6	Very high	91.6	Very high	13 Å²	13	74 Å²	74	9%	0.088	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-39.9	171.6	-55.7	0	0	0	0	111.4	F446 F449 Y450 G457 K458 L464	F446-C460 HydrophobicContact CZ-CB 4.26Å; F449-C460 HydrophobicContact CD1-CB 4.26Å; F449-C460 HydrophobicContact CE1-CB 4.06Å; F449-C460 PolarHBondContact O-SG 3.37Å; Y450-C460 HydrophobicContact CD2-CB 4.01Å; G457-C460 WeakPolarHBondContact O-CB 3.44Å; G457-C460 PolarHBondContact O-N 3.16Å; K458-C460 VanDerWaalsContact C-N 3.31Å; K458-C460 PolarHBondContact O-N 3.28Å; C460-L464 PolarHBondContact O-N 3.01Å
461	Y	92.6	Very high	92	Very high	131 Å²	131	70.6 Å²	70.6	51%	0.514	35%	0.352	S	S	.	.	H	α-helix	trans	-72	-29.6	174	-71.9	-68.2	0	0	0	113.5	Y450 G457 K458 E459 L464 N465	Y450-Y461 HydrophobicContact CE2-CD2 4.48Å; Y450-Y461 AromaticContact CE2-CE2 3.77Å; Y450-Y461 HydrophobicContact CE2-CE2 3.77Å; G457-Y461 WeakPolarHBondContact O-CD2 3.31Å; G457-Y461 PolarHBondContact O-N 3.18Å; K458-Y461 CarbonylContact O-C 3.57Å; K458-Y461 WeakPolarHBondContact O-CB 3.24Å; K458-Y461 PolarHBondContact O-N 3.01Å; K458-Y461 VanDerWaalsContact O-N 3.12Å; E459-Y461 VanDerWaalsContact C-N 3.29Å; E459-Y461 PolarHBondContact O-N 3.16Å; Y461-L464 HydrophobicContact CD1-CD2 4.25Å; Y461-L464 PolarHBondContact O-N 3.4Å; Y461-N465 WeakPolarHBondContact O-CB 3.32Å; Y461-N465 PolarHBondContact O-N 3.2Å
462	R	93.1	Very high	92.3	Very high	125 Å²	125	67.8 Å²	67.8	47%	0.472	34%	0.34	S	S	.	.	H	α-helix	trans	-63.9	-47.7	172.4	-172.7	179.4	61.7	69.9	-0.6	110.9	K458 E459 L464 N465 E466	K458-R462 PolarHBondContact O-N 3.11Å; E459-R462 WeakPolarHBondContact O-CB 3.38Å; E459-R462 PolarHBondContact O-N 2.81Å; E459-R462 VanDerWaalsContact O-N 3.15Å; E459-R462 IonicContact OE1-NE 3.58Å; E459-R462 PolarHBondContact OE1-NE 3.21Å; E459-R462 IonicContact OE2-CZ 2.83Å; E459-R462 IonicContact OE2-NE 3.08Å; E459-R462 PolarHBondContact OE2-NE 2.88Å; E459-R462 IonicContact OE2-NH2 3.14Å; E459-R462 PolarHBondContact OE2-NH2 3.46Å; R462-L464 VanDerWaalsContact C-N 3.35Å; R462-N465 PolarHBondContact O-N 3.11Å; R462-E466 IonicContact NH1-OE2 2.75Å; R462-E466 PolarHBondContact O-N 3.48Å
463	V	93	Very high	92.5	Very high	18 Å²	18	66.6 Å²	66.6	11%	0.109	34%	0.335	C	S	.	.	H	α-helix	trans	-61.7	-41.7	175.3	174.4	0	0	0	0	111.2	F449 E459 N465 E466 L467 F531 M535 F540	F449-V463 HydrophobicContact CE1-CB 4.11Å; F449-V463 HydrophobicContact CE1-CG1 4.06Å; F449-V463 HydrophobicContact CZ-CB 4.26Å; F449-V463 HydrophobicContact CZ-CG1 4.07Å; F449-V463 HydrophobicContact CZ-CG2 4.25Å; E459-V463 WeakPolarHBondContact O-CG2 3.37Å; E459-V463 PolarHBondContact O-N 2.69Å; V463-N465 PolarHBondContact O-N 3.14Å; V463-E466 WeakPolarHBondContact O-CB 3.49Å; V463-E466 PolarHBondContact O-N 3.47Å; V463-L467 PolarHBondContact O-N 2.92Å; V463-F531 HydrophobicContact CG1-CE1 4Å; V463-F531 HydrophobicContact CG1-CZ 3.93Å; V463-M535 HydrophobicContact CG1-CE 4.33Å; V463-M535 HydrophobicContact CG1-SD 4.26Å; V463-F540 HydrophobicContact CG1-CE2 3.89Å; V463-F540 HydrophobicContact CG1-CZ 4.13Å
464	L	94.3	Very high	92.9	Very high	14 Å²	14	62 Å²	62	7%	0.073	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-43.8	173.7	-177.5	61	0	0	0	112	I443 F446 C460 Y461 R462 E466 L467 I468 A491	I443-L464 HydrophobicContact CD1-CD1 3.57Å; F446-L464 HydrophobicContact CD2-CD1 4.35Å; F446-L464 HydrophobicContact CE1-CD2 4.29Å; F446-L464 HydrophobicContact CE2-CB 3.8Å; F446-L464 HydrophobicContact CE2-CD1 4.22Å; F446-L464 HydrophobicContact CE2-CD2 4.18Å; F446-L464 HydrophobicContact CE2-CG 4.29Å; F446-L464 HydrophobicContact CZ-CB 4.05Å; F446-L464 HydrophobicContact CZ-CD2 3.92Å; F446-L464 HydrophobicContact CZ-CG 4.46Å; C460-L464 PolarHBondContact O-N 3.01Å; Y461-L464 HydrophobicContact CD1-CD2 4.25Å; Y461-L464 PolarHBondContact O-N 3.4Å; R462-L464 VanDerWaalsContact C-N 3.35Å; L464-E466 VanDerWaalsContact C-N 3.3Å; L464-E466 PolarHBondContact O-N 3.07Å; L464-L467 PolarHBondContact O-N 3.28Å; L464-I468 HydrophobicContact CD1-CG1 4.16Å; L464-I468 HydrophobicContact CG-CG1 4.27Å; L464-I468 WeakPolarHBondContact O-CB 3.2Å; L464-I468 WeakPolarHBondContact O-CG1 3.36Å; L464-I468 PolarHBondContact O-N 3.06Å; L464-A491 HydrophobicContact CD1-CB 4.27Å; L464-A491 HydrophobicContact CD2-CB 4.41Å
465	N	95.3	Very high	93.4	Very high	119 Å²	119	57.1 Å²	57.1	64%	0.636	29%	0.285	S	S	*	.	H	α-helix	trans	-66.3	-32	179.5	-174.5	89	0	0	0	112.5	Y461 R462 V463 G469	Y461-N465 WeakPolarHBondContact O-CB 3.32Å; Y461-N465 PolarHBondContact O-N 3.2Å; R462-N465 PolarHBondContact O-N 3.11Å; V463-N465 PolarHBondContact O-N 3.14Å; N465-G469 PolarHBondContact O-N 2.98Å
466	E	95.9	Very high	93.7	Very high	99 Å²	99	59.2 Å²	59.2	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-54.1	173.1	-158.5	169.4	156.4	0	0	110.3	R462 V463 L464 I468 G469 D470 F531	R462-E466 IonicContact NH1-OE2 2.75Å; R462-E466 PolarHBondContact O-N 3.48Å; V463-E466 WeakPolarHBondContact O-CB 3.49Å; V463-E466 PolarHBondContact O-N 3.47Å; L464-E466 VanDerWaalsContact C-N 3.3Å; L464-E466 PolarHBondContact O-N 3.07Å; E466-I468 PolarHBondContact O-N 3.07Å; E466-G469 CarbonylContact O-C 3.54Å; E466-G469 WeakPolarHBondContact O-CA 3.28Å; E466-G469 PolarHBondContact O-N 3.48Å; E466-D470 PolarHBondContact O-N 2.93Å; E466-F531 HydrophobicContact CB-CE2 4.17Å; E466-F531 HydrophobicContact CB-CZ 4.42Å; E466-F531 HydrophobicContact CG-CE2 4.12Å
467	L	95.9	Very high	94.1	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-37.8	177.8	178.3	57.8	0	0	0	113.5	I443 V463 L464 G469 D470 F471 V527 V528 F531 F540	I443-L467 HydrophobicContact CD1-CD2 3.62Å; I443-L467 HydrophobicContact CG1-CD2 4.48Å; V463-L467 PolarHBondContact O-N 2.92Å; L464-L467 PolarHBondContact O-N 3.28Å; L467-G469 VanDerWaalsContact C-N 3.28Å; L467-G469 PolarHBondContact O-N 2.94Å; L467-D470 PolarHBondContact O-N 3.25Å; L467-F471 HydrophobicContact CD1-CE1 4Å; L467-F471 HydrophobicContact CD1-CE2 4.44Å; L467-F471 HydrophobicContact CD1-CZ 3.87Å; L467-F471 HydrophobicContact CG-CE2 4.15Å; L467-F471 HydrophobicContact CG-CZ 4.02Å; L467-F471 WeakPolarHBondContact O-CG 3.41Å; L467-F471 PolarHBondContact O-N 3.13Å; L467-V527 HydrophobicContact CD1-CG1 4.25Å; L467-V528 HydrophobicContact CD1-CG2 4Å; L467-V528 HydrophobicContact CD2-CG2 4.34Å; L467-F531 HydrophobicContact CB-CD2 4.15Å; L467-F531 HydrophobicContact CB-CE1 4.4Å; L467-F531 HydrophobicContact CB-CE2 3.91Å; L467-F531 HydrophobicContact CB-CZ 4.04Å; L467-F531 HydrophobicContact CD1-CB 4.03Å; L467-F531 HydrophobicContact CD1-CD1 4.43Å; L467-F531 HydrophobicContact CD1-CD2 3.97Å; L467-F531 HydrophobicContact CD1-CG 3.89Å; L467-F540 HydrophobicContact CD2-CD2 4.4Å
468	I	96.5	Very high	94.1	Very high	17 Å²	17	67 Å²	67	9%	0.087	32%	0.322	C	S	.	.	H	α-helix	trans	-66.6	-33.2	172.8	-64.6	-73.4	0	0	0	110.9	L464 E466 F471 D472 T488 Y493	L464-I468 HydrophobicContact CD1-CG1 4.16Å; L464-I468 HydrophobicContact CG-CG1 4.27Å; L464-I468 WeakPolarHBondContact O-CB 3.2Å; L464-I468 WeakPolarHBondContact O-CG1 3.36Å; L464-I468 PolarHBondContact O-N 3.06Å; E466-I468 PolarHBondContact O-N 3.07Å; I468-F471 HydrophobicContact CD1-CD2 4.19Å; I468-F471 HydrophobicContact CD1-CE2 4.48Å; I468-F471 PolarHBondContact O-N 3.46Å; I468-D472 PolarHBondContact O-N 2.9Å; I468-T488 HydrophobicContact CD1-CG2 4.06Å; I468-T488 HydrophobicContact CG2-CG2 4.04Å; I468-Y493 HydrophobicContact CD1-CD2 3.85Å; I468-Y493 HydrophobicContact CG2-CD2 4.38Å; I468-Y493 HydrophobicContact CG2-CE2 4.3Å
469	G	96.4	Very high	94.1	Very high	26 Å²	26	63.3 Å²	63.3	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-39.1	173.6	0	0	0	0	0	112.8	N465 E466 L467 D472 E473	N465-G469 PolarHBondContact O-N 2.98Å; E466-G469 CarbonylContact O-C 3.54Å; E466-G469 WeakPolarHBondContact O-CA 3.28Å; E466-G469 PolarHBondContact O-N 3.48Å; L467-G469 VanDerWaalsContact C-N 3.28Å; L467-G469 PolarHBondContact O-N 2.94Å; G469-D472 CarbonylContact O-C 3.54Å; G469-D472 PolarHBondContact O-N 2.74Å; G469-E473 PolarHBondContact O-N 3.35Å
470	D	96.8	Very high	94.2	Very high	61 Å²	61	61 Å²	61	33%	0.326	31%	0.307	S	S	.	.	H	α-helix	trans	-66.2	-38.6	174.9	-64.4	-26.3	0	0	0	111.8	E466 L467 E473 L474 V527 F531	E466-D470 PolarHBondContact O-N 2.93Å; L467-D470 PolarHBondContact O-N 3.25Å; D470-E473 WeakPolarHBondContact O-CB 3.38Å; D470-E473 PolarHBondContact O-N 3.27Å; D470-L474 PolarHBondContact O-N 3Å; D470-V527 HydrophobicContact CB-CG1 3.62Å; D470-F531 WeakPolarHBondContact OD2-CD2 3.46Å
471	F	97.5	Very high	94	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.009	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-38.8	170.7	-60.4	-29	0	0	0	112.5	L467 I468 E473 L474 Y493 M524 V527 V528 L542	L467-F471 HydrophobicContact CD1-CE1 4Å; L467-F471 HydrophobicContact CD1-CE2 4.44Å; L467-F471 HydrophobicContact CD1-CZ 3.87Å; L467-F471 HydrophobicContact CG-CE2 4.15Å; L467-F471 HydrophobicContact CG-CZ 4.02Å; L467-F471 WeakPolarHBondContact O-CG 3.41Å; L467-F471 PolarHBondContact O-N 3.13Å; I468-F471 HydrophobicContact CD1-CD2 4.19Å; I468-F471 HydrophobicContact CD1-CE2 4.48Å; I468-F471 PolarHBondContact O-N 3.46Å; F471-E473 VanDerWaalsContact C-N 3.26Å; F471-E473 PolarHBondContact O-N 2.94Å; F471-L474 WeakPolarHBondContact O-CB 3.4Å; F471-L474 PolarHBondContact O-N 3.31Å; F471-Y493 HydrophobicContact CB-CD2 4.25Å; F471-Y493 HydrophobicContact CB-CE2 3.82Å; F471-Y493 AromaticContact CD2-CD2 3.93Å; F471-Y493 HydrophobicContact CD2-CD2 3.93Å; F471-Y493 HydrophobicContact CD2-CE2 4.36Å; F471-Y493 HydrophobicContact CD2-CG 4.3Å; F471-M524 HydrophobicContact CB-CE 4.27Å; F471-M524 HydrophobicContact CD1-CB 4.26Å; F471-M524 HydrophobicContact CD1-CE 3.87Å; F471-M524 HydrophobicContact CD1-CG 3.96Å; F471-M524 HydrophobicContact CD2-CE 3.55Å; F471-M524 HydrophobicContact CE1-CB 4.03Å; F471-M524 HydrophobicContact CE1-CE 4.01Å; F471-M524 HydrophobicContact CE1-CG 4.22Å; F471-M524 HydrophobicContact CE2-CE 3.7Å; F471-M524 HydrophobicContact CG-CE 3.65Å; F471-M524 HydrophobicContact CG-CG 4.48Å; F471-M524 HydrophobicContact CZ-CE 3.93Å; F471-V527 HydrophobicContact CD1-CB 4.38Å; F471-V527 HydrophobicContact CD1-CG1 3.9Å; F471-V527 HydrophobicContact CE1-CB 4.24Å; F471-V527 HydrophobicContact CE1-CG1 3.87Å; F471-V528 HydrophobicContact CE1-CG2 3.86Å; F471-V528 HydrophobicContact CZ-CG2 3.58Å; F471-L542 HydrophobicContact CZ-CD1 4.4Å; F471-L542 HydrophobicContact CZ-CD2 4.4Å
472	D	95.6	Very high	93.8	Very high	50 Å²	50	58.6 Å²	58.6	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-70.5	-22	175.2	-71.4	-8.5	0	0	0	112.6	I468 G469 K485 Y493	I468-D472 PolarHBondContact O-N 2.9Å; G469-D472 CarbonylContact O-C 3.54Å; G469-D472 PolarHBondContact O-N 2.74Å; D472-K485 WeakPolarHBondContact OD1-CD 3.24Å; D472-K485 WeakPolarHBondContact OD1-CE 3.38Å; D472-K485 IonicContact OD1-NZ 3.61Å; D472-K485 PolarHBondContact OD1-NZ 3.45Å; D472-K485 IonicContact OD2-NZ 2.74Å; D472-K485 PolarHBondContact OD2-NZ 3.43Å; D472-Y493 VanDerWaalsContact OD1-CE2 3.27Å; D472-Y493 WeakPolarHBondContact OD1-CE2 3.24Å; D472-Y493 PolarHBondContact OD1-OH 3.48Å
473	E	96.3	Very high	93.8	Very high	108 Å²	108	53.1 Å²	53.1	51%	0.505	29%	0.291	S	S	.	.	H	α-helix	trans	-71.7	-36.5	170.4	-173.7	142.8	155.5	0	0	112.4	G469 D470 F471 L475 R476	G469-E473 PolarHBondContact O-N 3.35Å; D470-E473 WeakPolarHBondContact O-CB 3.38Å; D470-E473 PolarHBondContact O-N 3.27Å; F471-E473 VanDerWaalsContact C-N 3.26Å; F471-E473 PolarHBondContact O-N 2.94Å; E473-L475 VanDerWaalsContact C-N 3.25Å; E473-L475 PolarHBondContact O-N 3.27Å; E473-R476 WeakPolarHBondContact O-CB 3.45Å; E473-R476 PolarHBondContact O-N 3.29Å; E473-R476 IonicContact OE1-NH1 2.71Å; E473-R476 IonicContact OE2-CZ 3.91Å; E473-R476 IonicContact OE2-NH1 2.63Å; E473-R476 PolarHBondContact OE2-NH1 3.2Å; E473-R476 IonicContact OE2-NH2 2.77Å; E473-R476 PolarHBondContact OE2-NH2 2.9Å
474	L	96.3	Very high	93.9	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-55.6	-41.2	173.2	-66.6	178.6	0	0	0	111.6	D470 F471 R476 K477 F480 F520 E523 M524 V527	D470-L474 PolarHBondContact O-N 3Å; F471-L474 WeakPolarHBondContact O-CB 3.4Å; F471-L474 PolarHBondContact O-N 3.31Å; L474-R476 PolarHBondContact O-N 3.45Å; L474-R476 VanDerWaalsContact O-N 3.13Å; L474-K477 HydrophobicContact CD2-CD 4.16Å; L474-K477 VanDerWaalsContact O-CB 3.28Å; L474-K477 WeakPolarHBondContact O-CB 3.3Å; L474-K477 WeakPolarHBondContact O-CG 3.39Å; L474-K477 PolarHBondContact O-N 3.03Å; L474-F480 WeakPolarHBondContact O-CD2 3.13Å; L474-F520 HydrophobicContact CB-CD2 4.08Å; L474-F520 HydrophobicContact CB-CE2 3.57Å; L474-F520 HydrophobicContact CD1-CD2 4.46Å; L474-F520 HydrophobicContact CD1-CE2 4.19Å; L474-E523 HydrophobicContact CD1-CB 4.04Å; L474-E523 HydrophobicContact CD2-CB 4.25Å; L474-M524 HydrophobicContact CD1-CG 3.97Å; L474-V527 HydrophobicContact CD1-CG2 3.92Å; L474-V527 HydrophobicContact CD2-CG2 3.96Å; L474-V527 HydrophobicContact CG-CG2 4.11Å
475	L	93.6	Very high	94	Very high	36 Å²	36	56.6 Å²	56.6	19%	0.188	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.6	178.7	-65.7	178	0	0	0	114.2	E473 K477 I483 K485 Y493 F520	E473-L475 VanDerWaalsContact C-N 3.25Å; E473-L475 PolarHBondContact O-N 3.27Å; L475-K477 VanDerWaalsContact C-N 3.31Å; L475-I483 HydrophobicContact CD2-CB 3.77Å; L475-I483 HydrophobicContact CD2-CG2 3.64Å; L475-K485 HydrophobicContact CD1-CB 3.85Å; L475-Y493 VanDerWaalsContact CD1-OH 3.27Å; L475-Y493 WeakPolarHBondContact CD1-OH 3.35Å; L475-F520 HydrophobicContact CD2-CD2 4.2Å; L475-F520 HydrophobicContact CD2-CE2 3.45Å; L475-F520 VanDerWaalsContact CD2-CE2 3.45Å; L475-F520 HydrophobicContact CD2-CZ 3.65Å; L475-F520 HydrophobicContact CG-CE2 3.87Å; L475-F520 HydrophobicContact CG-CZ 4.01Å
476	R	91.3	Very high	94	Very high	164 Å²	164	51.8 Å²	51.8	62%	0.619	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-14.1	175.2	-50.4	-176.2	-146	131.7	14.3	112.6	E473 L474	E473-R476 WeakPolarHBondContact O-CB 3.45Å; E473-R476 PolarHBondContact O-N 3.29Å; E473-R476 IonicContact OE1-NH1 2.71Å; E473-R476 IonicContact OE2-CZ 3.91Å; E473-R476 IonicContact OE2-NH1 2.63Å; E473-R476 PolarHBondContact OE2-NH1 3.2Å; E473-R476 IonicContact OE2-NH2 2.77Å; E473-R476 PolarHBondContact OE2-NH2 2.9Å; L474-R476 PolarHBondContact O-N 3.45Å; L474-R476 VanDerWaalsContact O-N 3.13Å
477	K	94	Very high	93.9	Very high	83 Å²	83	50 Å²	50	36%	0.361	27%	0.27	S	S	.	.	S	Bend	trans	-68.1	134.3	175.7	-65.3	173	170.8	173.2	0	109.2	L474 L475 A479 F480 E523	L474-K477 HydrophobicContact CD2-CD 4.16Å; L474-K477 VanDerWaalsContact O-CB 3.28Å; L474-K477 WeakPolarHBondContact O-CB 3.3Å; L474-K477 WeakPolarHBondContact O-CG 3.39Å; L474-K477 PolarHBondContact O-N 3.03Å; L475-K477 VanDerWaalsContact C-N 3.31Å; K477-A479 PolarHBondContact O-N 3.09Å; K477-A479 VanDerWaalsContact O-N 3.11Å; K477-F480 HydrophobicContact CB-CD2 3.95Å; K477-F480 HydrophobicContact CD-CD2 3.96Å; K477-F480 HydrophobicContact CD-CE2 3.87Å; K477-F480 PolarHBondContact O-N 3.07Å; K477-E523 IonicContact NZ-OE2 2.74Å; K477-E523 PolarHBondContact NZ-OE2 2.92Å
478	P	90	Very high	93.8	Very high	123 Å²	123	53.2 Å²	53.2	80%	0.799	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-61.9	-25.6	-176.5	24.1	-34.3	0	0	0	113.8	F480 A481	P478-F480 PolarHBondContact O-N 3.33Å; P478-A481 WeakPolarHBondContact O-CB 3.5Å; P478-A481 PolarHBondContact O-N 3.39Å
479	A	89.4	Confident	93.7	Very high	69 Å²	69	55.7 Å²	55.7	57%	0.57	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-66.3	-19.4	174.5	0	0	0	0	0	114	K477	K477-A479 PolarHBondContact O-N 3.09Å; K477-A479 VanDerWaalsContact O-N 3.11Å
480	F	92.9	Very high	93.5	Very high	14 Å²	14	57.4 Å²	57.4	6%	0.061	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-113.7	11.3	-177.4	-58.8	-44.3	0	0	0	112.9	L474 K477 P478 N482 I483 A516 E519 F520 E523	L474-F480 WeakPolarHBondContact O-CD2 3.13Å; K477-F480 HydrophobicContact CB-CD2 3.95Å; K477-F480 HydrophobicContact CD-CD2 3.96Å; K477-F480 HydrophobicContact CD-CE2 3.87Å; K477-F480 PolarHBondContact O-N 3.07Å; P478-F480 PolarHBondContact O-N 3.33Å; F480-N482 PolarHBondContact O-N 2.98Å; F480-I483 HydrophobicContact CB-CD1 3.95Å; F480-I483 HydrophobicContact CB-CG1 4.4Å; F480-I483 HydrophobicContact CD1-CD1 3.72Å; F480-I483 HydrophobicContact CG-CD1 4.13Å; F480-I483 WeakPolarHBondContact O-CB 3.02Å; F480-I483 PolarHBondContact O-N 3.35Å; F480-A516 WeakPolarHBondContact CE1-O 3.47Å; F480-E519 HydrophobicContact CE1-CB 4.07Å; F480-E519 HydrophobicContact CZ-CB 4.42Å; F480-F520 HydrophobicContact CB-CD2 4.33Å; F480-F520 HydrophobicContact CD1-CB 3.92Å; F480-F520 HydrophobicContact CD1-CD2 4.32Å; F480-F520 HydrophobicContact CD2-CD2 4Å; F480-F520 HydrophobicContact CE1-CB 3.88Å; F480-F520 HydrophobicContact CE2-CD2 4.42Å; F480-F520 HydrophobicContact CG-CB 4.42Å; F480-F520 AromaticContact CG-CD2 3.96Å; F480-F520 HydrophobicContact CG-CD2 3.96Å; F480-F520 HydrophobicContact CZ-CB 4.33Å; F480-E523 HydrophobicContact CE2-CG 4.12Å; F480-E523 HydrophobicContact CZ-CG 3.93Å
481	A	86.8	Confident	93.3	Very high	59 Å²	59	55.4 Å²	55.4	49%	0.488	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-2.2	-177.9	0	0	0	0	0	115.3	P478	P478-A481 WeakPolarHBondContact O-CB 3.5Å; P478-A481 PolarHBondContact O-N 3.39Å
482	N	88.5	Confident	93.3	Very high	36 Å²	36	56.6 Å²	56.6	19%	0.193	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	4.5	173.4	65.3	-4.1	0	0	0	113.1	F480	F480-N482 PolarHBondContact O-N 2.98Å
483	I	94.3	Very high	93.4	Very high	10 Å²	10	54.2 Å²	54.2	5%	0.051	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.8	176.8	-54.2	-177.7	0	0	0	108.5	L475 F480 A495 A497 L517 F520	L475-I483 HydrophobicContact CD2-CB 3.77Å; L475-I483 HydrophobicContact CD2-CG2 3.64Å; F480-I483 HydrophobicContact CB-CD1 3.95Å; F480-I483 HydrophobicContact CB-CG1 4.4Å; F480-I483 HydrophobicContact CD1-CD1 3.72Å; F480-I483 HydrophobicContact CG-CD1 4.13Å; F480-I483 WeakPolarHBondContact O-CB 3.02Å; F480-I483 PolarHBondContact O-N 3.35Å; I483-A495 HydrophobicContact CG2-CB 4.08Å; I483-A497 HydrophobicContact CG1-CB 4.24Å; I483-L517 HydrophobicContact CD1-CD1 4.22Å; I483-L517 HydrophobicContact CG1-CD1 4.41Å; I483-L517 HydrophobicContact CG2-CD1 3.84Å; I483-F520 HydrophobicContact CD1-CB 3.31Å; I483-F520 HydrophobicContact CD1-CD1 4.18Å; I483-F520 HydrophobicContact CD1-CD2 3.9Å; I483-F520 HydrophobicContact CD1-CG 3.55Å; I483-F520 HydrophobicContact CG2-CD1 4.48Å
484	E	94.7	Very high	93.5	Very high	41 Å²	41	49.3 Å²	49.3	19%	0.192	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.8	179.3	-61.2	-81.9	-164.1	0	0	108.8	H418 I486 A495 A496 L499	H418-E484 IonicContact CE1-OE1 3.66Å; H418-E484 PolarHBondContact CE1-OE1 3.22Å; H418-E484 VanDerWaalsContact CE1-OE1 3.29Å; H418-E484 IonicContact ND1-OE1 2.63Å; H418-E484 PolarHBondContact ND1-OE1 2.9Å; E484-I486 PolarHBondContact O-N 3.46Å; E484-A495 WeakPolarHBondContact O-CA 3.47Å; E484-A496 PolarHBondContact N-O 3.13Å; E484-A496 PolarHBondContact O-N 2.94Å; E484-L499 HydrophobicContact CB-CD1 4.03Å; E484-L499 HydrophobicContact CG-CB 4.45Å; E484-L499 HydrophobicContact CG-CD1 4.29Å
485	K	95.5	Very high	93.6	Very high	64 Å²	64	49 Å²	49	28%	0.278	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	125.3	167	-176.9	-177.7	-171.3	168	0	108.5	D472 L475 Y493	D472-K485 WeakPolarHBondContact OD1-CD 3.24Å; D472-K485 WeakPolarHBondContact OD1-CE 3.38Å; D472-K485 IonicContact OD1-NZ 3.61Å; D472-K485 PolarHBondContact OD1-NZ 3.45Å; D472-K485 IonicContact OD2-NZ 2.74Å; D472-K485 PolarHBondContact OD2-NZ 3.43Å; L475-K485 HydrophobicContact CD1-CB 3.85Å; K485-Y493 HydrophobicContact CD-CE2 4.11Å; K485-Y493 HydrophobicContact CG-CE1 4.34Å; K485-Y493 HydrophobicContact CG-CE2 4.42Å
486	I	95.6	Very high	93.8	Very high	17 Å²	17	47.2 Å²	47.2	9%	0.087	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-57.3	177.6	-53.6	-56.9	0	0	0	109.9	E484 M494 A496 L499 Y563 I565	E484-I486 PolarHBondContact O-N 3.46Å; I486-M494 HydrophobicContact CB-CB 4.49Å; I486-M494 HydrophobicContact CB-CE 4.23Å; I486-M494 HydrophobicContact CB-CG 4.03Å; I486-M494 HydrophobicContact CB-SD 4.06Å; I486-M494 HydrophobicContact CG1-CE 4.25Å; I486-M494 HydrophobicContact CG1-CG 4.34Å; I486-M494 HydrophobicContact CG2-CE 3.99Å; I486-M494 HydrophobicContact CG2-SD 3.95Å; I486-M494 PolarHBondContact N-O 3.38Å; I486-A496 HydrophobicContact CD1-CB 4.16Å; I486-A496 HydrophobicContact CG1-CB 4.22Å; I486-L499 HydrophobicContact CD1-CD1 3.9Å; I486-Y563 HydrophobicContact CD1-CE1 3.9Å; I486-I565 HydrophobicContact CD1-CD1 3.98Å; I486-I565 HydrophobicContact CD1-CG1 4.27Å; I486-I565 HydrophobicContact CD1-CG2 4.17Å; I486-I565 HydrophobicContact CG1-CD1 3.85Å; I486-I565 HydrophobicContact CG1-CG1 4.19Å; I486-I565 HydrophobicContact CG2-CG1 4.27Å
487	K	94.6	Very high	94	Very high	62 Å²	62	39.4 Å²	39.4	27%	0.27	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	172.2	179	69.8	-168.5	82.5	165.9	0	111.2	I489 M494 D564	K487-I489 HydrophobicContact CD-CD1 3.95Å; K487-I489 HydrophobicContact CD-CG1 3.83Å; K487-I489 HydrophobicContact CG-CD1 4.2Å; K487-I489 HydrophobicContact CG-CG1 3.76Å; K487-M494 HydrophobicContact CD-SD 4.46Å; K487-M494 HydrophobicContact CG-CB 4.4Å; K487-M494 HydrophobicContact CG-SD 4.2Å; K487-M494 PolarHBondContact N-O 2.99Å; K487-M494 WeakPolarHBondContact O-CB 3.18Å; K487-M494 PolarHBondContact O-N 2.92Å; K487-D564 WeakPolarHBondContact CE-OD1 3.42Å; K487-D564 IonicContact NZ-OD1 3.7Å; K487-D564 PolarHBondContact NZ-OD1 2.91Å; K487-D564 IonicContact NZ-OD2 3.86Å; K487-D564 PolarHBondContact NZ-OD2 3.39Å
488	T	94.2	Very high	93.9	Very high	69 Å²	69	35.8 Å²	35.8	42%	0.423	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	143.8	160	50.6	0	0	0	0	109.7	I468 T492 Y493	I468-T488 HydrophobicContact CD1-CG2 4.06Å; I468-T488 HydrophobicContact CG2-CG2 4.04Å; T488-T492 CarbonylContact C-O 3.58Å; T488-T492 WeakPolarHBondContact CA-O 3.36Å; T488-Y493 HydrophobicContact CG2-CD2 4Å
489	I	93.4	Very high	94	Very high	69 Å²	69	29.9 Å²	29.9	35%	0.354	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	92.6	179.6	-46.8	178.5	0	0	0	107.6	F440 K487 A491 T492	F440-I489 HydrophobicContact CE1-CD1 4.44Å; K487-I489 HydrophobicContact CD-CD1 3.95Å; K487-I489 HydrophobicContact CD-CG1 3.83Å; K487-I489 HydrophobicContact CG-CD1 4.2Å; K487-I489 HydrophobicContact CG-CG1 3.76Å; I489-A491 PolarHBondContact O-N 3.09Å; I489-T492 PolarHBondContact N-O 2.95Å; I489-T492 VanDerWaalsContact O-CB 3.31Å; I489-T492 WeakPolarHBondContact O-CB 3.2Å; I489-T492 PolarHBondContact O-N 2.95Å; I489-T492 PolarHBondContact O-OG1 2.87Å
490	G	91.9	Very high	93.8	Very high	62 Å²	62	28 Å²	28	64%	0.639	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	-123.7	-168.6	0	0	0	0	0	110.6	T492	G490-T492 VanDerWaalsContact C-N 3.29Å; G490-T492 PolarHBondContact O-N 3.28Å
491	A	93.8	Very high	93.1	Very high	19 Å²	19	30.5 Å²	30.5	16%	0.157	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	18.7	175.5	0	0	0	0	0	114.2	I443 F446 L464 I489	I443-A491 HydrophobicContact CB-CB 4.22Å; I443-A491 PolarHBondContact N-O 3.42Å; I443-A491 VanDerWaalsContact N-O 3.15Å; F446-A491 HydrophobicContact CB-CB 3.94Å; F446-A491 HydrophobicContact CD1-CB 4.08Å; F446-A491 HydrophobicContact CG-CB 3.94Å; L464-A491 HydrophobicContact CD1-CB 4.27Å; L464-A491 HydrophobicContact CD2-CB 4.41Å; I489-A491 PolarHBondContact O-N 3.09Å
492	T	96.9	Very high	92.5	Very high	26 Å²	26	34.3 Å²	34.3	16%	0.16	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.6	176.8	-45.5	0	0	0	0	110.9	F440 A441 S442 T488 I489 G490	F440-T492 HydrophobicContact CB-CG2 4.34Å; F440-T492 HydrophobicContact CD1-CG2 3.99Å; A441-T492 CarbonylContact O-C 3.45Å; A441-T492 WeakPolarHBondContact O-CA 3.47Å; S442-T492 WeakPolarHBondContact OG-CG2 3.45Å; S442-T492 PolarHBondContact OG-OG1 3.44Å; T488-T492 CarbonylContact C-O 3.58Å; T488-T492 WeakPolarHBondContact CA-O 3.36Å; I489-T492 PolarHBondContact N-O 2.95Å; I489-T492 VanDerWaalsContact O-CB 3.31Å; I489-T492 WeakPolarHBondContact O-CB 3.2Å; I489-T492 PolarHBondContact O-N 2.95Å; I489-T492 PolarHBondContact O-OG1 2.87Å; G490-T492 VanDerWaalsContact C-N 3.29Å; G490-T492 PolarHBondContact O-N 3.28Å
493	Y	98.2	Very high	91.7	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.3	172.7	-163.9	-87	0	0	0	110.1	A441 I468 F471 D472 L475 K485 T488 A495 F520 M524	A441-Y493 PolarHBondContact N-O 3.02Å; A441-Y493 PolarHBondContact O-N 3.41Å; I468-Y493 HydrophobicContact CD1-CD2 3.85Å; I468-Y493 HydrophobicContact CG2-CD2 4.38Å; I468-Y493 HydrophobicContact CG2-CE2 4.3Å; F471-Y493 HydrophobicContact CB-CD2 4.25Å; F471-Y493 HydrophobicContact CB-CE2 3.82Å; F471-Y493 AromaticContact CD2-CD2 3.93Å; F471-Y493 HydrophobicContact CD2-CD2 3.93Å; F471-Y493 HydrophobicContact CD2-CE2 4.36Å; F471-Y493 HydrophobicContact CD2-CG 4.3Å; D472-Y493 VanDerWaalsContact OD1-CE2 3.27Å; D472-Y493 WeakPolarHBondContact OD1-CE2 3.24Å; D472-Y493 PolarHBondContact OD1-OH 3.48Å; L475-Y493 VanDerWaalsContact CD1-OH 3.27Å; L475-Y493 WeakPolarHBondContact CD1-OH 3.35Å; K485-Y493 HydrophobicContact CD-CE2 4.11Å; K485-Y493 HydrophobicContact CG-CE1 4.34Å; K485-Y493 HydrophobicContact CG-CE2 4.42Å; T488-Y493 HydrophobicContact CG2-CD2 4Å; Y493-A495 HydrophobicContact CD1-CB 4.35Å; Y493-A495 HydrophobicContact CE1-CB 4.02Å; Y493-F520 HydrophobicContact CE1-CE1 4.28Å; Y493-F520 HydrophobicContact CE1-CZ 4.22Å; Y493-M524 HydrophobicContact CD1-CE 3.82Å; Y493-M524 HydrophobicContact CE1-CE 4.44Å; Y493-M524 HydrophobicContact CG-CE 3.96Å
494	M	98.1	Very high	90.5	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.02	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.4	-179.7	-176.3	-173.6	173	0	0	110.5	V438 F440 I486 K487 I565 V570	V438-M494 HydrophobicContact CG1-CE 4.43Å; F440-M494 HydrophobicContact CD1-CB 4.5Å; F440-M494 HydrophobicContact CD1-CG 4.4Å; F440-M494 HydrophobicContact CE1-CB 4.38Å; F440-M494 HydrophobicContact CE1-CG 3.99Å; F440-M494 HydrophobicContact CE1-SD 3.84Å; F440-M494 HydrophobicContact CE2-CE 4.17Å; F440-M494 HydrophobicContact CE2-CG 4.26Å; F440-M494 HydrophobicContact CE2-SD 4.4Å; F440-M494 HydrophobicContact CZ-CE 3.75Å; F440-M494 HydrophobicContact CZ-CG 3.91Å; F440-M494 HydrophobicContact CZ-SD 3.62Å; I486-M494 HydrophobicContact CB-CB 4.49Å; I486-M494 HydrophobicContact CB-CE 4.23Å; I486-M494 HydrophobicContact CB-CG 4.03Å; I486-M494 HydrophobicContact CB-SD 4.06Å; I486-M494 HydrophobicContact CG1-CE 4.25Å; I486-M494 HydrophobicContact CG1-CG 4.34Å; I486-M494 HydrophobicContact CG2-CE 3.99Å; I486-M494 HydrophobicContact CG2-SD 3.95Å; I486-M494 PolarHBondContact N-O 3.38Å; K487-M494 HydrophobicContact CD-SD 4.46Å; K487-M494 HydrophobicContact CG-CB 4.4Å; K487-M494 HydrophobicContact CG-SD 4.2Å; K487-M494 PolarHBondContact N-O 2.99Å; K487-M494 WeakPolarHBondContact O-CB 3.18Å; K487-M494 PolarHBondContact O-N 2.92Å; M494-I565 HydrophobicContact CE-CD1 3.79Å; M494-I565 HydrophobicContact CE-CG1 3.58Å; M494-V570 HydrophobicContact CE-CG1 3.69Å
495	A	97.8	Very high	89.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	157.2	179	0	0	0	0	0	111.5	I439 I483 E484 Y493 F520	I439-A495 HydrophobicContact CD1-CB 4.28Å; I439-A495 HydrophobicContact CG1-CB 4.01Å; I439-A495 PolarHBondContact N-O 3.16Å; I439-A495 PolarHBondContact O-N 3Å; I483-A495 HydrophobicContact CG2-CB 4.08Å; E484-A495 WeakPolarHBondContact O-CA 3.47Å; Y493-A495 HydrophobicContact CD1-CB 4.35Å; Y493-A495 HydrophobicContact CE1-CB 4.02Å; A495-F520 HydrophobicContact CB-CE1 4.41Å
496	A	97.4	Very high	88.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	155.3	178.5	0	0	0	0	0	111.9	V436 G437 V438 E484 I486 L499 I565	V436-A496 HydrophobicContact CG1-CB 4.12Å; G437-A496 CarbonylContact O-C 3.51Å; G437-A496 WeakPolarHBondContact O-CA 3.26Å; G437-A496 VanDerWaalsContact O-CB 3.31Å; G437-A496 WeakPolarHBondContact O-CB 3.46Å; V438-A496 HydrophobicContact CG2-CB 4.19Å; E484-A496 PolarHBondContact N-O 3.13Å; E484-A496 PolarHBondContact O-N 2.94Å; I486-A496 HydrophobicContact CD1-CB 4.16Å; I486-A496 HydrophobicContact CG1-CB 4.22Å; A496-L499 HydrophobicContact CB-CD1 3.82Å; A496-I565 HydrophobicContact CB-CD1 3.78Å
497	A	95.6	Very high	87.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	144	177.4	0	0	0	0	0	110.5	V436 G437 I483 H513 L517	V436-A497 WeakPolarHBondContact CA-O 3.37Å; V436-A497 WeakPolarHBondContact CG1-O 3.41Å; G437-A497 PolarHBondContact N-O 3.5Å; G437-A497 PolarHBondContact O-N 3.35Å; I483-A497 HydrophobicContact CG1-CB 4.24Å; A497-H513 HydrophobicContact CB-CB 4.18Å; A497-H513 WeakPolarHBondContact CB-O 3.38Å; A497-H513 PolarHBondContact O-CD2 3.09Å; A497-H513 VanDerWaalsContact O-CD2 3.3Å; A497-L517 HydrophobicContact CB-CB 3.83Å; A497-L517 HydrophobicContact CB-CD1 4.22Å; A497-L517 HydrophobicContact CB-CD2 4.14Å; A497-L517 HydrophobicContact CB-CG 4.3Å
498	G	92.4	Very high	86.2	Confident	6 Å²	6	46.8 Å²	46.8	6%	0.062	29%	0.292	C	S	.	.	S	Bend	trans	104.7	2.9	-171.9	0	0	0	0	0	114.7
499	L	92	Very high	85.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	29%	0.293	C	S	.	.			trans	-76.2	-35.6	180	-66.8	165.4	0	0	0	112.3	H433 V436 E484 I486 A496 T501 L551 A553 Y563 I565	H433-L499 PolarHBondContact CE1-O 3.32Å; V436-L499 HydrophobicContact CG1-CD2 4.04Å; V436-L499 HydrophobicContact CG1-CG 4.02Å; V436-L499 HydrophobicContact CG2-CD2 4.3Å; E484-L499 HydrophobicContact CB-CD1 4.03Å; E484-L499 HydrophobicContact CG-CB 4.45Å; E484-L499 HydrophobicContact CG-CD1 4.29Å; I486-L499 HydrophobicContact CD1-CD1 3.9Å; A496-L499 HydrophobicContact CB-CD1 3.82Å; L499-T501 PolarHBondContact O-N 3.07Å; L499-T501 VanDerWaalsContact O-N 3.11Å; L499-L551 HydrophobicContact CD2-CD1 4.04Å; L499-A553 HydrophobicContact CD2-CB 4.14Å; L499-Y563 WeakPolarHBondContact CD1-OH 3.36Å; L499-I565 HydrophobicContact CD1-CG2 4.4Å; L499-I565 HydrophobicContact CD2-CG2 4.08Å
500	N	85.8	Confident	84.8	Confident	28 Å²	28	49.4 Å²	49.4	15%	0.15	31%	0.306	C	S	.	.			trans	-81.2	93.2	175.1	-170.7	-13.3	0	0	0	111.8	Q502 Q503 C504	N500-Q502 PolarHBondContact O-N 3.39Å; N500-Q502 VanDerWaalsContact O-N 3.15Å; N500-Q502 PolarHBondContact OD1-N 2.94Å; N500-Q502 VanDerWaalsContact OD1-N 3.16Å; N500-Q503 HydrophobicContact CB-CB 4.23Å; N500-Q503 HydrophobicContact CB-CG 4.45Å; N500-Q503 WeakPolarHBondContact ND2-CG 3.33Å; N500-Q503 PolarHBondContact ND2-OE1 2.9Å; N500-Q503 PolarHBondContact O-N 3.29Å; N500-Q503 PolarHBondContact OD1-N 2.92Å; N500-C504 PolarHBondContact O-N 3.37Å; N500-C504 VanDerWaalsContact O-N 3.08Å; N500-C504 PolarHBondContact O-SG 2.91Å; N500-C504 VanDerWaalsContact O-SG 3.38Å
501	T	77.5	Confident	84.6	Confident	67 Å²	67	48.6 Å²	48.6	41%	0.411	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.1	-178	56.1	0	0	0	0	115	K431 L499 A505	K431-T501 VanDerWaalsContact NZ-CG2 3.27Å; K431-T501 PolarHBondContact NZ-OG1 2.98Å; L499-T501 PolarHBondContact O-N 3.07Å; L499-T501 VanDerWaalsContact O-N 3.11Å; T501-A505 PolarHBondContact O-N 2.77Å
502	Q	73.8	Confident	84.3	Confident	140 Å²	140	50.1 Å²	50.1	65%	0.654	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-52.1	174	-69.6	-174.1	-4.4	0	0	110.3	N500 C504 A505 D506	N500-Q502 PolarHBondContact O-N 3.39Å; N500-Q502 VanDerWaalsContact O-N 3.15Å; N500-Q502 PolarHBondContact OD1-N 2.94Å; N500-Q502 VanDerWaalsContact OD1-N 3.16Å; Q502-C504 PolarHBondContact O-N 3.34Å; Q502-A505 WeakPolarHBondContact O-CB 3.31Å; Q502-A505 PolarHBondContact O-N 3.35Å; Q502-D506 PolarHBondContact O-N 2.71Å
503	Q	72.3	Confident	84.1	Confident	79 Å²	79	49.4 Å²	49.4	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-57.4	-34.2	174.8	-75.6	173.8	-25.7	0	0	112.8	N500 A505 A507	N500-Q503 HydrophobicContact CB-CB 4.23Å; N500-Q503 HydrophobicContact CB-CG 4.45Å; N500-Q503 WeakPolarHBondContact ND2-CG 3.33Å; N500-Q503 PolarHBondContact ND2-OE1 2.9Å; N500-Q503 PolarHBondContact O-N 3.29Å; N500-Q503 PolarHBondContact OD1-N 2.92Å; Q503-A505 VanDerWaalsContact C-N 3.31Å; Q503-A505 PolarHBondContact O-N 3.46Å; Q503-A507 PolarHBondContact O-N 2.73Å
504	C	70.4	Confident	84	Confident	41 Å²	41	49.4 Å²	49.4	28%	0.277	28%	0.284	S	S	.	.	H	α-helix	trans	-71.7	-20.5	174.7	-65.3	0	0	0	0	114.5	N500 Q502	N500-C504 PolarHBondContact O-N 3.37Å; N500-C504 VanDerWaalsContact O-N 3.08Å; N500-C504 PolarHBondContact O-SG 2.91Å; N500-C504 VanDerWaalsContact O-SG 3.38Å; Q502-C504 PolarHBondContact O-N 3.34Å
505	A	70.3	Confident	83.8	Confident	79 Å²	79	54.3 Å²	54.3	65%	0.653	30%	0.302	S	S	*	.	H	α-helix	trans	-82.7	-31.1	175.7	0	0	0	0	0	112.1	T501 Q502 Q503 A507	T501-A505 PolarHBondContact O-N 2.77Å; Q502-A505 WeakPolarHBondContact O-CB 3.31Å; Q502-A505 PolarHBondContact O-N 3.35Å; Q503-A505 VanDerWaalsContact C-N 3.31Å; Q503-A505 PolarHBondContact O-N 3.46Å; A505-A507 VanDerWaalsContact C-N 3.32Å
506	D	72.2	Confident	83.6	Confident	141 Å²	141	54.9 Å²	54.9	75%	0.754	31%	0.307	S	S	*	.	H	α-helix	trans	-81.4	-11.5	177.3	-60.4	-32.5	0	0	0	113	Q502	Q502-D506 PolarHBondContact O-N 2.71Å
507	A	74.3	Confident	83.6	Confident	33 Å²	33	54.9 Å²	54.9	27%	0.273	31%	0.307	S	S	.	.	S	Bend	trans	-74.2	135	-177.7	0	0	0	0	0	112.4	Q503 A505 H509	Q503-A507 PolarHBondContact O-N 2.73Å; A505-A507 VanDerWaalsContact C-N 3.32Å; A507-H509 PolarHBondContact O-N 3.38Å
508	P	72.1	Confident	83.7	Confident	119 Å²	119	54.9 Å²	54.9	77%	0.773	31%	0.307	S	S	*	.	S	Bend	trans	-64.6	-20.2	-178.8	25.6	-36.6	0	0	0	114.7	E512	P508-E512 VanDerWaalsContact CD-OE2 3.24Å; P508-E512 WeakPolarHBondContact CD-OE2 3.41Å; P508-E512 WeakPolarHBondContact CG-OE2 3.28Å
509	H	79.4	Confident	83.9	Confident	98 Å²	98	57.6 Å²	57.6	45%	0.454	32%	0.318	S	S	.	.	S	Bend	trans	-133.1	130.9	176.6	-167.9	-101.4	0	0	0	112	A507 Q511 E512	A507-H509 PolarHBondContact O-N 3.38Å; H509-Q511 PolarHBondContact ND1-N 3.49Å; H509-Q511 PolarHBondContact O-N 3.03Å; H509-E512 HydrophobicContact CB-CB 4.37Å; H509-E512 WeakPolarHBondContact O-CB 3.35Å; H509-E512 PolarHBondContact O-N 3.11Å
510	P	79.9	Confident	84.2	Confident	94 Å²	94	57.6 Å²	57.6	61%	0.61	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.5	-174.8	-27.6	34.9	0	0	0	115.1	H513	P510-H513 PolarHBondContact O-CE1 3.43Å; P510-H513 PolarHBondContact O-ND1 3.46Å; P510-H513 VanDerWaalsContact O-ND1 3.15Å
511	Q	85.8	Confident	84.7	Confident	45 Å²	45	56.3 Å²	56.3	21%	0.21	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	10.5	-177.7	-55.4	-63	-1.9	0	0	114	N435 H509 H513 L514 R515 V594 M598	N435-Q511 PolarHBondContact ND2-NE2 2.97Å; N435-Q511 PolarHBondContact ND2-OE1 3.48Å; H509-Q511 PolarHBondContact ND1-N 3.49Å; H509-Q511 PolarHBondContact O-N 3.03Å; Q511-H513 VanDerWaalsContact C-N 3.27Å; Q511-H513 PolarHBondContact O-N 2.92Å; Q511-L514 HydrophobicContact CB-CD1 4.44Å; Q511-L514 WeakPolarHBondContact O-CB 3.21Å; Q511-L514 PolarHBondContact O-N 3.35Å; Q511-L514 VanDerWaalsContact O-N 3.07Å; Q511-R515 PolarHBondContact O-N 3.34Å; Q511-V594 HydrophobicContact CB-CG1 4.22Å; Q511-V594 HydrophobicContact CG-CG1 4.14Å; Q511-M598 HydrophobicContact CB-CE 3.45Å; Q511-M598 VanDerWaalsContact CB-CE 3.45Å; Q511-M598 HydrophobicContact CG-CE 4.5Å
512	E	89.4	Confident	85.7	Confident	52 Å²	52	53.5 Å²	53.5	24%	0.243	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-32	-177.7	-179.9	154.1	-127.5	0	0	113.5	P508 H509 L514 R515 A516	P508-E512 VanDerWaalsContact CD-OE2 3.24Å; P508-E512 WeakPolarHBondContact CD-OE2 3.41Å; P508-E512 WeakPolarHBondContact CG-OE2 3.28Å; H509-E512 HydrophobicContact CB-CB 4.37Å; H509-E512 WeakPolarHBondContact O-CB 3.35Å; H509-E512 PolarHBondContact O-N 3.11Å; E512-L514 VanDerWaalsContact C-N 3.25Å; E512-L514 PolarHBondContact O-N 2.91Å; E512-R515 WeakPolarHBondContact O-CB 3.49Å; E512-R515 PolarHBondContact O-N 3.14Å; E512-R515 VanDerWaalsContact O-N 3.14Å; E512-R515 IonicContact OE1-CZ 2.64Å; E512-R515 IonicContact OE1-NH2 3.26Å; E512-R515 PolarHBondContact OE1-NH2 3.05Å; E512-A516 PolarHBondContact O-N 3.24Å
513	H	92.4	Very high	86.8	Confident	10 Å²	10	48.7 Å²	48.7	5%	0.046	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-30.1	174.7	65.3	-88.6	0	0	0	112.6	N435 A497 P510 Q511 L517	N435-H513 PolarHBondContact ND2-CE1 3.12Å; A497-H513 HydrophobicContact CB-CB 4.18Å; A497-H513 WeakPolarHBondContact CB-O 3.38Å; A497-H513 PolarHBondContact O-CD2 3.09Å; A497-H513 VanDerWaalsContact O-CD2 3.3Å; P510-H513 PolarHBondContact O-CE1 3.43Å; P510-H513 PolarHBondContact O-ND1 3.46Å; P510-H513 VanDerWaalsContact O-ND1 3.15Å; Q511-H513 VanDerWaalsContact C-N 3.27Å; Q511-H513 PolarHBondContact O-N 2.92Å; H513-L517 WeakPolarHBondContact O-CB 3.27Å; H513-L517 PolarHBondContact O-N 2.85Å
514	L	94.8	Very high	88	Confident	1 Å²	1	45 Å²	45	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-70.3	-39.8	173.2	-58.6	-173.8	0	0	0	111.4	Q511 E512 L517 F518 F546 H548 V594	Q511-L514 HydrophobicContact CB-CD1 4.44Å; Q511-L514 WeakPolarHBondContact O-CB 3.21Å; Q511-L514 PolarHBondContact O-N 3.35Å; Q511-L514 VanDerWaalsContact O-N 3.07Å; E512-L514 VanDerWaalsContact C-N 3.25Å; E512-L514 PolarHBondContact O-N 2.91Å; L514-L517 PolarHBondContact O-N 3.05Å; L514-F518 WeakPolarHBondContact O-CB 3.49Å; L514-F518 PolarHBondContact O-N 2.87Å; L514-F546 HydrophobicContact CB-CZ 4.35Å; L514-F546 HydrophobicContact CD2-CZ 4.38Å; L514-H548 HydrophobicContact CD1-CB 3.94Å; L514-H548 HydrophobicContact CD2-CB 3.64Å; L514-H548 HydrophobicContact CG-CB 4.48Å; L514-V594 HydrophobicContact CD1-CG1 3.95Å
515	R	93.6	Very high	89.3	Confident	107 Å²	107	44.2 Å²	44.2	40%	0.404	25%	0.247	S	C	.	.	H	α-helix	trans	-62.4	-47.4	174	-174.2	170	62	-177.8	-0.9	111.4	Q511 E512 L517 F518 E519 M598 Y600	Q511-R515 PolarHBondContact O-N 3.34Å; E512-R515 WeakPolarHBondContact O-CB 3.49Å; E512-R515 PolarHBondContact O-N 3.14Å; E512-R515 VanDerWaalsContact O-N 3.14Å; E512-R515 IonicContact OE1-CZ 2.64Å; E512-R515 IonicContact OE1-NH2 3.26Å; E512-R515 PolarHBondContact OE1-NH2 3.05Å; R515-L517 VanDerWaalsContact C-N 3.33Å; R515-L517 PolarHBondContact O-N 3.36Å; R515-F518 PolarHBondContact O-N 2.84Å; R515-E519 PolarHBondContact O-N 3.4Å; R515-M598 HydrophobicContact CB-SD 3.81Å; R515-M598 HydrophobicContact CG-SD 4.36Å; R515-Y600 HydrophobicContact CG-CE2 4.33Å
516	A	94.6	Very high	90.5	Very high	13 Å²	13	46.7 Å²	46.7	11%	0.107	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-44.2	176.8	0	0	0	0	0	111.7	F480 E512 F520	F480-A516 WeakPolarHBondContact CE1-O 3.47Å; E512-A516 PolarHBondContact O-N 3.24Å; A516-F520 WeakPolarHBondContact O-CB 3.43Å; A516-F520 PolarHBondContact O-N 3.04Å
517	L	97.1	Very high	91.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.3	-35.5	176.7	-170.8	65.5	0	0	0	113.2	G437 I439 I483 A497 H513 L514 R515 A521 F546	G437-L517 VanDerWaalsContact O-CD2 3.3Å; G437-L517 WeakPolarHBondContact O-CD2 3.43Å; I439-L517 HydrophobicContact CD1-CD1 3.94Å; I439-L517 HydrophobicContact CD1-CG 4.5Å; I439-L517 HydrophobicContact CG1-CD1 4.03Å; I439-L517 HydrophobicContact CG2-CD1 4.41Å; I439-L517 HydrophobicContact CG2-CD2 4.05Å; I439-L517 HydrophobicContact CG2-CG 3.95Å; I483-L517 HydrophobicContact CD1-CD1 4.22Å; I483-L517 HydrophobicContact CG1-CD1 4.41Å; I483-L517 HydrophobicContact CG2-CD1 3.84Å; A497-L517 HydrophobicContact CB-CB 3.83Å; A497-L517 HydrophobicContact CB-CD1 4.22Å; A497-L517 HydrophobicContact CB-CD2 4.14Å; A497-L517 HydrophobicContact CB-CG 4.3Å; H513-L517 WeakPolarHBondContact O-CB 3.27Å; H513-L517 PolarHBondContact O-N 2.85Å; L514-L517 PolarHBondContact O-N 3.05Å; R515-L517 VanDerWaalsContact C-N 3.33Å; R515-L517 PolarHBondContact O-N 3.36Å; L517-A521 PolarHBondContact O-N 3.48Å; L517-F546 HydrophobicContact CB-CE2 4.24Å; L517-F546 HydrophobicContact CD2-CE2 3.95Å; L517-F546 HydrophobicContact CG-CE2 4.08Å
518	F	97.3	Very high	92.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-70.1	-47.2	176.3	-166	-101.7	0	0	0	111.3	L514 R515 F520 A521 L522 F546 V585 V587 L595 Y600 F602 Y621	L514-F518 WeakPolarHBondContact O-CB 3.49Å; L514-F518 PolarHBondContact O-N 2.87Å; R515-F518 PolarHBondContact O-N 2.84Å; F518-F520 VanDerWaalsContact C-N 3.28Å; F518-F520 PolarHBondContact O-N 3.26Å; F518-A521 WeakPolarHBondContact O-CA 3.38Å; F518-A521 WeakPolarHBondContact O-CB 3.44Å; F518-A521 PolarHBondContact O-N 3.39Å; F518-L522 HydrophobicContact CD1-CD1 4.3Å; F518-L522 HydrophobicContact CD1-CG 4.33Å; F518-L522 HydrophobicContact CE1-CD1 4.09Å; F518-L522 HydrophobicContact CE1-CD2 4.06Å; F518-L522 HydrophobicContact CE1-CG 4.25Å; F518-L522 HydrophobicContact CZ-CD2 4.3Å; F518-L522 WeakPolarHBondContact O-CG 3.43Å; F518-L522 PolarHBondContact O-N 2.98Å; F518-F546 HydrophobicContact CB-CE2 4.19Å; F518-F546 HydrophobicContact CD2-CD2 4.04Å; F518-F546 HydrophobicContact CD2-CE2 4.24Å; F518-V585 HydrophobicContact CE2-CB 4.47Å; F518-V585 HydrophobicContact CE2-CG1 3.98Å; F518-V587 HydrophobicContact CE2-CG2 4.13Å; F518-L595 HydrophobicContact CB-CD2 4.06Å; F518-L595 HydrophobicContact CD2-CD1 3.59Å; F518-L595 HydrophobicContact CD2-CD2 4.47Å; F518-L595 HydrophobicContact CE2-CD1 3.85Å; F518-L595 HydrophobicContact CG-CD1 4.07Å; F518-L595 HydrophobicContact CG-CD2 4.14Å; F518-Y600 AromaticContact CD1-CD1 3.93Å; F518-Y600 HydrophobicContact CD1-CD1 3.93Å; F518-Y600 HydrophobicContact CD1-CD2 4.21Å; F518-Y600 AromaticContact CD1-CE1 3.69Å; F518-Y600 HydrophobicContact CD1-CE1 3.69Å; F518-Y600 HydrophobicContact CD1-CE2 4Å; F518-Y600 HydrophobicContact CD1-CG 4.19Å; F518-Y600 AromaticContact CD1-CZ 3.75Å; F518-Y600 AromaticContact CE1-CD1 3.61Å; F518-Y600 HydrophobicContact CE1-CD1 3.61Å; F518-Y600 HydrophobicContact CE1-CD2 4.37Å; F518-Y600 AromaticContact CE1-CE1 3.82Å; F518-Y600 HydrophobicContact CE1-CE1 3.82Å; F518-Y600 AromaticContact CE1-CG 3.92Å; F518-Y600 HydrophobicContact CE1-CG 3.92Å; F518-F602 HydrophobicContact CE2-CE1 4.1Å; F518-F602 HydrophobicContact CE2-CZ 4.32Å; F518-F602 AromaticContact CZ-CE1 3.75Å; F518-F602 HydrophobicContact CZ-CE1 3.75Å; F518-F602 AromaticContact CZ-CZ 3.92Å; F518-F602 HydrophobicContact CZ-CZ 3.92Å; F518-Y621 HydrophobicContact CE1-CD1 4.3Å; F518-Y621 HydrophobicContact CE1-CD2 4.21Å; F518-Y621 HydrophobicContact CE1-CE1 4.47Å; F518-Y621 HydrophobicContact CE1-CE2 4.35Å; F518-Y621 HydrophobicContact CE1-CG 4.19Å; F518-Y621 HydrophobicContact CZ-CD1 4.01Å; F518-Y621 AromaticContact CZ-CD2 3.99Å; F518-Y621 HydrophobicContact CZ-CD2 3.99Å; F518-Y621 AromaticContact CZ-CG 3.68Å; F518-Y621 HydrophobicContact CZ-CG 3.68Å
519	E	96.6	Very high	93.9	Very high	63 Å²	63	38.5 Å²	38.5	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-58.1	-39.2	172.4	-74.6	-60.2	146.8	0	0	112.3	F480 R515 A521 L522 E523 Y600	F480-E519 HydrophobicContact CE1-CB 4.07Å; F480-E519 HydrophobicContact CZ-CB 4.42Å; R515-E519 PolarHBondContact O-N 3.4Å; E519-A521 VanDerWaalsContact C-N 3.34Å; E519-A521 PolarHBondContact O-N 3.44Å; E519-L522 PolarHBondContact O-N 3.37Å; E519-L522 VanDerWaalsContact O-N 3.13Å; E519-E523 WeakPolarHBondContact O-CG 3.37Å; E519-E523 PolarHBondContact O-N 3.37Å; E519-Y600 WeakPolarHBondContact CG-OH 3.33Å; E519-Y600 WeakPolarHBondContact OE1-CE1 3.34Å; E519-Y600 PolarHBondContact OE1-OH 2.92Å
520	F	98.1	Very high	94.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.5	-42.4	172.9	177.9	-97.3	0	0	0	111.9	I439 L474 L475 F480 I483 Y493 A495 A516 F518 L522 E523 M524	I439-F520 HydrophobicContact CD1-CD1 3.8Å; I439-F520 HydrophobicContact CD1-CE1 4.04Å; L474-F520 HydrophobicContact CB-CD2 4.08Å; L474-F520 HydrophobicContact CB-CE2 3.57Å; L474-F520 HydrophobicContact CD1-CD2 4.46Å; L474-F520 HydrophobicContact CD1-CE2 4.19Å; L475-F520 HydrophobicContact CD2-CD2 4.2Å; L475-F520 HydrophobicContact CD2-CE2 3.45Å; L475-F520 VanDerWaalsContact CD2-CE2 3.45Å; L475-F520 HydrophobicContact CD2-CZ 3.65Å; L475-F520 HydrophobicContact CG-CE2 3.87Å; L475-F520 HydrophobicContact CG-CZ 4.01Å; F480-F520 HydrophobicContact CB-CD2 4.33Å; F480-F520 HydrophobicContact CD1-CB 3.92Å; F480-F520 HydrophobicContact CD1-CD2 4.32Å; F480-F520 HydrophobicContact CD2-CD2 4Å; F480-F520 HydrophobicContact CE1-CB 3.88Å; F480-F520 HydrophobicContact CE2-CD2 4.42Å; F480-F520 HydrophobicContact CG-CB 4.42Å; F480-F520 AromaticContact CG-CD2 3.96Å; F480-F520 HydrophobicContact CG-CD2 3.96Å; F480-F520 HydrophobicContact CZ-CB 4.33Å; I483-F520 HydrophobicContact CD1-CB 3.31Å; I483-F520 HydrophobicContact CD1-CD1 4.18Å; I483-F520 HydrophobicContact CD1-CD2 3.9Å; I483-F520 HydrophobicContact CD1-CG 3.55Å; I483-F520 HydrophobicContact CG2-CD1 4.48Å; Y493-F520 HydrophobicContact CE1-CE1 4.28Å; Y493-F520 HydrophobicContact CE1-CZ 4.22Å; A495-F520 HydrophobicContact CB-CE1 4.41Å; A516-F520 WeakPolarHBondContact O-CB 3.43Å; A516-F520 PolarHBondContact O-N 3.04Å; F518-F520 VanDerWaalsContact C-N 3.28Å; F518-F520 PolarHBondContact O-N 3.26Å; F520-L522 VanDerWaalsContact C-N 3.3Å; F520-L522 PolarHBondContact O-N 2.94Å; F520-E523 PolarHBondContact O-N 2.99Å; F520-M524 HydrophobicContact CD1-CG 4.21Å; F520-M524 HydrophobicContact CD1-SD 3.83Å; F520-M524 HydrophobicContact CE1-CG 3.94Å; F520-M524 HydrophobicContact CE1-SD 3.36Å; F520-M524 WeakPolarHBondContact CE1-SD 3.48Å; F520-M524 HydrophobicContact CZ-CG 4.22Å; F520-M524 HydrophobicContact CZ-SD 4.06Å; F520-M524 VanDerWaalsContact O-CG 3.31Å; F520-M524 WeakPolarHBondContact O-CG 3.42Å; F520-M524 PolarHBondContact O-N 3.15Å
521	A	97.8	Very high	95.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63	-34.1	173.4	0	0	0	0	0	112.9	I439 L517 F518 E519 M525 I544	I439-A521 HydrophobicContact CD1-CB 4.37Å; L517-A521 PolarHBondContact O-N 3.48Å; F518-A521 WeakPolarHBondContact O-CA 3.38Å; F518-A521 WeakPolarHBondContact O-CB 3.44Å; F518-A521 PolarHBondContact O-N 3.39Å; E519-A521 VanDerWaalsContact C-N 3.34Å; E519-A521 PolarHBondContact O-N 3.44Å; A521-M525 PolarHBondContact O-N 2.93Å; A521-I544 HydrophobicContact CB-CD1 3.78Å; A521-I544 HydrophobicContact CB-CG2 4.17Å; A521-I544 VanDerWaalsContact O-CD1 3.25Å; A521-I544 WeakPolarHBondContact O-CD1 3.27Å
522	L	96.8	Very high	95.8	Very high	9 Å²	9	33.4 Å²	33.4	5%	0.047	16%	0.157	C	C	.	.	H	α-helix	trans	-70.4	-41.6	173.9	-54.8	-167.9	0	0	0	112	F518 E519 F520 M525 R526 V585 Y600 Y621	F518-L522 HydrophobicContact CD1-CD1 4.3Å; F518-L522 HydrophobicContact CD1-CG 4.33Å; F518-L522 HydrophobicContact CE1-CD1 4.09Å; F518-L522 HydrophobicContact CE1-CD2 4.06Å; F518-L522 HydrophobicContact CE1-CG 4.25Å; F518-L522 HydrophobicContact CZ-CD2 4.3Å; F518-L522 WeakPolarHBondContact O-CG 3.43Å; F518-L522 PolarHBondContact O-N 2.98Å; E519-L522 PolarHBondContact O-N 3.37Å; E519-L522 VanDerWaalsContact O-N 3.13Å; F520-L522 VanDerWaalsContact C-N 3.3Å; F520-L522 PolarHBondContact O-N 2.94Å; L522-M525 HydrophobicContact CD2-CE 3.52Å; L522-M525 PolarHBondContact O-N 3.23Å; L522-R526 PolarHBondContact O-N 2.98Å; L522-R526 VanDerWaalsContact O-N 3.16Å; L522-V585 HydrophobicContact CD2-CG2 4.15Å; L522-Y600 HydrophobicContact CD1-CE1 4.48Å; L522-Y621 HydrophobicContact CD1-CE1 3.68Å; L522-Y621 HydrophobicContact CD2-CD1 3.51Å; L522-Y621 HydrophobicContact CD2-CE1 3.38Å; L522-Y621 HydrophobicContact CG-CE1 4.19Å
523	E	97.6	Very high	96	Very high	39 Å²	39	38 Å²	38	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-37.1	173.7	-73.7	-78.9	103.6	0	0	111.9	L474 K477 F480 E519 F520 M525 R526 V527	L474-E523 HydrophobicContact CD1-CB 4.04Å; L474-E523 HydrophobicContact CD2-CB 4.25Å; K477-E523 IonicContact NZ-OE2 2.74Å; K477-E523 PolarHBondContact NZ-OE2 2.92Å; F480-E523 HydrophobicContact CE2-CG 4.12Å; F480-E523 HydrophobicContact CZ-CG 3.93Å; E519-E523 WeakPolarHBondContact O-CG 3.37Å; E519-E523 PolarHBondContact O-N 3.37Å; F520-E523 PolarHBondContact O-N 2.99Å; E523-M525 VanDerWaalsContact C-N 3.32Å; E523-M525 PolarHBondContact O-N 3.17Å; E523-R526 WeakPolarHBondContact O-CB 3.46Å; E523-R526 PolarHBondContact O-N 3.37Å; E523-R526 WeakPolarHBondContact OE1-CD 3.39Å; E523-R526 IonicContact OE1-CZ 3.78Å; E523-R526 IonicContact OE1-NE 3.18Å; E523-R526 IonicContact OE1-NH1 3.64Å; E523-R526 PolarHBondContact OE1-NH1 3.24Å; E523-V527 WeakPolarHBondContact O-CG2 3.44Å; E523-V527 PolarHBondContact O-N 3.48Å
524	M	97.8	Very high	95.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-39.6	173.3	-73.9	-179.2	82.7	0	0	112.2	I439 A441 F471 L474 Y493 F520 V527 V528 L542 I544	I439-M524 HydrophobicContact CD1-SD 4.15Å; A441-M524 HydrophobicContact CB-CE 3.74Å; A441-M524 HydrophobicContact CB-SD 4.3Å; F471-M524 HydrophobicContact CB-CE 4.27Å; F471-M524 HydrophobicContact CD1-CB 4.26Å; F471-M524 HydrophobicContact CD1-CE 3.87Å; F471-M524 HydrophobicContact CD1-CG 3.96Å; F471-M524 HydrophobicContact CD2-CE 3.55Å; F471-M524 HydrophobicContact CE1-CB 4.03Å; F471-M524 HydrophobicContact CE1-CE 4.01Å; F471-M524 HydrophobicContact CE1-CG 4.22Å; F471-M524 HydrophobicContact CE2-CE 3.7Å; F471-M524 HydrophobicContact CG-CE 3.65Å; F471-M524 HydrophobicContact CG-CG 4.48Å; F471-M524 HydrophobicContact CZ-CE 3.93Å; L474-M524 HydrophobicContact CD1-CG 3.97Å; Y493-M524 HydrophobicContact CD1-CE 3.82Å; Y493-M524 HydrophobicContact CE1-CE 4.44Å; Y493-M524 HydrophobicContact CG-CE 3.96Å; F520-M524 HydrophobicContact CD1-CG 4.21Å; F520-M524 HydrophobicContact CD1-SD 3.83Å; F520-M524 HydrophobicContact CE1-CG 3.94Å; F520-M524 HydrophobicContact CE1-SD 3.36Å; F520-M524 WeakPolarHBondContact CE1-SD 3.48Å; F520-M524 HydrophobicContact CZ-CG 4.22Å; F520-M524 HydrophobicContact CZ-SD 4.06Å; F520-M524 VanDerWaalsContact O-CG 3.31Å; F520-M524 WeakPolarHBondContact O-CG 3.42Å; F520-M524 PolarHBondContact O-N 3.15Å; M524-V527 PolarHBondContact O-N 2.87Å; M524-V528 PolarHBondContact O-N 3.19Å; M524-L542 HydrophobicContact CB-CD2 4.08Å; M524-I544 HydrophobicContact CB-CD1 4.4Å
525	M	96.4	Very high	95.6	Very high	26 Å²	26	46 Å²	46	13%	0.128	22%	0.218	C	C	.	.	H	α-helix	trans	-64.2	-43.6	174.1	-68.7	-171.3	-65	0	0	111.2	A521 L522 E523 V527 V528 D529 L542 I544 V585	A521-M525 PolarHBondContact O-N 2.93Å; L522-M525 HydrophobicContact CD2-CE 3.52Å; L522-M525 PolarHBondContact O-N 3.23Å; E523-M525 VanDerWaalsContact C-N 3.32Å; E523-M525 PolarHBondContact O-N 3.17Å; M525-V527 VanDerWaalsContact C-N 3.34Å; M525-V527 PolarHBondContact O-N 3.34Å; M525-V528 PolarHBondContact O-N 3.4Å; M525-D529 PolarHBondContact O-N 3.09Å; M525-L542 HydrophobicContact CG-CD2 4.2Å; M525-I544 HydrophobicContact CG-CD1 4.04Å; M525-V585 HydrophobicContact CE-CG2 3.59Å; M525-V585 HydrophobicContact SD-CG2 3.99Å
526	R	96.4	Very high	95.2	Very high	130 Å²	130	49.2 Å²	49.2	49%	0.491	24%	0.243	S	C	.	.	H	α-helix	trans	-60.7	-41.2	175.1	-66.8	174	-177.3	152.2	5.9	112.4	L522 E523 V528 D529 D530	L522-R526 PolarHBondContact O-N 2.98Å; L522-R526 VanDerWaalsContact O-N 3.16Å; E523-R526 WeakPolarHBondContact O-CB 3.46Å; E523-R526 PolarHBondContact O-N 3.37Å; E523-R526 WeakPolarHBondContact OE1-CD 3.39Å; E523-R526 IonicContact OE1-CZ 3.78Å; E523-R526 IonicContact OE1-NE 3.18Å; E523-R526 IonicContact OE1-NH1 3.64Å; E523-R526 PolarHBondContact OE1-NH1 3.24Å; R526-V528 VanDerWaalsContact C-N 3.35Å; R526-V528 PolarHBondContact O-N 3.49Å; R526-D529 PolarHBondContact O-N 3.29Å; R526-D530 WeakPolarHBondContact O-CB 3.47Å; R526-D530 PolarHBondContact O-N 3.34Å
527	V	97	Very high	94.6	Very high	25 Å²	25	53 Å²	53	15%	0.152	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-41	175.5	165.4	0	0	0	0	111.3	L467 D470 F471 L474 E523 M524 M525 D530 F531	L467-V527 HydrophobicContact CD1-CG1 4.25Å; D470-V527 HydrophobicContact CB-CG1 3.62Å; F471-V527 HydrophobicContact CD1-CB 4.38Å; F471-V527 HydrophobicContact CD1-CG1 3.9Å; F471-V527 HydrophobicContact CE1-CB 4.24Å; F471-V527 HydrophobicContact CE1-CG1 3.87Å; L474-V527 HydrophobicContact CD1-CG2 3.92Å; L474-V527 HydrophobicContact CD2-CG2 3.96Å; L474-V527 HydrophobicContact CG-CG2 4.11Å; E523-V527 WeakPolarHBondContact O-CG2 3.44Å; E523-V527 PolarHBondContact O-N 3.48Å; M524-V527 PolarHBondContact O-N 2.87Å; M525-V527 VanDerWaalsContact C-N 3.34Å; M525-V527 PolarHBondContact O-N 3.34Å; V527-D530 PolarHBondContact O-N 2.8Å; V527-F531 VanDerWaalsContact O-CB 3.26Å; V527-F531 WeakPolarHBondContact O-CB 3.29Å; V527-F531 PolarHBondContact O-N 2.9Å
528	V	96.8	Very high	94.3	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.024	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-41.2	174	171.5	0	0	0	0	111.7	L467 F471 M524 M525 R526 D530 F531 N532 F540 L542	L467-V528 HydrophobicContact CD1-CG2 4Å; L467-V528 HydrophobicContact CD2-CG2 4.34Å; F471-V528 HydrophobicContact CE1-CG2 3.86Å; F471-V528 HydrophobicContact CZ-CG2 3.58Å; M524-V528 PolarHBondContact O-N 3.19Å; M525-V528 PolarHBondContact O-N 3.4Å; R526-V528 VanDerWaalsContact C-N 3.35Å; R526-V528 PolarHBondContact O-N 3.49Å; V528-D530 VanDerWaalsContact C-N 3.32Å; V528-D530 PolarHBondContact O-N 3.41Å; V528-F531 PolarHBondContact O-N 3.27Å; V528-N532 VanDerWaalsContact O-CB 3.29Å; V528-N532 WeakPolarHBondContact O-CB 3.49Å; V528-N532 PolarHBondContact O-N 2.99Å; V528-N532 PolarHBondContact O-ND2 2.97Å; V528-F540 HydrophobicContact CG1-CB 4.26Å; V528-F540 VanDerWaalsContact CG1-O 3.3Å; V528-F540 WeakPolarHBondContact CG1-O 3.45Å; V528-L542 HydrophobicContact CB-CB 4.47Å; V528-L542 HydrophobicContact CG1-CB 4.37Å; V528-L542 HydrophobicContact CG2-CB 4.11Å; V528-L542 HydrophobicContact CG2-CD1 4.46Å; V528-L542 HydrophobicContact CG2-CD2 4.01Å; V528-L542 HydrophobicContact CG2-CG 4.43Å
529	D	95.2	Very high	94.1	Very high	93 Å²	93	57.1 Å²	57.1	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-37.7	175.3	-72	-26.9	0	0	0	112.3	M525 R526 K533	M525-D529 PolarHBondContact O-N 3.09Å; R526-D529 PolarHBondContact O-N 3.29Å; D529-K533 WeakPolarHBondContact O-CE 3.38Å; D529-K533 WeakPolarHBondContact O-CG 3.37Å; D529-K533 PolarHBondContact O-N 3.46Å
530	D	95.8	Very high	94	Very high	83 Å²	83	54.4 Å²	54.4	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-71.6	-43.2	175	-76.6	-28	0	0	0	112	R526 V527 V528 N532 K533	R526-D530 WeakPolarHBondContact O-CB 3.47Å; R526-D530 PolarHBondContact O-N 3.34Å; V527-D530 PolarHBondContact O-N 2.8Å; V528-D530 VanDerWaalsContact C-N 3.32Å; V528-D530 PolarHBondContact O-N 3.41Å; D530-N532 VanDerWaalsContact C-N 3.3Å; D530-N532 PolarHBondContact O-N 3.31Å; D530-K533 WeakPolarHBondContact O-CB 3.12Å; D530-K533 PolarHBondContact O-N 2.87Å; D530-K533 VanDerWaalsContact O-N 3.1Å; D530-K533 IonicContact OD1-NZ 3.58Å; D530-K533 PolarHBondContact OD1-NZ 2.87Å
531	F	95.2	Very high	93.9	Very high	13 Å²	13	57.9 Å²	57.9	6%	0.057	31%	0.314	C	S	.	.	H	α-helix	trans	-58.7	-42.5	174.4	-168.6	-86.6	0	0	0	111.5	V463 E466 L467 D470 V527 V528 K533 N534 M535 F540	V463-F531 HydrophobicContact CG1-CE1 4Å; V463-F531 HydrophobicContact CG1-CZ 3.93Å; E466-F531 HydrophobicContact CB-CE2 4.17Å; E466-F531 HydrophobicContact CB-CZ 4.42Å; E466-F531 HydrophobicContact CG-CE2 4.12Å; L467-F531 HydrophobicContact CB-CD2 4.15Å; L467-F531 HydrophobicContact CB-CE1 4.4Å; L467-F531 HydrophobicContact CB-CE2 3.91Å; L467-F531 HydrophobicContact CB-CZ 4.04Å; L467-F531 HydrophobicContact CD1-CB 4.03Å; L467-F531 HydrophobicContact CD1-CD1 4.43Å; L467-F531 HydrophobicContact CD1-CD2 3.97Å; L467-F531 HydrophobicContact CD1-CG 3.89Å; D470-F531 WeakPolarHBondContact OD2-CD2 3.46Å; V527-F531 VanDerWaalsContact O-CB 3.26Å; V527-F531 WeakPolarHBondContact O-CB 3.29Å; V527-F531 PolarHBondContact O-N 2.9Å; V528-F531 PolarHBondContact O-N 3.27Å; F531-K533 PolarHBondContact O-N 3.42Å; F531-N534 WeakPolarHBondContact O-CB 3.43Å; F531-N534 PolarHBondContact O-N 3.19Å; F531-M535 HydrophobicContact CD1-CG 3.95Å; F531-M535 HydrophobicContact CE1-CG 3.82Å; F531-M535 HydrophobicContact CE1-SD 3.99Å; F531-M535 PolarHBondContact O-N 3.03Å; F531-F540 HydrophobicContact CD1-CD2 4.17Å; F531-F540 HydrophobicContact CD1-CE2 4.49Å; F531-F540 HydrophobicContact CE1-CD2 4.11Å; F531-F540 AromaticContact CE1-CE2 3.97Å; F531-F540 HydrophobicContact CE1-CE2 3.97Å
532	N	95.2	Very high	93.8	Very high	33 Å²	33	58 Å²	58	18%	0.176	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-24.2	176.9	-75.1	-24.3	0	0	0	113.6	V528 D530 N534 M535 G539 F540	V528-N532 VanDerWaalsContact O-CB 3.29Å; V528-N532 WeakPolarHBondContact O-CB 3.49Å; V528-N532 PolarHBondContact O-N 2.99Å; V528-N532 PolarHBondContact O-ND2 2.97Å; D530-N532 VanDerWaalsContact C-N 3.3Å; D530-N532 PolarHBondContact O-N 3.31Å; N532-N534 PolarHBondContact O-N 2.98Å; N532-M535 PolarHBondContact O-N 2.95Å; N532-G539 WeakPolarHBondContact OD1-CA 3.45Å; N532-F540 PolarHBondContact ND2-O 3.41Å; N532-F540 PolarHBondContact OD1-N 3.47Å
533	K	93.8	Very high	93.8	Very high	149 Å²	149	59.1 Å²	59.1	65%	0.648	32%	0.318	S	S	*	.	H	α-helix	trans	-69.9	-24.6	173.8	-65.8	162.8	-163.2	167.2	0	112.4	D529 D530 F531	D529-K533 WeakPolarHBondContact O-CE 3.38Å; D529-K533 WeakPolarHBondContact O-CG 3.37Å; D529-K533 PolarHBondContact O-N 3.46Å; D530-K533 WeakPolarHBondContact O-CB 3.12Å; D530-K533 PolarHBondContact O-N 2.87Å; D530-K533 VanDerWaalsContact O-N 3.1Å; D530-K533 IonicContact OD1-NZ 3.58Å; D530-K533 PolarHBondContact OD1-NZ 2.87Å; F531-K533 PolarHBondContact O-N 3.42Å
534	N	90.2	Very high	93.8	Very high	136 Å²	136	57.2 Å²	57.2	73%	0.727	31%	0.309	S	S	*	.	H	α-helix	trans	-88	-16.6	176.7	-58.5	-31.8	0	0	0	112.2	F531 N532	F531-N534 WeakPolarHBondContact O-CB 3.43Å; F531-N534 PolarHBondContact O-N 3.19Å; N532-N534 PolarHBondContact O-N 2.98Å
535	M	88.6	Confident	93.9	Very high	42 Å²	42	57.2 Å²	57.2	21%	0.207	31%	0.309	C	S	.	.	S	Bend	trans	-85.2	128	178.1	-70.8	-71.4	-72.3	0	0	111.6	F449 V463 F531 N532 F538 F540	F449-M535 HydrophobicContact CD2-CE 4.47Å; F449-M535 HydrophobicContact CE2-CE 3.7Å; F449-M535 HydrophobicContact CZ-CE 3.99Å; V463-M535 HydrophobicContact CG1-CE 4.33Å; V463-M535 HydrophobicContact CG1-SD 4.26Å; F531-M535 HydrophobicContact CD1-CG 3.95Å; F531-M535 HydrophobicContact CE1-CG 3.82Å; F531-M535 HydrophobicContact CE1-SD 3.99Å; F531-M535 PolarHBondContact O-N 3.03Å; N532-M535 PolarHBondContact O-N 2.95Å; M535-F538 VanDerWaalsContact CB-O 3.28Å; M535-F538 WeakPolarHBondContact CB-O 3.32Å; M535-F540 HydrophobicContact CE-CE2 3.82Å; M535-F540 HydrophobicContact CE-CZ 4.29Å
536	L	86.1	Confident	93.9	Very high	175 Å²	175	56 Å²	56	92%	0.916	30%	0.303	S	S	*	.	S	Bend	trans	-88.7	112	178.9	-66.4	176.5	0	0	0	111.1	F538	L536-F538 VanDerWaalsContact C-N 3.27Å; L536-F538 PolarHBondContact O-N 3.32Å
537	G	81.8	Confident	94	Very high	94 Å²	94	49.9 Å²	49.9	97%	0.969	28%	0.28	S	S	*	.	S	Bend	trans	77.3	2.6	169.7	0	0	0	0	0	116.1
538	F	90.3	Very high	94	Very high	52 Å²	52	49.6 Å²	49.6	23%	0.228	28%	0.277	C	S	.	.			trans	-135.9	139.6	174.5	-168.4	-87.5	0	0	0	110.2	N445 E448 F449 M535 L536 F540	N445-F538 HydrophobicContact CB-CZ 4.29Å; N445-F538 VanDerWaalsContact ND2-CZ 3.27Å; N445-F538 WeakPolarHBondContact ND2-CZ 3.44Å; E448-F538 HydrophobicContact CB-CE2 4.44Å; F449-F538 HydrophobicContact CB-CE1 3.89Å; F449-F538 HydrophobicContact CB-CE2 4.2Å; F449-F538 HydrophobicContact CB-CZ 3.71Å; F449-F538 AromaticContact CD2-CD1 4Å; F449-F538 HydrophobicContact CD2-CD1 4Å; F449-F538 HydrophobicContact CD2-CD2 4.47Å; F449-F538 HydrophobicContact CD2-CE1 4.2Å; F449-F538 HydrophobicContact CD2-CG 4.15Å; F449-F538 HydrophobicContact CG-CE1 4.3Å; M535-F538 VanDerWaalsContact CB-O 3.28Å; M535-F538 WeakPolarHBondContact CB-O 3.32Å; L536-F538 VanDerWaalsContact C-N 3.27Å; L536-F538 PolarHBondContact O-N 3.32Å; F538-F540 HydrophobicContact CD1-CD1 4.32Å; F538-F540 HydrophobicContact CD1-CE1 4.22Å; F538-F540 HydrophobicContact CD1-CZ 4.39Å; F538-F540 AromaticContact CE1-CD1 3.61Å; F538-F540 HydrophobicContact CE1-CD1 3.61Å; F538-F540 AromaticContact CE1-CE1 3.62Å; F538-F540 HydrophobicContact CE1-CE1 3.62Å; F538-F540 HydrophobicContact CE1-CG 4.19Å; F538-F540 HydrophobicContact CE1-CZ 4.22Å
539	G	92.3	Very high	94	Very high	34 Å²	34	49.7 Å²	49.7	35%	0.351	28%	0.279	S	S	.	.			trans	-127.1	121.3	176.2	0	0	0	0	0	110.9	N445 N532	N445-G539 PolarHBondContact ND2-O 3.02Å; N532-G539 WeakPolarHBondContact OD1-CA 3.45Å
540	F	95.5	Very high	94	Very high	6 Å²	6	49.2 Å²	49.2	3%	0.026	28%	0.281	C	S	.	.			trans	-70.1	135.3	172.8	-71.2	-63.5	0	0	0	110.8	I443 N445 F446 F449 V463 L467 V528 F531 N532 M535 F538	I443-F540 HydrophobicContact CG2-CB 4.04Å; I443-F540 HydrophobicContact CG2-CD1 3.51Å; I443-F540 HydrophobicContact CG2-CE1 4.35Å; I443-F540 HydrophobicContact CG2-CG 4.08Å; N445-F540 WeakPolarHBondContact OD1-CA 3.38Å; F446-F540 AromaticContact CD2-CE1 3.89Å; F446-F540 HydrophobicContact CD2-CE1 3.89Å; F446-F540 HydrophobicContact CD2-CZ 4.44Å; F449-F540 HydrophobicContact CB-CE1 3.96Å; F449-F540 HydrophobicContact CB-CZ 4.39Å; F449-F540 AromaticContact CD1-CE1 3.87Å; F449-F540 HydrophobicContact CD1-CE1 3.87Å; F449-F540 AromaticContact CD1-CZ 3.57Å; F449-F540 HydrophobicContact CD1-CZ 3.57Å; F449-F540 HydrophobicContact CD2-CZ 4.18Å; F449-F540 AromaticContact CE1-CZ 3.78Å; F449-F540 HydrophobicContact CE1-CZ 3.78Å; F449-F540 HydrophobicContact CE2-CZ 4.38Å; F449-F540 AromaticContact CG-CE1 3.85Å; F449-F540 HydrophobicContact CG-CE1 3.85Å; F449-F540 AromaticContact CG-CZ 3.78Å; F449-F540 HydrophobicContact CG-CZ 3.78Å; F449-F540 HydrophobicContact CZ-CZ 4.19Å; V463-F540 HydrophobicContact CG1-CE2 3.89Å; V463-F540 HydrophobicContact CG1-CZ 4.13Å; L467-F540 HydrophobicContact CD2-CD2 4.4Å; V528-F540 HydrophobicContact CG1-CB 4.26Å; V528-F540 VanDerWaalsContact CG1-O 3.3Å; V528-F540 WeakPolarHBondContact CG1-O 3.45Å; F531-F540 HydrophobicContact CD1-CD2 4.17Å; F531-F540 HydrophobicContact CD1-CE2 4.49Å; F531-F540 HydrophobicContact CE1-CD2 4.11Å; F531-F540 AromaticContact CE1-CE2 3.97Å; F531-F540 HydrophobicContact CE1-CE2 3.97Å; N532-F540 PolarHBondContact ND2-O 3.41Å; N532-F540 PolarHBondContact OD1-N 3.47Å; M535-F540 HydrophobicContact CE-CE2 3.82Å; M535-F540 HydrophobicContact CE-CZ 4.29Å; F538-F540 HydrophobicContact CD1-CD1 4.32Å; F538-F540 HydrophobicContact CD1-CE1 4.22Å; F538-F540 HydrophobicContact CD1-CZ 4.39Å; F538-F540 AromaticContact CE1-CD1 3.61Å; F538-F540 HydrophobicContact CE1-CD1 3.61Å; F538-F540 AromaticContact CE1-CE1 3.62Å; F538-F540 HydrophobicContact CE1-CE1 3.62Å; F538-F540 HydrophobicContact CE1-CG 4.19Å; F538-F540 HydrophobicContact CE1-CZ 4.22Å
541	K	94.7	Very high	94.1	Very high	72 Å²	72	45.6 Å²	45.6	31%	0.313	26%	0.262	S	S	.	.			trans	-107	116.6	175.9	-56.3	-173.2	-167	176.3	0	110	V444 N445 E582	V444-K541 HydrophobicContact CB-CB 4.48Å; V444-K541 PolarHBondContact N-O 3.34Å; N445-K541 PolarHBondContact OD1-N 3.47Å; K541-E582 HydrophobicContact CB-CB 4.25Å; K541-E582 HydrophobicContact CD-CB 4.15Å; K541-E582 HydrophobicContact CD-CG 4.3Å; K541-E582 WeakPolarHBondContact CD-OE2 3.4Å; K541-E582 IonicContact NZ-OE1 3.3Å; K541-E582 PolarHBondContact NZ-OE1 3.32Å; K541-E582 IonicContact NZ-OE2 3.71Å; K541-E582 PolarHBondContact NZ-OE2 3.45Å
542	L	96.6	Very high	94.2	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	137	174.7	-165.1	69.4	0	0	0	110	A441 I443 F471 M524 M525 V528 I544 C583	A441-L542 HydrophobicContact CB-CD1 4.19Å; I443-L542 HydrophobicContact CG1-CD1 4.18Å; F471-L542 HydrophobicContact CZ-CD1 4.4Å; F471-L542 HydrophobicContact CZ-CD2 4.4Å; M524-L542 HydrophobicContact CB-CD2 4.08Å; M525-L542 HydrophobicContact CG-CD2 4.2Å; V528-L542 HydrophobicContact CB-CB 4.47Å; V528-L542 HydrophobicContact CG1-CB 4.37Å; V528-L542 HydrophobicContact CG2-CB 4.11Å; V528-L542 HydrophobicContact CG2-CD1 4.46Å; V528-L542 HydrophobicContact CG2-CD2 4.01Å; V528-L542 HydrophobicContact CG2-CG 4.43Å; L542-I544 HydrophobicContact CD2-CD1 3.82Å; L542-I544 HydrophobicContact CD2-CG1 4Å; L542-I544 HydrophobicContact CG-CD1 4.48Å; L542-I544 HydrophobicContact CG-CG1 4.11Å; L542-C583 WeakPolarHBondContact O-CA 3.22Å; L542-C583 PolarHBondContact O-N 3.36Å
543	R	96.9	Very high	94.2	Very high	31 Å²	31	45.8 Å²	45.8	12%	0.117	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.2	161.1	64.7	174.1	-169.4	-161.2	-5.6	108.7	A441 S442 V444 D577 T578 V581	A441-R543 CarbonylContact C-O 3.58Å; A441-R543 WeakPolarHBondContact CA-O 3.21Å; S442-R543 PolarHBondContact N-O 3.47Å; S442-R543 PolarHBondContact O-N 3.01Å; V444-R543 HydrophobicContact CG2-CB 4.02Å; V444-R543 HydrophobicContact CG2-CG 3.61Å; R543-D577 VanDerWaalsContact CD-O 3.28Å; R543-D577 WeakPolarHBondContact CD-O 3.35Å; R543-D577 WeakPolarHBondContact CD-OD1 3.38Å; R543-D577 VanDerWaalsContact CG-OD1 3.32Å; R543-D577 WeakPolarHBondContact CG-OD1 3.32Å; R543-D577 VanDerWaalsContact CZ-O 3.23Å; R543-D577 IonicContact CZ-OD1 2.79Å; R543-D577 PolarHBondContact NE-O 3.5Å; R543-D577 IonicContact NE-OD1 2.71Å; R543-D577 PolarHBondContact NE-OD1 3.26Å; R543-D577 IonicContact NH2-OD1 3.19Å; R543-T578 PolarHBondContact NH1-O 2.86Å; R543-V581 WeakPolarHBondContact CB-O 3.5Å
544	I	98.3	Very high	94.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.1	179.7	-50.7	-177.5	0	0	0	110.2	I439 F440 A441 A521 M524 M525 L542 R584 V585 Q586	I439-I544 HydrophobicContact CB-CG2 4.15Å; I439-I544 HydrophobicContact CG2-CG2 4.33Å; F440-I544 CarbonylContact O-C 3.57Å; F440-I544 WeakPolarHBondContact O-CA 3.28Å; A441-I544 HydrophobicContact CB-CD1 4.28Å; A441-I544 HydrophobicContact CB-CG1 3.85Å; A441-I544 HydrophobicContact CB-CG2 4.35Å; A521-I544 HydrophobicContact CB-CD1 3.78Å; A521-I544 HydrophobicContact CB-CG2 4.17Å; A521-I544 VanDerWaalsContact O-CD1 3.25Å; A521-I544 WeakPolarHBondContact O-CD1 3.27Å; M524-I544 HydrophobicContact CB-CD1 4.4Å; M525-I544 HydrophobicContact CG-CD1 4.04Å; L542-I544 HydrophobicContact CD2-CD1 3.82Å; L542-I544 HydrophobicContact CD2-CG1 4Å; L542-I544 HydrophobicContact CG-CD1 4.48Å; L542-I544 HydrophobicContact CG-CG1 4.11Å; I544-R584 PolarHBondContact N-O 3.31Å; I544-V585 HydrophobicContact CB-CB 4.48Å; I544-V585 HydrophobicContact CB-CG1 4.17Å; I544-V585 HydrophobicContact CB-CG2 4.22Å; I544-V585 HydrophobicContact CD1-CG2 4.43Å; I544-V585 HydrophobicContact CG2-CG1 4.23Å; I544-V585 CarbonylContact O-C 3.57Å; I544-V585 WeakPolarHBondContact O-CA 3.31Å; I544-Q586 PolarHBondContact O-N 3.07Å
545	G	98.1	Very high	94.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	128.8	167.6	0	0	0	0	0	111.2	I439 F440	I439-G545 VanDerWaalsContact CA-O 3.28Å; I439-G545 WeakPolarHBondContact CA-O 3.4Å; F440-G545 PolarHBondContact N-O 3.08Å; F440-G545 PolarHBondContact O-N 3.45Å
546	F	98.4	Very high	94.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	134.6	177.7	-174	-75.4	0	0	0	111	I439 L514 L517 F518 V585 Q586 V587 L595	I439-F546 HydrophobicContact CG2-CB 4.26Å; I439-F546 HydrophobicContact CG2-CD2 3.47Å; I439-F546 VanDerWaalsContact CG2-CD2 3.47Å; I439-F546 HydrophobicContact CG2-CE2 4.21Å; I439-F546 HydrophobicContact CG2-CG 4.21Å; L514-F546 HydrophobicContact CB-CZ 4.35Å; L514-F546 HydrophobicContact CD2-CZ 4.38Å; L517-F546 HydrophobicContact CB-CE2 4.24Å; L517-F546 HydrophobicContact CD2-CE2 3.95Å; L517-F546 HydrophobicContact CG-CE2 4.08Å; F518-F546 HydrophobicContact CB-CE2 4.19Å; F518-F546 HydrophobicContact CD2-CD2 4.04Å; F518-F546 HydrophobicContact CD2-CE2 4.24Å; F546-V585 HydrophobicContact CB-CG1 4.19Å; F546-Q586 PolarHBondContact N-O 3.13Å; F546-V587 HydrophobicContact CB-CG2 4.27Å; F546-V587 HydrophobicContact CD1-CG1 4.35Å; F546-L595 HydrophobicContact CD1-CD1 4.31Å; F546-L595 HydrophobicContact CE1-CD1 4.07Å; F546-L595 HydrophobicContact CZ-CD1 4.34Å
547	N	97.8	Very high	94.1	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.011	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	159.5	164.3	-171.1	51.8	0	0	0	110.8	V438 T569 I572 A573 S588 S591	V438-N547 PolarHBondContact N-O 2.94Å; V438-N547 PolarHBondContact O-N 3.4Å; V438-N547 VanDerWaalsContact O-N 3.11Å; N547-T569 WeakPolarHBondContact ND2-CA 3.37Å; N547-T569 PolarHBondContact ND2-O 3.06Å; N547-I572 HydrophobicContact CB-CB 4.45Å; N547-I572 HydrophobicContact CB-CG2 4.09Å; N547-A573 HydrophobicContact CB-CB 3.88Å; N547-S588 VanDerWaalsContact OD1-CB 3.27Å; N547-S588 WeakPolarHBondContact OD1-CB 3.47Å; N547-S588 PolarHBondContact OD1-OG 3.2Å; N547-S591 WeakPolarHBondContact CA-OG 3.42Å; N547-S591 PolarHBondContact OD1-OG 3.47Å
548	H	97.2	Very high	93.7	Very high	19 Å²	19	31.6 Å²	31.6	9%	0.088	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	169.7	169	78.5	-74.5	0	0	0	111.8	N435 V436 L514 T569 E590 S591	N435-H548 PolarHBondContact OD1-CD2 3.39Å; V436-H548 CarbonylContact O-C 3.6Å; V436-H548 VanDerWaalsContact O-CA 3.24Å; V436-H548 WeakPolarHBondContact O-CA 3.29Å; L514-H548 HydrophobicContact CD1-CB 3.94Å; L514-H548 HydrophobicContact CD2-CB 3.64Å; L514-H548 HydrophobicContact CG-CB 4.48Å; H548-T569 VanDerWaalsContact C-CG2 3.45Å; H548-E590 PolarHBondContact CE1-O 3.31Å; H548-S591 PolarHBondContact N-OG 3.04Å; H548-S591 WeakPolarHBondContact ND1-CA 3.39Å; H548-S591 PolarHBondContact ND1-OG 2.81Å
549	G	95.9	Very high	92.9	Very high	6 Å²	6	35.5 Å²	35.5	6%	0.062	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.1	-163.3	176.1	0	0	0	0	0	113.2	D434 V436 T569	D434-G549 CarbonylContact O-C 3.59Å; V436-G549 PolarHBondContact N-O 2.94Å; V436-G549 PolarHBondContact O-N 3.37Å; V436-G549 VanDerWaalsContact O-N 3.09Å; G549-T569 VanDerWaalsContact C-OG1 3.27Å; G549-T569 WeakPolarHBondContact CA-OG1 3.27Å
550	P	96.3	Very high	92.4	Very high	83 Å²	83	42.8 Å²	42.8	54%	0.539	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	141	-174.4	30.3	-35.2	0	0	0	113.3	H433 D434 T569	H433-P550 CarbonylContact O-C 3.42Å; H433-P550 VanDerWaalsContact O-CA 3.28Å; H433-P550 WeakPolarHBondContact O-CA 3.36Å; D434-P550 WeakPolarHBondContact O-CA 3.27Å; P550-T569 PolarHBondContact O-OG1 2.97Å
551	L	97.3	Very high	91.9	Very high	7 Å²	7	46 Å²	46	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	170.5	174.5	60.7	74.6	0	0	0	112.9	H433 V436 V438 L499 I565 W566 V570	H433-L551 HydrophobicContact CB-CD1 4.31Å; H433-L551 PolarHBondContact N-O 3.36Å; H433-L551 PolarHBondContact O-N 3.13Å; H433-L551 VanDerWaalsContact O-O 3.13Å; V436-L551 HydrophobicContact CB-CD1 4.3Å; V436-L551 HydrophobicContact CB-CD2 3.79Å; V436-L551 HydrophobicContact CB-CG 3.88Å; V436-L551 HydrophobicContact CG1-CD1 4.43Å; V436-L551 HydrophobicContact CG1-CD2 3.84Å; V436-L551 HydrophobicContact CG1-CG 4.31Å; V436-L551 HydrophobicContact CG2-CD1 3.98Å; V436-L551 HydrophobicContact CG2-CD2 4.37Å; V436-L551 HydrophobicContact CG2-CG 3.95Å; V438-L551 HydrophobicContact CG2-CD2 3.59Å; L499-L551 HydrophobicContact CD2-CD1 4.04Å; L551-I565 HydrophobicContact CD1-CB 4.19Å; L551-I565 HydrophobicContact CD1-CG2 4.19Å; L551-I565 HydrophobicContact CD2-CB 4.46Å; L551-I565 HydrophobicContact CD2-CD1 3.97Å; L551-W566 WeakPolarHBondContact CB-O 3.36Å; L551-V570 HydrophobicContact CB-CG2 4.46Å; L551-V570 HydrophobicContact CD2-CG2 3.9Å
552	T	96.3	Very high	91.6	Very high	49 Å²	49	47 Å²	47	30%	0.301	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.7	175.7	-52.2	0	0	0	0	109.4	K431 N432 I565 W566	K431-T552 CarbonylContact O-C 3.51Å; K431-T552 WeakPolarHBondContact O-CA 3.37Å; N432-T552 WeakPolarHBondContact OD1-CG2 3.33Å; N432-T552 PolarHBondContact OD1-OG1 3.19Å; N432-T552 VanDerWaalsContact OD1-OG1 3.12Å; T552-I565 CarbonylContact O-C 3.51Å; T552-I565 WeakPolarHBondContact O-CA 3.41Å; T552-W566 PolarHBondContact N-O 2.94Å; T552-W566 PolarHBondContact O-N 3.38Å
553	A	95.7	Very high	91.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	143.7	170.6	0	0	0	0	0	110.1	Y429 S430 K431 L499 Y563 I565	Y429-A553 HydrophobicContact CE1-CB 4.18Å; S430-A553 WeakPolarHBondContact CA-O 3.39Å; K431-A553 PolarHBondContact N-O 2.85Å; K431-A553 PolarHBondContact O-N 2.86Å; L499-A553 HydrophobicContact CD2-CB 4.14Å; A553-Y563 HydrophobicContact CB-CE2 4.07Å; A553-I565 HydrophobicContact CB-CG2 3.9Å
554	G	93.9	Very high	91.4	Very high	5 Å²	5	46.7 Å²	46.7	5%	0.052	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	165.7	-177.9	0	0	0	0	0	113.3	Y429 D564	Y429-G554 WeakPolarHBondContact O-CA 3.48Å; G554-D564 PolarHBondContact N-O 3.23Å; G554-D564 PolarHBondContact O-N 3Å; G554-D564 VanDerWaalsContact O-N 3.07Å
555	V	92.9	Very high	91.4	Very high	23 Å²	23	46.9 Å²	46.9	14%	0.139	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.1	172.2	178.6	0	0	0	0	109.3	I415 V419 L423 Y429 L561 L562 Y563	I415-V555 HydrophobicContact CG2-CG2 4.47Å; V419-V555 HydrophobicContact CG1-CG2 3.55Å; L423-V555 HydrophobicContact CD1-CB 4.4Å; L423-V555 HydrophobicContact CD1-CG1 4.32Å; L423-V555 HydrophobicContact CD1-CG2 4.08Å; Y429-V555 HydrophobicContact CD1-CG2 4.22Å; Y429-V555 PolarHBondContact O-N 3.24Å; V555-L561 HydrophobicContact CG1-CB 4.08Å; V555-L561 HydrophobicContact CG1-CD2 3.77Å; V555-L561 HydrophobicContact CG1-CG 4.47Å; V555-L562 WeakPolarHBondContact CA-O 3.18Å; V555-Y563 HydrophobicContact CG2-CD2 3.93Å
556	I	88.4	Confident	91.3	Very high	97 Å²	97	51.4 Å²	51.4	50%	0.497	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	147.2	178.6	-66.4	-178	0	0	0	110	L562 W566	I556-L562 PolarHBondContact N-O 3.49Å; I556-L562 PolarHBondContact O-N 3.27Å; I556-W566 HydrophobicContact CD1-CH2 3.46Å; I556-W566 VanDerWaalsContact CD1-CH2 3.46Å; I556-W566 HydrophobicContact CD1-CZ2 3.35Å; I556-W566 HydrophobicContact CD1-CZ3 4.5Å; I556-W566 HydrophobicContact CG1-CH2 3.74Å; I556-W566 HydrophobicContact CG1-CZ2 4.13Å
557	G	81	Confident	91.1	Very high	43 Å²	43	52.5 Å²	52.5	44%	0.443	30%	0.297	S	S	.	.			trans	95.3	163	177.1	0	0	0	0	0	113.5	L561	G557-L561 WeakPolarHBondContact O-CD2 3.49Å
558	T	74.3	Confident	91	Very high	130 Å²	130	56.1 Å²	56.1	80%	0.798	32%	0.316	S	S	*	.	S	Bend	trans	-121.2	-31.4	178.1	51.3	0	0	0	0	112.7
559	T	72.4	Confident	91	Very high	135 Å²	135	55.5 Å²	55.5	83%	0.828	31%	0.314	S	S	*	.	S	Bend	trans	-105.1	-32.8	178.2	-45	0	0	0	0	112.4
560	K	81.9	Confident	91	Very high	187 Å²	187	55.9 Å²	55.9	81%	0.813	32%	0.315	S	S	*	.	S	Bend	trans	-121.4	100.7	169.8	-68.5	-174.1	177.1	-175.3	0	106.6
561	L	85.7	Confident	91	Very high	74 Å²	74	56.8 Å²	56.8	39%	0.387	32%	0.315	S	S	.	.			trans	-74.5	133.9	177.4	-63.7	169.9	0	0	0	108.8	V555 G557	V555-L561 HydrophobicContact CG1-CB 4.08Å; V555-L561 HydrophobicContact CG1-CD2 3.77Å; V555-L561 HydrophobicContact CG1-CG 4.47Å; G557-L561 WeakPolarHBondContact O-CD2 3.49Å
562	L	89.1	Confident	91	Very high	93 Å²	93	56.9 Å²	56.9	49%	0.487	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	115.2	174.1	-178.6	133.9	0	0	0	108.4	V555 I556 D564	V555-L562 WeakPolarHBondContact CA-O 3.18Å; I556-L562 PolarHBondContact N-O 3.49Å; I556-L562 PolarHBondContact O-N 3.27Å; L562-D564 HydrophobicContact CD2-CB 3.74Å
563	Y	93.8	Very high	91	Very high	13 Å²	13	54.6 Å²	54.6	5%	0.051	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	136.1	168.8	175.7	-103.2	0	0	0	109.8	P416 V419 Y429 I486 L499 A553 V555	P416-Y563 HydrophobicContact CG-CD1 3.69Å; P416-Y563 HydrophobicContact CG-CE1 3.63Å; P416-Y563 HydrophobicContact CG-CE2 4.45Å; P416-Y563 HydrophobicContact CG-CG 4.14Å; V419-Y563 HydrophobicContact CG1-CD2 4.26Å; V419-Y563 HydrophobicContact CG2-CD2 3.9Å; V419-Y563 HydrophobicContact CG2-CE2 3.56Å; Y429-Y563 HydrophobicContact CE1-CE2 4.1Å; I486-Y563 HydrophobicContact CD1-CE1 3.9Å; L499-Y563 WeakPolarHBondContact CD1-OH 3.36Å; A553-Y563 HydrophobicContact CB-CE2 4.07Å; V555-Y563 HydrophobicContact CG2-CD2 3.93Å
564	D	95.4	Very high	91	Very high	15 Å²	15	55.3 Å²	55.3	8%	0.08	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	167.8	-178.6	-167	18.3	0	0	0	111.5	K487 G554 L562 W566	K487-D564 WeakPolarHBondContact CE-OD1 3.42Å; K487-D564 IonicContact NZ-OD1 3.7Å; K487-D564 PolarHBondContact NZ-OD1 2.91Å; K487-D564 IonicContact NZ-OD2 3.86Å; K487-D564 PolarHBondContact NZ-OD2 3.39Å; G554-D564 PolarHBondContact N-O 3.23Å; G554-D564 PolarHBondContact O-N 3Å; G554-D564 VanDerWaalsContact O-N 3.07Å; L562-D564 HydrophobicContact CD2-CB 3.74Å; D564-W566 HydrophobicContact CB-CH2 3.62Å; D564-W566 HydrophobicContact CB-CZ2 3.48Å; D564-W566 VanDerWaalsContact CB-CZ2 3.48Å; D564-W566 HydrophobicContact CB-CZ3 4.38Å; D564-W566 WeakPolarHBondContact O-CZ3 3.28Å
565	I	96.8	Very high	91.1	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.2	-179.7	60.8	175.2	0	0	0	111.5	V438 I486 M494 A496 L499 L551 T552 A553 V570	V438-I565 HydrophobicContact CG1-CD1 4.41Å; V438-I565 HydrophobicContact CG2-CD1 4.03Å; I486-I565 HydrophobicContact CD1-CD1 3.98Å; I486-I565 HydrophobicContact CD1-CG1 4.27Å; I486-I565 HydrophobicContact CD1-CG2 4.17Å; I486-I565 HydrophobicContact CG1-CD1 3.85Å; I486-I565 HydrophobicContact CG1-CG1 4.19Å; I486-I565 HydrophobicContact CG2-CG1 4.27Å; M494-I565 HydrophobicContact CE-CD1 3.79Å; M494-I565 HydrophobicContact CE-CG1 3.58Å; A496-I565 HydrophobicContact CB-CD1 3.78Å; L499-I565 HydrophobicContact CD1-CG2 4.4Å; L499-I565 HydrophobicContact CD2-CG2 4.08Å; L551-I565 HydrophobicContact CD1-CB 4.19Å; L551-I565 HydrophobicContact CD1-CG2 4.19Å; L551-I565 HydrophobicContact CD2-CB 4.46Å; L551-I565 HydrophobicContact CD2-CD1 3.97Å; T552-I565 CarbonylContact O-C 3.51Å; T552-I565 WeakPolarHBondContact O-CA 3.41Å; A553-I565 HydrophobicContact CB-CG2 3.9Å; I565-V570 HydrophobicContact CD1-CG2 4.12Å; I565-V570 HydrophobicContact CG1-CG2 4.04Å
566	W	96.4	Very high	91.3	Very high	94 Å²	94	56 Å²	56	36%	0.356	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141.5	179.8	-56.3	-82.3	0	0	0	110.9	L551 T552 I556 D564	L551-W566 WeakPolarHBondContact CB-O 3.36Å; T552-W566 PolarHBondContact N-O 2.94Å; T552-W566 PolarHBondContact O-N 3.38Å; I556-W566 HydrophobicContact CD1-CH2 3.46Å; I556-W566 VanDerWaalsContact CD1-CH2 3.46Å; I556-W566 HydrophobicContact CD1-CZ2 3.35Å; I556-W566 HydrophobicContact CD1-CZ3 4.5Å; I556-W566 HydrophobicContact CG1-CH2 3.74Å; I556-W566 HydrophobicContact CG1-CZ2 4.13Å; D564-W566 HydrophobicContact CB-CH2 3.62Å; D564-W566 HydrophobicContact CB-CZ2 3.48Å; D564-W566 VanDerWaalsContact CB-CZ2 3.48Å; D564-W566 HydrophobicContact CB-CZ3 4.38Å; D564-W566 WeakPolarHBondContact O-CZ3 3.28Å
567	G	95.1	Very high	91.7	Very high	24 Å²	24	51.6 Å²	51.6	25%	0.247	28%	0.283	C	S	.	.	S	Bend	trans	166.1	164.6	175.2	0	0	0	0	0	111.8	T569 V570 N571	G567-T569 PolarHBondContact O-N 3.33Å; G567-V570 WeakPolarHBondContact O-CB 3.39Å; G567-V570 PolarHBondContact O-N 3.04Å; G567-V570 VanDerWaalsContact O-N 3.14Å; G567-N571 PolarHBondContact O-N 3.02Å; G567-N571 PolarHBondContact O-ND2 3.4Å
568	D	95.1	Very high	92.3	Very high	77 Å²	77	50.4 Å²	50.4	41%	0.412	27%	0.267	S	S	.	.	H	α-helix	trans	-60.1	-36.7	173.2	-171.3	42.5	0	0	0	111.1	V570 N571 I572 K613	D568-V570 VanDerWaalsContact C-N 3.31Å; D568-V570 PolarHBondContact O-N 3.48Å; D568-N571 WeakPolarHBondContact O-CB 3.25Å; D568-N571 PolarHBondContact O-N 2.73Å; D568-N571 VanDerWaalsContact O-N 3.15Å; D568-I572 VanDerWaalsContact O-CG1 3.28Å; D568-I572 WeakPolarHBondContact O-CG1 3.37Å; D568-I572 PolarHBondContact O-N 3.17Å; D568-K613 WeakPolarHBondContact OD2-CE 3.42Å; D568-K613 IonicContact OD2-NZ 3.94Å; D568-K613 PolarHBondContact OD2-NZ 3.07Å
569	T	96.7	Very high	93.3	Very high	7 Å²	7	45 Å²	45	4%	0.043	23%	0.234	C	C	.	.	H	α-helix	trans	-53.6	-43.1	171.6	-67.7	0	0	0	0	113.5	V438 N547 H548 G549 P550 G567 I572 A573	V438-T569 HydrophobicContact CG2-CG2 4.18Å; N547-T569 WeakPolarHBondContact ND2-CA 3.37Å; N547-T569 PolarHBondContact ND2-O 3.06Å; H548-T569 VanDerWaalsContact C-CG2 3.45Å; G549-T569 VanDerWaalsContact C-OG1 3.27Å; G549-T569 WeakPolarHBondContact CA-OG1 3.27Å; P550-T569 PolarHBondContact O-OG1 2.97Å; G567-T569 PolarHBondContact O-N 3.33Å; T569-I572 PolarHBondContact O-N 3.37Å; T569-A573 PolarHBondContact O-N 3.46Å
570	V	97	Very high	94.2	Very high	13 Å²	13	39.1 Å²	39.1	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-68.5	-42.5	178.5	-176.4	0	0	0	0	110.5	V438 F440 M494 L551 I565 G567 D568 I572 A573 S574	V438-V570 HydrophobicContact CG2-CG2 4.35Å; F440-V570 HydrophobicContact CE2-CG1 3.91Å; F440-V570 HydrophobicContact CZ-CG1 3.88Å; M494-V570 HydrophobicContact CE-CG1 3.69Å; L551-V570 HydrophobicContact CB-CG2 4.46Å; L551-V570 HydrophobicContact CD2-CG2 3.9Å; I565-V570 HydrophobicContact CD1-CG2 4.12Å; I565-V570 HydrophobicContact CG1-CG2 4.04Å; G567-V570 WeakPolarHBondContact O-CB 3.39Å; G567-V570 PolarHBondContact O-N 3.04Å; G567-V570 VanDerWaalsContact O-N 3.14Å; D568-V570 VanDerWaalsContact C-N 3.31Å; D568-V570 PolarHBondContact O-N 3.48Å; V570-I572 PolarHBondContact O-N 3.41Å; V570-A573 PolarHBondContact O-N 3.21Å; V570-S574 WeakPolarHBondContact O-CB 3.45Å; V570-S574 PolarHBondContact O-N 3.13Å
571	N	96.1	Very high	94.7	Very high	102 Å²	102	31.3 Å²	31.3	55%	0.545	17%	0.168	S	C	.	.	H	α-helix	trans	-61.8	-43.8	176.3	-69	-35.7	0	0	0	111.5	G567 D568 S574 R575	G567-N571 PolarHBondContact O-N 3.02Å; G567-N571 PolarHBondContact O-ND2 3.4Å; D568-N571 WeakPolarHBondContact O-CB 3.25Å; D568-N571 PolarHBondContact O-N 2.73Å; D568-N571 VanDerWaalsContact O-N 3.15Å; N571-S574 PolarHBondContact O-N 3.19Å; N571-R575 WeakPolarHBondContact O-CG 3.47Å; N571-R575 PolarHBondContact O-N 3.35Å
572	I	96.4	Very high	95	Very high	10 Å²	10	32 Å²	32	5%	0.051	17%	0.169	C	C	.	.	H	α-helix	trans	-63.8	-46	177.4	-63.4	163.8	0	0	0	110.4	N547 D568 T569 V570 S574 R575 M576 M616	N547-I572 HydrophobicContact CB-CB 4.45Å; N547-I572 HydrophobicContact CB-CG2 4.09Å; D568-I572 VanDerWaalsContact O-CG1 3.28Å; D568-I572 WeakPolarHBondContact O-CG1 3.37Å; D568-I572 PolarHBondContact O-N 3.17Å; T569-I572 PolarHBondContact O-N 3.37Å; V570-I572 PolarHBondContact O-N 3.41Å; I572-S574 PolarHBondContact O-N 3.06Å; I572-R575 CarbonylContact O-C 3.58Å; I572-R575 PolarHBondContact O-N 2.95Å; I572-R575 VanDerWaalsContact O-N 3.1Å; I572-M576 HydrophobicContact CG2-CG 4.45Å; I572-M576 WeakPolarHBondContact O-CG 3.23Å; I572-M576 PolarHBondContact O-N 2.92Å; I572-M616 HydrophobicContact CD1-CE 4.27Å; I572-M616 HydrophobicContact CG2-CE 4.27Å; I572-M616 HydrophobicContact CG2-SD 3.98Å
573	A	97.3	Very high	95.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.4	-47.3	175.7	0	0	0	0	0	112	V438 F440 N547 T569 V570 R575 M576 D577	V438-A573 HydrophobicContact CB-CB 4.11Å; V438-A573 HydrophobicContact CG1-CB 4.02Å; F440-A573 HydrophobicContact CD2-CB 3.81Å; F440-A573 HydrophobicContact CE2-CB 4.06Å; N547-A573 HydrophobicContact CB-CB 3.88Å; T569-A573 PolarHBondContact O-N 3.46Å; V570-A573 PolarHBondContact O-N 3.21Å; A573-R575 VanDerWaalsContact C-N 3.29Å; A573-R575 PolarHBondContact O-N 3.38Å; A573-M576 WeakPolarHBondContact O-CB 3.44Å; A573-M576 PolarHBondContact O-N 3.28Å; A573-M576 VanDerWaalsContact O-N 3.09Å; A573-D577 PolarHBondContact O-N 3.37Å
574	S	96.4	Very high	95.3	Very high	16 Å²	16	32.1 Å²	32.1	11%	0.112	17%	0.173	C	C	.	.	H	α-helix	trans	-60.3	-35.5	175.9	176.7	0	0	0	0	112.8	V570 N571 I572 T578	V570-S574 WeakPolarHBondContact O-CB 3.45Å; V570-S574 PolarHBondContact O-N 3.13Å; N571-S574 PolarHBondContact O-N 3.19Å; I572-S574 PolarHBondContact O-N 3.06Å; S574-T578 WeakPolarHBondContact O-CB 3.22Å; S574-T578 PolarHBondContact O-N 3.49Å; S574-T578 PolarHBondContact O-OG1 2.89Å
575	R	95.1	Very high	95.4	Very high	43 Å²	43	31.4 Å²	31.4	16%	0.162	17%	0.169	C	C	.	.	H	α-helix	trans	-75.4	-30.6	173.4	-61.6	-56	170.8	-178.9	-5.4	113	N571 I572 A573 D577 T578 T579 V610 V645 I649	N571-R575 WeakPolarHBondContact O-CG 3.47Å; N571-R575 PolarHBondContact O-N 3.35Å; I572-R575 CarbonylContact O-C 3.58Å; I572-R575 PolarHBondContact O-N 2.95Å; I572-R575 VanDerWaalsContact O-N 3.1Å; A573-R575 VanDerWaalsContact C-N 3.29Å; A573-R575 PolarHBondContact O-N 3.38Å; R575-D577 VanDerWaalsContact C-N 3.31Å; R575-T578 PolarHBondContact O-N 3.49Å; R575-T579 WeakPolarHBondContact O-CB 3.27Å; R575-T579 PolarHBondContact O-N 3.33Å; R575-T579 PolarHBondContact O-OG1 3.49Å; R575-V610 HydrophobicContact CB-CG1 4.48Å; R575-V610 HydrophobicContact CG-CG1 4.47Å; R575-V645 PolarHBondContact NH1-O 3.16Å; R575-V645 VanDerWaalsContact NH1-O 3.15Å; R575-I649 PolarHBondContact NH2-O 2.88Å
576	M	97.1	Very high	95.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-37.4	171.8	-67.5	-57	98.1	0	0	111.5	I572 A573 G580 Q586 V610 M616 T618	I572-M576 HydrophobicContact CG2-CG 4.45Å; I572-M576 WeakPolarHBondContact O-CG 3.23Å; I572-M576 PolarHBondContact O-N 2.92Å; A573-M576 WeakPolarHBondContact O-CB 3.44Å; A573-M576 PolarHBondContact O-N 3.28Å; A573-M576 VanDerWaalsContact O-N 3.09Å; M576-G580 VanDerWaalsContact O-CA 3.3Å; M576-G580 WeakPolarHBondContact O-CA 3.32Å; M576-G580 PolarHBondContact O-N 2.97Å; M576-G580 VanDerWaalsContact O-N 3.08Å; M576-Q586 HydrophobicContact CB-CG 4.44Å; M576-Q586 PolarHBondContact O-NE2 3.15Å; M576-Q586 HydrophobicContact SD-CG 4.06Å; M576-Q586 PolarHBondContact SD-NE2 3.18Å; M576-V610 HydrophobicContact CE-CG2 3.83Å; M576-M616 HydrophobicContact CE-SD 4.23Å; M576-T618 HydrophobicContact CE-CG2 3.92Å; M576-T618 HydrophobicContact SD-CG2 3.72Å
577	D	96.8	Very high	95.5	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-69	-54.9	171.6	169.5	29.9	0	0	0	110.9	F440 S442 R543 A573 R575 T579 G580	F440-D577 HydrophobicContact CB-CB 3.62Å; S442-D577 VanDerWaalsContact CB-OD1 3.26Å; S442-D577 WeakPolarHBondContact CB-OD1 3.38Å; S442-D577 VanDerWaalsContact OG-CG 3.31Å; S442-D577 PolarHBondContact OG-OD1 3.25Å; S442-D577 PolarHBondContact OG-OD2 3.08Å; R543-D577 VanDerWaalsContact CD-O 3.28Å; R543-D577 WeakPolarHBondContact CD-O 3.35Å; R543-D577 WeakPolarHBondContact CD-OD1 3.38Å; R543-D577 VanDerWaalsContact CG-OD1 3.32Å; R543-D577 WeakPolarHBondContact CG-OD1 3.32Å; R543-D577 VanDerWaalsContact CZ-O 3.23Å; R543-D577 IonicContact CZ-OD1 2.79Å; R543-D577 PolarHBondContact NE-O 3.5Å; R543-D577 IonicContact NE-OD1 2.71Å; R543-D577 PolarHBondContact NE-OD1 3.26Å; R543-D577 IonicContact NH2-OD1 3.19Å; A573-D577 PolarHBondContact O-N 3.37Å; R575-D577 VanDerWaalsContact C-N 3.31Å; D577-T579 PolarHBondContact O-N 2.95Å; D577-T579 VanDerWaalsContact O-N 3.12Å; D577-G580 WeakPolarHBondContact O-CA 3.35Å; D577-G580 PolarHBondContact O-N 3.49Å
578	T	93.8	Very high	95.5	Very high	18 Å²	18	25.8 Å²	25.8	11%	0.11	14%	0.14	C	C	.	.	H	α-helix	trans	-58.4	-34.1	-175.6	-51.7	0	0	0	0	113.2	R543 S574 R575 I641 V645	R543-T578 PolarHBondContact NH1-O 2.86Å; S574-T578 WeakPolarHBondContact O-CB 3.22Å; S574-T578 PolarHBondContact O-N 3.49Å; S574-T578 PolarHBondContact O-OG1 2.89Å; R575-T578 PolarHBondContact O-N 3.49Å; T578-I641 HydrophobicContact CG2-CG2 4.09Å; T578-I641 WeakPolarHBondContact O-CG2 3.24Å; T578-V645 HydrophobicContact CG2-CG2 3.52Å
579	T	94	Very high	95.5	Very high	17 Å²	17	25.4 Å²	25.4	10%	0.104	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	4.5	176.3	64.3	0	0	0	0	113.8	R575 D577 Q586 R605 V608	R575-T579 WeakPolarHBondContact O-CB 3.27Å; R575-T579 PolarHBondContact O-N 3.33Å; R575-T579 PolarHBondContact O-OG1 3.49Å; D577-T579 PolarHBondContact O-N 2.95Å; D577-T579 VanDerWaalsContact O-N 3.12Å; T579-Q586 PolarHBondContact O-OE1 2.9Å; T579-Q586 PolarHBondContact OG1-NE2 3.48Å; T579-R605 PolarHBondContact O-NH2 3.36Å; T579-V608 HydrophobicContact CG2-CG1 3.94Å
580	G	91.7	Very high	95.3	Very high	11 Å²	11	31.3 Å²	31.3	11%	0.113	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-67.9	157.6	-178.7	0	0	0	0	0	113.9	M576 D577	M576-G580 VanDerWaalsContact O-CA 3.3Å; M576-G580 WeakPolarHBondContact O-CA 3.32Å; M576-G580 PolarHBondContact O-N 2.97Å; M576-G580 VanDerWaalsContact O-N 3.08Å; D577-G580 WeakPolarHBondContact O-CA 3.35Å; D577-G580 PolarHBondContact O-N 3.49Å
581	V	92.4	Very high	95.3	Very high	23 Å²	23	30.7 Å²	30.7	14%	0.139	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-91.2	144	170.9	-172.9	0	0	0	0	108.9	R543 R605 L620	R543-V581 WeakPolarHBondContact CB-O 3.5Å; V581-R605 VanDerWaalsContact CG2-CZ 3.5Å; V581-R605 VanDerWaalsContact CG2-NH1 3.26Å; V581-L620 HydrophobicContact CG2-CD1 4.2Å; V581-L620 HydrophobicContact CG2-CD2 4.36Å
582	E	93.1	Very high	95.3	Very high	87 Å²	87	29.3 Å²	29.3	41%	0.407	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	146	171.1	54.1	176.7	-134.9	0	0	112.8	V444 K541 R584	V444-E582 HydrophobicContact CG2-CB 4.34Å; K541-E582 HydrophobicContact CB-CB 4.25Å; K541-E582 HydrophobicContact CD-CB 4.15Å; K541-E582 HydrophobicContact CD-CG 4.3Å; K541-E582 WeakPolarHBondContact CD-OE2 3.4Å; K541-E582 IonicContact NZ-OE1 3.3Å; K541-E582 PolarHBondContact NZ-OE1 3.32Å; K541-E582 IonicContact NZ-OE2 3.71Å; K541-E582 PolarHBondContact NZ-OE2 3.45Å; E582-R584 PolarHBondContact O-N 2.7Å
583	C	94.2	Very high	95.1	Very high	69 Å²	69	32.7 Å²	32.7	47%	0.466	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	26.1	179.6	-53.3	0	0	0	0	114.8	L542	L542-C583 WeakPolarHBondContact O-CA 3.22Å; L542-C583 PolarHBondContact O-N 3.36Å
584	R	94.8	Very high	95	Very high	41 Å²	41	34.4 Å²	34.4	16%	0.155	18%	0.181	C	C	.	.	S	Bend	trans	-139.9	158	174.5	-66.3	-162.3	-178.7	-153.3	7.7	112	I544 E582 D603 L620 Y621 P622 S624	I544-R584 PolarHBondContact N-O 3.31Å; E582-R584 PolarHBondContact O-N 2.7Å; R584-D603 IonicContact CZ-OD2 2.79Å; R584-D603 IonicContact NH1-OD2 2.69Å; R584-D603 PolarHBondContact NH1-OD2 3.47Å; R584-L620 HydrophobicContact CB-CD2 4.06Å; R584-Y621 CarbonylContact C-O 3.51Å; R584-Y621 WeakPolarHBondContact CA-O 3.15Å; R584-Y621 WeakPolarHBondContact CB-O 3.14Å; R584-P622 PolarHBondContact NH1-O 2.93Å; R584-P622 VanDerWaalsContact NH1-O 3.08Å; R584-S624 PolarHBondContact NH2-OG 3.1Å
585	V	97.4	Very high	94.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.5	168.7	-169.2	0	0	0	0	108.6	F518 L522 M525 I544 F546 V587 L620 Y621	F518-V585 HydrophobicContact CE2-CB 4.47Å; F518-V585 HydrophobicContact CE2-CG1 3.98Å; L522-V585 HydrophobicContact CD2-CG2 4.15Å; M525-V585 HydrophobicContact CE-CG2 3.59Å; M525-V585 HydrophobicContact SD-CG2 3.99Å; I544-V585 HydrophobicContact CB-CB 4.48Å; I544-V585 HydrophobicContact CB-CG1 4.17Å; I544-V585 HydrophobicContact CB-CG2 4.22Å; I544-V585 HydrophobicContact CD1-CG2 4.43Å; I544-V585 HydrophobicContact CG2-CG1 4.23Å; I544-V585 CarbonylContact O-C 3.57Å; I544-V585 WeakPolarHBondContact O-CA 3.31Å; F546-V585 HydrophobicContact CB-CG1 4.19Å; V585-V587 HydrophobicContact CG1-CG2 4.11Å; V585-L620 WeakPolarHBondContact O-CA 3.35Å; V585-Y621 PolarHBondContact N-O 2.91Å; V585-Y621 PolarHBondContact O-N 3.24Å
586	Q	97.6	Very high	94.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.6	172.4	-173.7	175.2	-63.7	0	0	110.6	I544 F546 M576 T579 R605 F619 L620	I544-Q586 PolarHBondContact O-N 3.07Å; F546-Q586 PolarHBondContact N-O 3.13Å; M576-Q586 HydrophobicContact CB-CG 4.44Å; M576-Q586 PolarHBondContact O-NE2 3.15Å; M576-Q586 HydrophobicContact SD-CG 4.06Å; M576-Q586 PolarHBondContact SD-NE2 3.18Å; T579-Q586 PolarHBondContact O-OE1 2.9Å; T579-Q586 PolarHBondContact OG1-NE2 3.48Å; Q586-R605 VanDerWaalsContact OE1-CD 3.26Å; Q586-F619 WeakPolarHBondContact CA-O 3.37Å; Q586-L620 HydrophobicContact CB-CD2 3.95Å; Q586-L620 HydrophobicContact CG-CD2 4.3Å
587	V	97.4	Very high	94.4	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141.4	-169.8	-173.4	0	0	0	0	110.3	F518 F546 V585 L595 F602 F619	F518-V587 HydrophobicContact CE2-CG2 4.13Å; F546-V587 HydrophobicContact CB-CG2 4.27Å; F546-V587 HydrophobicContact CD1-CG1 4.35Å; V585-V587 HydrophobicContact CG1-CG2 4.11Å; V587-L595 HydrophobicContact CG1-CD1 4.19Å; V587-F602 HydrophobicContact CB-CE1 4.38Å; V587-F602 HydrophobicContact CG2-CD1 4.29Å; V587-F602 HydrophobicContact CG2-CE1 3.76Å; V587-F619 PolarHBondContact N-O 3.23Å; V587-F619 PolarHBondContact O-N 3.23Å
588	S	95.9	Very high	94.1	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	161.6	174.4	68.1	0	0	0	0	112.9	N547 E590 S591 Y592	N547-S588 VanDerWaalsContact OD1-CB 3.27Å; N547-S588 WeakPolarHBondContact OD1-CB 3.47Å; N547-S588 PolarHBondContact OD1-OG 3.2Å; S588-E590 PolarHBondContact O-N 2.87Å; S588-S591 PolarHBondContact O-N 2.7Å; S588-S591 WeakPolarHBondContact OG-CB 3.37Å; S588-S591 PolarHBondContact OG-N 3.46Å; S588-S591 PolarHBondContact OG-OG 3.28Å; S588-Y592 WeakPolarHBondContact O-CB 3.36Å; S588-Y592 PolarHBondContact O-N 3.47Å
589	E	94.9	Very high	93.9	Very high	70 Å²	70	45 Å²	45	33%	0.327	26%	0.257	S	S	.	.	H	α-helix	trans	-55.8	-45	177.7	-175.5	166.3	-165.8	0	0	113.7	Y592 C593 K617 F619	E589-Y592 PolarHBondContact O-N 2.99Å; E589-C593 PolarHBondContact O-N 3.2Å; E589-C593 VanDerWaalsContact O-N 3.11Å; E589-C593 PolarHBondContact O-SG 3.48Å; E589-C593 VanDerWaalsContact O-SG 3.34Å; E589-K617 HydrophobicContact CB-CB 4.15Å; E589-K617 HydrophobicContact CG-CB 4.37Å; E589-K617 PolarHBondContact N-O 2.97Å; E589-K617 WeakPolarHBondContact OE1-CD 3.22Å; E589-K617 WeakPolarHBondContact OE1-CE 3.1Å; E589-K617 IonicContact OE1-NZ 3.44Å; E589-K617 PolarHBondContact OE1-NZ 3.42Å; E589-K617 WeakPolarHBondContact OE2-CB 3.39Å; E589-K617 IonicContact OE2-NZ 3.7Å; E589-F619 HydrophobicContact CB-CE2 4.26Å; E589-F619 HydrophobicContact CG-CE2 4.35Å
590	E	93	Very high	93.9	Very high	130 Å²	130	45.3 Å²	45.3	61%	0.607	26%	0.257	S	S	*	.	H	α-helix	trans	-64.5	-43	178.9	-65.1	176.4	179.1	0	0	111.1	H548 S588 C593 V594	H548-E590 PolarHBondContact CE1-O 3.31Å; S588-E590 PolarHBondContact O-N 2.87Å; E590-C593 PolarHBondContact O-N 2.96Å; E590-V594 PolarHBondContact O-N 3.47Å
591	S	95.8	Very high	93.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69.5	-35	179.6	-55.2	0	0	0	0	112.5	N547 H548 S588 V594 L595	N547-S591 WeakPolarHBondContact CA-OG 3.42Å; N547-S591 PolarHBondContact OD1-OG 3.47Å; H548-S591 PolarHBondContact N-OG 3.04Å; H548-S591 WeakPolarHBondContact ND1-CA 3.39Å; H548-S591 PolarHBondContact ND1-OG 2.81Å; S588-S591 PolarHBondContact O-N 2.7Å; S588-S591 WeakPolarHBondContact OG-CB 3.37Å; S588-S591 PolarHBondContact OG-N 3.46Å; S588-S591 PolarHBondContact OG-OG 3.28Å; S591-V594 PolarHBondContact O-N 3.35Å; S591-L595 WeakPolarHBondContact O-CB 3.33Å; S591-L595 WeakPolarHBondContact O-CG 3.36Å; S591-L595 PolarHBondContact O-N 2.68Å
592	Y	95.6	Very high	94	Very high	73 Å²	73	50.3 Å²	50.3	29%	0.286	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-48.1	170.7	162.9	-95	0	0	0	111.2	S588 E589 V594 L595 S596 F602 F619	S588-Y592 WeakPolarHBondContact O-CB 3.36Å; S588-Y592 PolarHBondContact O-N 3.47Å; E589-Y592 PolarHBondContact O-N 2.99Å; Y592-V594 PolarHBondContact O-N 2.94Å; Y592-L595 PolarHBondContact O-N 2.97Å; Y592-S596 VanDerWaalsContact CE2-OG 3.25Å; Y592-S596 WeakPolarHBondContact CE2-OG 3.47Å; Y592-S596 WeakPolarHBondContact O-CB 3.42Å; Y592-S596 PolarHBondContact O-N 3.05Å; Y592-S596 PolarHBondContact O-OG 2.86Å; Y592-F602 HydrophobicContact CD2-CB 3.88Å; Y592-F602 AromaticContact CD2-CD2 3.56Å; Y592-F602 HydrophobicContact CD2-CD2 3.56Å; Y592-F602 HydrophobicContact CD2-CE2 4.29Å; Y592-F602 AromaticContact CD2-CG 3.82Å; Y592-F602 HydrophobicContact CD2-CG 3.82Å; Y592-F602 HydrophobicContact CE2-CB 3.94Å; Y592-F602 AromaticContact CE2-CD2 3.87Å; Y592-F602 HydrophobicContact CE2-CD2 3.87Å; Y592-F602 HydrophobicContact CE2-CG 4.22Å; Y592-F619 HydrophobicContact CD1-CD1 4.25Å; Y592-F619 HydrophobicContact CD1-CD2 4.16Å; Y592-F619 AromaticContact CD1-CE1 3.88Å; Y592-F619 HydrophobicContact CD1-CE1 3.88Å; Y592-F619 AromaticContact CD1-CE2 3.82Å; Y592-F619 HydrophobicContact CD1-CE2 3.82Å; Y592-F619 HydrophobicContact CD1-CG 4.37Å; Y592-F619 AromaticContact CD1-CZ 3.66Å; Y592-F619 HydrophobicContact CD1-CZ 3.66Å; Y592-F619 HydrophobicContact CD2-CB 4.03Å; Y592-F619 AromaticContact CD2-CD1 3.46Å; Y592-F619 HydrophobicContact CD2-CD1 3.46Å; Y592-F619 VanDerWaalsContact CD2-CD1 3.46Å; Y592-F619 HydrophobicContact CD2-CD2 4.11Å; Y592-F619 AromaticContact CD2-CE1 3.88Å; Y592-F619 HydrophobicContact CD2-CE1 3.88Å; Y592-F619 HydrophobicContact CD2-CE2 4.49Å; Y592-F619 AromaticContact CD2-CG 3.59Å; Y592-F619 HydrophobicContact CD2-CG 3.59Å; Y592-F619 HydrophobicContact CD2-CZ 4.38Å; Y592-F619 HydrophobicContact CE1-CD1 4.41Å; Y592-F619 AromaticContact CE1-CE1 3.82Å; Y592-F619 HydrophobicContact CE1-CE1 3.82Å; Y592-F619 HydrophobicContact CE1-CE2 4.49Å; Y592-F619 AromaticContact CE1-CZ 3.87Å; Y592-F619 HydrophobicContact CE1-CZ 3.87Å; Y592-F619 AromaticContact CE2-CD1 3.65Å; Y592-F619 HydrophobicContact CE2-CD1 3.65Å; Y592-F619 AromaticContact CE2-CE1 3.8Å; Y592-F619 HydrophobicContact CE2-CE1 3.8Å; Y592-F619 HydrophobicContact CE2-CG 4.26Å; Y592-F619 HydrophobicContact CG-CB 4.35Å; Y592-F619 AromaticContact CG-CD1 3.79Å; Y592-F619 HydrophobicContact CG-CD1 3.79Å; Y592-F619 AromaticContact CG-CD2 3.66Å; Y592-F619 HydrophobicContact CG-CD2 3.66Å; Y592-F619 AromaticContact CG-CE1 3.91Å; Y592-F619 HydrophobicContact CG-CE1 3.91Å; Y592-F619 AromaticContact CG-CE2 3.82Å; Y592-F619 HydrophobicContact CG-CE2 3.82Å; Y592-F619 AromaticContact CG-CG 3.66Å; Y592-F619 HydrophobicContact CG-CG 3.66Å; Y592-F619 AromaticContact CG-CZ 3.94Å; Y592-F619 HydrophobicContact CG-CZ 3.94Å; Y592-F619 AromaticContact CZ-CE1 3.79Å
593	C	93.3	Very high	94	Very high	82 Å²	82	47.3 Å²	47.3	55%	0.554	26%	0.262	S	S	*	.	H	α-helix	trans	-58.1	-36.3	178.8	-70.4	0	0	0	0	113.1	E589 E590	E589-C593 PolarHBondContact O-N 3.2Å; E589-C593 VanDerWaalsContact O-N 3.11Å; E589-C593 PolarHBondContact O-SG 3.48Å; E589-C593 VanDerWaalsContact O-SG 3.34Å; E590-C593 PolarHBondContact O-N 2.96Å
594	V	93.9	Very high	93.9	Very high	36 Å²	36	49.5 Å²	49.5	22%	0.218	26%	0.262	C	S	.	.	H	α-helix	trans	-77.4	-45.2	178.4	176.5	0	0	0	0	111.8	Q511 L514 E590 S591 Y592 G597 M598	Q511-V594 HydrophobicContact CB-CG1 4.22Å; Q511-V594 HydrophobicContact CG-CG1 4.14Å; L514-V594 HydrophobicContact CD1-CG1 3.95Å; E590-V594 PolarHBondContact O-N 3.47Å; S591-V594 PolarHBondContact O-N 3.35Å; Y592-V594 PolarHBondContact O-N 2.94Å; V594-G597 PolarHBondContact O-N 2.88Å; V594-M598 HydrophobicContact CG1-CE 3.65Å
595	L	94.3	Very high	93.7	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-73.5	-32.6	-177.5	-67.9	170	0	0	0	113	F518 F546 V587 S591 Y592 G597 M598 Y600 F602	F518-L595 HydrophobicContact CB-CD2 4.06Å; F518-L595 HydrophobicContact CD2-CD1 3.59Å; F518-L595 HydrophobicContact CD2-CD2 4.47Å; F518-L595 HydrophobicContact CE2-CD1 3.85Å; F518-L595 HydrophobicContact CG-CD1 4.07Å; F518-L595 HydrophobicContact CG-CD2 4.14Å; F546-L595 HydrophobicContact CD1-CD1 4.31Å; F546-L595 HydrophobicContact CE1-CD1 4.07Å; F546-L595 HydrophobicContact CZ-CD1 4.34Å; V587-L595 HydrophobicContact CG1-CD1 4.19Å; S591-L595 WeakPolarHBondContact O-CB 3.33Å; S591-L595 WeakPolarHBondContact O-CG 3.36Å; S591-L595 PolarHBondContact O-N 2.68Å; Y592-L595 PolarHBondContact O-N 2.97Å; L595-G597 PolarHBondContact O-N 3.29Å; L595-M598 HydrophobicContact CD2-SD 4.14Å; L595-M598 CarbonylContact O-C 3.58Å; L595-M598 WeakPolarHBondContact O-CA 3.43Å; L595-M598 WeakPolarHBondContact O-CB 3.43Å; L595-M598 PolarHBondContact O-N 3.48Å; L595-Y600 HydrophobicContact CB-CD2 4.11Å; L595-Y600 HydrophobicContact CD2-CD2 4.12Å; L595-Y600 HydrophobicContact CD2-CE2 4.2Å; L595-Y600 WeakPolarHBondContact O-CD2 3.43Å; L595-Y600 PolarHBondContact O-N 2.89Å; L595-F602 HydrophobicContact CB-CE2 3.82Å; L595-F602 HydrophobicContact CB-CZ 3.66Å; L595-F602 HydrophobicContact CD1-CZ 3.96Å; L595-F602 HydrophobicContact CG-CZ 4.47Å
596	S	92.5	Very high	93.3	Very high	45 Å²	45	49 Å²	49	32%	0.315	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-68.7	-17.6	171.2	-71.1	0	0	0	0	113.3	Y592 M598 Y600 F602	Y592-S596 VanDerWaalsContact CE2-OG 3.25Å; Y592-S596 WeakPolarHBondContact CE2-OG 3.47Å; Y592-S596 WeakPolarHBondContact O-CB 3.42Å; Y592-S596 PolarHBondContact O-N 3.05Å; Y592-S596 PolarHBondContact O-OG 2.86Å; S596-M598 PolarHBondContact O-N 2.97Å; S596-Y600 PolarHBondContact OG-O 3.37Å; S596-F602 WeakPolarHBondContact OG-CD2 3.43Å
597	G	89.4	Confident	93	Very high	66 Å²	66	52.5 Å²	52.5	68%	0.68	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-76.1	-1.2	165.2	0	0	0	0	0	114.3	V594 L595	V594-G597 PolarHBondContact O-N 2.88Å; L595-G597 PolarHBondContact O-N 3.29Å
598	M	91.2	Very high	92.7	Very high	31 Å²	31	53.5 Å²	53.5	15%	0.153	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-120.9	28.6	179.7	-53.7	177.2	-172.4	0	0	111.9	Q511 R515 V594 L595 S596 Y600	Q511-M598 HydrophobicContact CB-CE 3.45Å; Q511-M598 VanDerWaalsContact CB-CE 3.45Å; Q511-M598 HydrophobicContact CG-CE 4.5Å; R515-M598 HydrophobicContact CB-SD 3.81Å; R515-M598 HydrophobicContact CG-SD 4.36Å; V594-M598 HydrophobicContact CG1-CE 3.65Å; L595-M598 HydrophobicContact CD2-SD 4.14Å; L595-M598 CarbonylContact O-C 3.58Å; L595-M598 WeakPolarHBondContact O-CA 3.43Å; L595-M598 WeakPolarHBondContact O-CB 3.43Å; L595-M598 PolarHBondContact O-N 3.48Å; S596-M598 PolarHBondContact O-N 2.97Å; M598-Y600 VanDerWaalsContact C-N 3.27Å; M598-Y600 HydrophobicContact CB-CD2 3.96Å; M598-Y600 HydrophobicContact CB-CE2 3.95Å; M598-Y600 PolarHBondContact O-N 3.38Å
599	D	89.4	Confident	92.3	Very high	159 Å²	159	58.5 Å²	58.5	85%	0.85	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	16.8	177.4	-53.4	-47.5	0	0	0	116.2
600	Y	93.1	Very high	92	Very high	24 Å²	24	55.5 Å²	55.5	9%	0.094	31%	0.305	C	S	.	.			trans	-84.7	123.3	169.5	-60.9	-72.7	0	0	0	112	R515 F518 E519 L522 L595 S596 M598 F602 Y621	R515-Y600 HydrophobicContact CG-CE2 4.33Å; F518-Y600 AromaticContact CD1-CD1 3.93Å; F518-Y600 HydrophobicContact CD1-CD1 3.93Å; F518-Y600 HydrophobicContact CD1-CD2 4.21Å; F518-Y600 AromaticContact CD1-CE1 3.69Å; F518-Y600 HydrophobicContact CD1-CE1 3.69Å; F518-Y600 HydrophobicContact CD1-CE2 4Å; F518-Y600 HydrophobicContact CD1-CG 4.19Å; F518-Y600 AromaticContact CD1-CZ 3.75Å; F518-Y600 AromaticContact CE1-CD1 3.61Å; F518-Y600 HydrophobicContact CE1-CD1 3.61Å; F518-Y600 HydrophobicContact CE1-CD2 4.37Å; F518-Y600 AromaticContact CE1-CE1 3.82Å; F518-Y600 HydrophobicContact CE1-CE1 3.82Å; F518-Y600 AromaticContact CE1-CG 3.92Å; F518-Y600 HydrophobicContact CE1-CG 3.92Å; E519-Y600 WeakPolarHBondContact CG-OH 3.33Å; E519-Y600 WeakPolarHBondContact OE1-CE1 3.34Å; E519-Y600 PolarHBondContact OE1-OH 2.92Å; L522-Y600 HydrophobicContact CD1-CE1 4.48Å; L595-Y600 HydrophobicContact CB-CD2 4.11Å; L595-Y600 HydrophobicContact CD2-CD2 4.12Å; L595-Y600 HydrophobicContact CD2-CE2 4.2Å; L595-Y600 WeakPolarHBondContact O-CD2 3.43Å; L595-Y600 PolarHBondContact O-N 2.89Å; S596-Y600 PolarHBondContact OG-O 3.37Å; M598-Y600 VanDerWaalsContact C-N 3.27Å; M598-Y600 HydrophobicContact CB-CD2 3.96Å; M598-Y600 HydrophobicContact CB-CE2 3.95Å; M598-Y600 PolarHBondContact O-N 3.38Å; Y600-F602 WeakPolarHBondContact O-CD2 3.44Å; Y600-F602 VanDerWaalsContact O-CE2 3.31Å; Y600-F602 WeakPolarHBondContact O-CE2 3.08Å; Y600-Y621 HydrophobicContact CD1-CE2 4.15Å
601	E	92.6	Very high	91.5	Very high	118 Å²	118	56.4 Å²	56.4	55%	0.551	31%	0.307	S	S	*	.			trans	-90.8	137.2	172.3	-56.2	-161.8	150.7	0	0	112.3	Y621 K623	E601-Y621 VanDerWaalsContact O-CD2 3.28Å; E601-Y621 WeakPolarHBondContact O-CD2 3.47Å; E601-K623 HydrophobicContact CB-CB 4.48Å; E601-K623 HydrophobicContact CB-CD 3.87Å; E601-K623 IonicContact OE1-NZ 2.75Å; E601-K623 WeakPolarHBondContact OE2-CD 3.3Å; E601-K623 WeakPolarHBondContact OE2-CE 3.36Å; E601-K623 IonicContact OE2-NZ 2.65Å; E601-K623 PolarHBondContact OE2-NZ 3.11Å
602	F	93.8	Very high	90.9	Very high	21 Å²	21	60.5 Å²	60.5	9%	0.092	35%	0.349	C	S	.	.			trans	-128.7	154.1	-178.5	-59.1	-95.7	0	0	0	112.3	F518 V587 Y592 L595 S596 Y600 F619 L620 Y621	F518-F602 HydrophobicContact CE2-CE1 4.1Å; F518-F602 HydrophobicContact CE2-CZ 4.32Å; F518-F602 AromaticContact CZ-CE1 3.75Å; F518-F602 HydrophobicContact CZ-CE1 3.75Å; F518-F602 AromaticContact CZ-CZ 3.92Å; F518-F602 HydrophobicContact CZ-CZ 3.92Å; V587-F602 HydrophobicContact CB-CE1 4.38Å; V587-F602 HydrophobicContact CG2-CD1 4.29Å; V587-F602 HydrophobicContact CG2-CE1 3.76Å; Y592-F602 HydrophobicContact CD2-CB 3.88Å; Y592-F602 AromaticContact CD2-CD2 3.56Å; Y592-F602 HydrophobicContact CD2-CD2 3.56Å; Y592-F602 HydrophobicContact CD2-CE2 4.29Å; Y592-F602 AromaticContact CD2-CG 3.82Å; Y592-F602 HydrophobicContact CD2-CG 3.82Å; Y592-F602 HydrophobicContact CE2-CB 3.94Å; Y592-F602 AromaticContact CE2-CD2 3.87Å; Y592-F602 HydrophobicContact CE2-CD2 3.87Å; Y592-F602 HydrophobicContact CE2-CG 4.22Å; L595-F602 HydrophobicContact CB-CE2 3.82Å; L595-F602 HydrophobicContact CB-CZ 3.66Å; L595-F602 HydrophobicContact CD1-CZ 3.96Å; L595-F602 HydrophobicContact CG-CZ 4.47Å; S596-F602 WeakPolarHBondContact OG-CD2 3.43Å; Y600-F602 WeakPolarHBondContact O-CD2 3.44Å; Y600-F602 VanDerWaalsContact O-CE2 3.31Å; Y600-F602 WeakPolarHBondContact O-CE2 3.08Å; F602-F619 HydrophobicContact CB-CB 4.13Å; F602-L620 WeakPolarHBondContact CA-O 3.48Å; F602-Y621 HydrophobicContact CD1-CD2 4.27Å; F602-Y621 HydrophobicContact CD1-CG 4.5Å; F602-Y621 HydrophobicContact CE1-CD2 4.11Å; F602-Y621 HydrophobicContact CE1-CG 4.3Å
603	D	93.4	Very high	90.4	Very high	24 Å²	24	62 Å²	62	13%	0.128	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	139.2	163.7	-67.4	-33.4	0	0	0	110.4	R584 R605 F619 L620 K623 S624	R584-D603 IonicContact CZ-OD2 2.79Å; R584-D603 IonicContact NH1-OD2 2.69Å; R584-D603 PolarHBondContact NH1-OD2 3.47Å; D603-R605 PolarHBondContact O-N 3.32Å; D603-F619 CarbonylContact O-C 3.54Å; D603-F619 VanDerWaalsContact O-CA 3.24Å; D603-F619 WeakPolarHBondContact O-CA 3.47Å; D603-L620 HydrophobicContact CB-CB 4.4Å; D603-L620 PolarHBondContact N-O 3.29Å; D603-L620 PolarHBondContact O-N 3.18Å; D603-K623 VanDerWaalsContact OD1-CG 3.31Å; D603-K623 WeakPolarHBondContact OD1-CG 3.22Å; D603-S624 PolarHBondContact OD1-N 3.47Å; D603-S624 VanDerWaalsContact OD2-CB 3.27Å; D603-S624 WeakPolarHBondContact OD2-CB 3.49Å; D603-S624 PolarHBondContact OD2-N 2.83Å
604	Y	93	Very high	90.2	Very high	116 Å²	116	59.5 Å²	59.5	46%	0.455	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	113.4	164.5	179.2	-117.8	0	0	0	109.8	G606 T607 K617 F619	Y604-G606 VanDerWaalsContact CZ-CA 3.43Å; Y604-T607 PolarHBondContact OH-OG1 3.31Å; Y604-K617 HydrophobicContact CE2-CB 4.06Å; Y604-K617 HydrophobicContact CE2-CD 4.31Å; Y604-K617 HydrophobicContact CE2-CG 4.2Å; Y604-F619 HydrophobicContact CD2-CD1 4.09Å; Y604-F619 AromaticContact CD2-CE1 3.63Å; Y604-F619 HydrophobicContact CD2-CE1 3.63Å; Y604-F619 HydrophobicContact CD2-CE2 4.42Å; Y604-F619 AromaticContact CD2-CZ 3.81Å; Y604-F619 HydrophobicContact CD2-CZ 3.81Å; Y604-F619 HydrophobicContact CE2-CZ 4.32Å; Y604-F619 HydrophobicContact CG-CE1 4.35Å
605	R	89.3	Confident	90	Very high	15 Å²	15	64 Å²	64	6%	0.057	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-37.2	178.9	176.3	172.1	176.4	53.5	-9.8	111.9	T579 V581 Q586 D603 T618 L620 Q634 L635	T579-R605 PolarHBondContact O-NH2 3.36Å; V581-R605 VanDerWaalsContact CG2-CZ 3.5Å; V581-R605 VanDerWaalsContact CG2-NH1 3.26Å; Q586-R605 VanDerWaalsContact OE1-CD 3.26Å; D603-R605 PolarHBondContact O-N 3.32Å; R605-T618 WeakPolarHBondContact CB-O 3Å; R605-T618 PolarHBondContact N-O 3.24Å; R605-L620 HydrophobicContact CB-CD1 3.95Å; R605-L620 HydrophobicContact CB-CG 4.02Å; R605-L620 HydrophobicContact CG-CD1 3.96Å; R605-L620 HydrophobicContact CG-CG 4.31Å; R605-Q634 PolarHBondContact NH1-O 3.29Å; R605-L635 HydrophobicContact CG-CD2 4.46Å; R605-L635 WeakPolarHBondContact O-CD2 3.25Å
606	G	90.8	Very high	89.9	Confident	16 Å²	16	65.5 Å²	65.5	17%	0.165	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.1	-166.7	-169	0	0	0	0	0	112.2	Y604 T618	Y604-G606 VanDerWaalsContact CZ-CA 3.43Å; G606-T618 PolarHBondContact O-N 2.9Å; G606-T618 PolarHBondContact O-OG1 2.87Å
607	T	90.3	Very high	90	Very high	73 Å²	73	67.5 Å²	67.5	45%	0.448	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.7	-175.7	-34.7	0	0	0	0	110.3	Y604 Q615 M616	Y604-T607 PolarHBondContact OH-OG1 3.31Å; T607-Q615 HydrophobicContact CG2-CB 3.67Å; T607-M616 CarbonylContact C-O 3.57Å; T607-M616 VanDerWaalsContact CA-O 3.32Å; T607-M616 WeakPolarHBondContact CA-O 3.45Å; T607-M616 VanDerWaalsContact CG2-C 3.5Å; T607-M616 WeakPolarHBondContact CG2-O 3.43Å
608	V	90.5	Very high	90.2	Very high	20 Å²	20	64.4 Å²	64.4	12%	0.121	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.1	-178.3	-180	0	0	0	0	109.2	T579 V610 M616 T618	T579-V608 HydrophobicContact CG2-CG1 3.94Å; V608-V610 PolarHBondContact O-N 3.21Å; V608-M616 PolarHBondContact N-O 3.39Å; V608-M616 PolarHBondContact O-N 3.33Å; V608-T618 HydrophobicContact CB-CG2 3.99Å; V608-T618 HydrophobicContact CG2-CG2 3.92Å
609	N	89.1	Confident	90.5	Very high	109 Å²	109	63.8 Å²	63.8	58%	0.583	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	109.5	-179.8	-175.5	56.5	0	0	0	111.3	G614	N609-G614 CarbonylContact C-O 3.59Å; N609-G614 WeakPolarHBondContact CA-O 3.29Å
610	V	87.6	Confident	90.8	Very high	6 Å²	6	56.2 Å²	56.2	4%	0.036	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.7	178.6	176.4	0	0	0	0	109.4	R575 M576 V608 G612 K613 G614 M616	R575-V610 HydrophobicContact CB-CG1 4.48Å; R575-V610 HydrophobicContact CG-CG1 4.47Å; M576-V610 HydrophobicContact CE-CG2 3.83Å; V608-V610 PolarHBondContact O-N 3.21Å; V610-G612 PolarHBondContact O-N 3.14Å; V610-K613 HydrophobicContact CB-CB 4.15Å; V610-K613 HydrophobicContact CG1-CB 4.15Å; V610-K613 HydrophobicContact CG1-CG 4.21Å; V610-K613 PolarHBondContact O-N 3.26Å; V610-G614 PolarHBondContact N-O 2.95Å; V610-G614 PolarHBondContact O-N 3.28Å; V610-M616 HydrophobicContact CB-CB 4.48Å; V610-M616 HydrophobicContact CG2-CB 3.98Å; V610-M616 HydrophobicContact CG2-SD 4.09Å
611	K	82.9	Confident	90.9	Very high	150 Å²	150	57.7 Å²	57.7	65%	0.652	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	124.7	-179.8	-172.9	173.9	-177.1	171	0	110.4	K613	K611-K613 VanDerWaalsContact C-N 3.33Å; K611-K613 PolarHBondContact O-N 2.65Å
612	G	81.9	Confident	90.7	Very high	85 Å²	85	54.8 Å²	54.8	88%	0.876	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	-18.9	-176.9	0	0	0	0	0	115.6	V610	V610-G612 PolarHBondContact O-N 3.14Å
613	K	85.3	Confident	90.3	Very high	105 Å²	105	58.9 Å²	58.9	46%	0.457	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-21.5	175.4	-64.9	-71.3	179.7	168.3	0	113.6	D568 V610 K611 M616	D568-K613 WeakPolarHBondContact OD2-CE 3.42Å; D568-K613 IonicContact OD2-NZ 3.94Å; D568-K613 PolarHBondContact OD2-NZ 3.07Å; V610-K613 HydrophobicContact CB-CB 4.15Å; V610-K613 HydrophobicContact CG1-CB 4.15Å; V610-K613 HydrophobicContact CG1-CG 4.21Å; V610-K613 PolarHBondContact O-N 3.26Å; K611-K613 VanDerWaalsContact C-N 3.33Å; K611-K613 PolarHBondContact O-N 2.65Å; K613-M616 HydrophobicContact CB-CE 4.17Å; K613-M616 HydrophobicContact CD-CE 4.49Å; K613-M616 HydrophobicContact CG-CE 4.02Å
614	G	89.6	Confident	89.6	Confident	29 Å²	29	59.6 Å²	59.6	30%	0.299	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	76	-141.4	-171.1	0	0	0	0	0	111	N609 V610 M616	N609-G614 CarbonylContact C-O 3.59Å; N609-G614 WeakPolarHBondContact CA-O 3.29Å; V610-G614 PolarHBondContact N-O 2.95Å; V610-G614 PolarHBondContact O-N 3.28Å; G614-M616 PolarHBondContact O-N 3.31Å
615	Q	90.6	Very high	88.2	Confident	130 Å²	130	60 Å²	60	61%	0.607	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	112.9	-175.2	-69.3	-71	19.2	0	0	111.4	T607	T607-Q615 HydrophobicContact CG2-CB 3.67Å
616	M	91.6	Very high	86.7	Confident	33 Å²	33	65.8 Å²	65.8	16%	0.163	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135	-178.5	177.6	175.9	-76.8	0	0	110.9	I572 M576 T607 V608 V610 K613 G614	I572-M616 HydrophobicContact CD1-CE 4.27Å; I572-M616 HydrophobicContact CG2-CE 4.27Å; I572-M616 HydrophobicContact CG2-SD 3.98Å; M576-M616 HydrophobicContact CE-SD 4.23Å; T607-M616 CarbonylContact C-O 3.57Å; T607-M616 VanDerWaalsContact CA-O 3.32Å; T607-M616 WeakPolarHBondContact CA-O 3.45Å; T607-M616 VanDerWaalsContact CG2-C 3.5Å; T607-M616 WeakPolarHBondContact CG2-O 3.43Å; V608-M616 PolarHBondContact N-O 3.39Å; V608-M616 PolarHBondContact O-N 3.33Å; V610-M616 HydrophobicContact CB-CB 4.48Å; V610-M616 HydrophobicContact CG2-CB 3.98Å; V610-M616 HydrophobicContact CG2-SD 4.09Å; K613-M616 HydrophobicContact CB-CE 4.17Å; K613-M616 HydrophobicContact CD-CE 4.49Å; K613-M616 HydrophobicContact CG-CE 4.02Å; G614-M616 PolarHBondContact O-N 3.31Å
617	K	93.6	Very high	84.4	Confident	88 Å²	88	71.3 Å²	71.3	38%	0.383	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	140.4	173.6	-65.1	-176.2	-145.1	144.5	0	110.4	E589 Y604 F619	E589-K617 HydrophobicContact CB-CB 4.15Å; E589-K617 HydrophobicContact CG-CB 4.37Å; E589-K617 PolarHBondContact N-O 2.97Å; E589-K617 WeakPolarHBondContact OE1-CD 3.22Å; E589-K617 WeakPolarHBondContact OE1-CE 3.1Å; E589-K617 IonicContact OE1-NZ 3.44Å; E589-K617 PolarHBondContact OE1-NZ 3.42Å; E589-K617 WeakPolarHBondContact OE2-CB 3.39Å; E589-K617 IonicContact OE2-NZ 3.7Å; Y604-K617 HydrophobicContact CE2-CB 4.06Å; Y604-K617 HydrophobicContact CE2-CD 4.31Å; Y604-K617 HydrophobicContact CE2-CG 4.2Å; K617-F619 HydrophobicContact CB-CE2 4.23Å
618	T	95.1	Very high	82.5	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	150.9	-176.6	58.6	0	0	0	0	111.1	M576 R605 G606 V608	M576-T618 HydrophobicContact CE-CG2 3.92Å; M576-T618 HydrophobicContact SD-CG2 3.72Å; R605-T618 WeakPolarHBondContact CB-O 3Å; R605-T618 PolarHBondContact N-O 3.24Å; G606-T618 PolarHBondContact O-N 2.9Å; G606-T618 PolarHBondContact O-OG1 2.87Å; V608-T618 HydrophobicContact CB-CG2 3.99Å; V608-T618 HydrophobicContact CG2-CG2 3.92Å
619	F	96.3	Very high	80.6	Confident	18 Å²	18	75.2 Å²	75.2	8%	0.079	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	155.6	-175.7	-62.7	-94.8	0	0	0	109.9	Q586 V587 E589 Y592 F602 D603 Y604 K617	Q586-F619 WeakPolarHBondContact CA-O 3.37Å; V587-F619 PolarHBondContact N-O 3.23Å; V587-F619 PolarHBondContact O-N 3.23Å; E589-F619 HydrophobicContact CB-CE2 4.26Å; E589-F619 HydrophobicContact CG-CE2 4.35Å; Y592-F619 HydrophobicContact CD1-CD1 4.25Å; Y592-F619 HydrophobicContact CD1-CD2 4.16Å; Y592-F619 AromaticContact CD1-CE1 3.88Å; Y592-F619 HydrophobicContact CD1-CE1 3.88Å; Y592-F619 AromaticContact CD1-CE2 3.82Å; Y592-F619 HydrophobicContact CD1-CE2 3.82Å; Y592-F619 HydrophobicContact CD1-CG 4.37Å; Y592-F619 AromaticContact CD1-CZ 3.66Å; Y592-F619 HydrophobicContact CD1-CZ 3.66Å; Y592-F619 HydrophobicContact CD2-CB 4.03Å; Y592-F619 AromaticContact CD2-CD1 3.46Å; Y592-F619 HydrophobicContact CD2-CD1 3.46Å; Y592-F619 VanDerWaalsContact CD2-CD1 3.46Å; Y592-F619 HydrophobicContact CD2-CD2 4.11Å; Y592-F619 AromaticContact CD2-CE1 3.88Å; Y592-F619 HydrophobicContact CD2-CE1 3.88Å; Y592-F619 HydrophobicContact CD2-CE2 4.49Å; Y592-F619 AromaticContact CD2-CG 3.59Å; Y592-F619 HydrophobicContact CD2-CG 3.59Å; Y592-F619 HydrophobicContact CD2-CZ 4.38Å; Y592-F619 HydrophobicContact CE1-CD1 4.41Å; Y592-F619 AromaticContact CE1-CE1 3.82Å; Y592-F619 HydrophobicContact CE1-CE1 3.82Å; Y592-F619 HydrophobicContact CE1-CE2 4.49Å; Y592-F619 AromaticContact CE1-CZ 3.87Å; Y592-F619 HydrophobicContact CE1-CZ 3.87Å; Y592-F619 AromaticContact CE2-CD1 3.65Å; Y592-F619 HydrophobicContact CE2-CD1 3.65Å; Y592-F619 AromaticContact CE2-CE1 3.8Å; Y592-F619 HydrophobicContact CE2-CE1 3.8Å; Y592-F619 HydrophobicContact CE2-CG 4.26Å; Y592-F619 HydrophobicContact CG-CB 4.35Å; Y592-F619 AromaticContact CG-CD1 3.79Å; Y592-F619 HydrophobicContact CG-CD1 3.79Å; Y592-F619 AromaticContact CG-CD2 3.66Å; Y592-F619 HydrophobicContact CG-CD2 3.66Å; Y592-F619 AromaticContact CG-CE1 3.91Å; Y592-F619 HydrophobicContact CG-CE1 3.91Å; Y592-F619 AromaticContact CG-CE2 3.82Å; Y592-F619 HydrophobicContact CG-CE2 3.82Å; Y592-F619 AromaticContact CG-CG 3.66Å; Y592-F619 HydrophobicContact CG-CG 3.66Å; Y592-F619 AromaticContact CG-CZ 3.94Å; Y592-F619 HydrophobicContact CG-CZ 3.94Å; Y592-F619 AromaticContact CZ-CE1 3.79Å; F602-F619 HydrophobicContact CB-CB 4.13Å; D603-F619 CarbonylContact O-C 3.54Å; D603-F619 VanDerWaalsContact O-CA 3.24Å; D603-F619 WeakPolarHBondContact O-CA 3.47Å; Y604-F619 HydrophobicContact CD2-CD1 4.09Å; Y604-F619 AromaticContact CD2-CE1 3.63Å; Y604-F619 HydrophobicContact CD2-CE1 3.63Å; Y604-F619 HydrophobicContact CD2-CE2 4.42Å; Y604-F619 AromaticContact CD2-CZ 3.81Å; Y604-F619 HydrophobicContact CD2-CZ 3.81Å; Y604-F619 HydrophobicContact CE2-CZ 4.32Å; Y604-F619 HydrophobicContact CG-CE1 4.35Å; K617-F619 HydrophobicContact CB-CE2 4.23Å
620	L	95.8	Very high	78.8	Confident	0 Å²	0	71 Å²	71	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.9	-178.8	-73.4	166.4	0	0	0	111.8	V581 R584 V585 Q586 F602 D603 R605	V581-L620 HydrophobicContact CG2-CD1 4.2Å; V581-L620 HydrophobicContact CG2-CD2 4.36Å; R584-L620 HydrophobicContact CB-CD2 4.06Å; V585-L620 WeakPolarHBondContact O-CA 3.35Å; Q586-L620 HydrophobicContact CB-CD2 3.95Å; Q586-L620 HydrophobicContact CG-CD2 4.3Å; F602-L620 WeakPolarHBondContact CA-O 3.48Å; D603-L620 HydrophobicContact CB-CB 4.4Å; D603-L620 PolarHBondContact N-O 3.29Å; D603-L620 PolarHBondContact O-N 3.18Å; R605-L620 HydrophobicContact CB-CD1 3.95Å; R605-L620 HydrophobicContact CB-CG 4.02Å; R605-L620 HydrophobicContact CG-CD1 3.96Å; R605-L620 HydrophobicContact CG-CG 4.31Å
621	Y	95.3	Very high	77	Confident	55 Å²	55	73.4 Å²	73.4	22%	0.216	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.4	168.9	-172.9	-83.3	0	0	0	110	F518 L522 R584 V585 Y600 E601 F602	F518-Y621 HydrophobicContact CE1-CD1 4.3Å; F518-Y621 HydrophobicContact CE1-CD2 4.21Å; F518-Y621 HydrophobicContact CE1-CE1 4.47Å; F518-Y621 HydrophobicContact CE1-CE2 4.35Å; F518-Y621 HydrophobicContact CE1-CG 4.19Å; F518-Y621 HydrophobicContact CZ-CD1 4.01Å; F518-Y621 AromaticContact CZ-CD2 3.99Å; F518-Y621 HydrophobicContact CZ-CD2 3.99Å; F518-Y621 AromaticContact CZ-CG 3.68Å; F518-Y621 HydrophobicContact CZ-CG 3.68Å; L522-Y621 HydrophobicContact CD1-CE1 3.68Å; L522-Y621 HydrophobicContact CD2-CD1 3.51Å; L522-Y621 HydrophobicContact CD2-CE1 3.38Å; L522-Y621 HydrophobicContact CG-CE1 4.19Å; R584-Y621 CarbonylContact C-O 3.51Å; R584-Y621 WeakPolarHBondContact CA-O 3.15Å; R584-Y621 WeakPolarHBondContact CB-O 3.14Å; V585-Y621 PolarHBondContact N-O 2.91Å; V585-Y621 PolarHBondContact O-N 3.24Å; Y600-Y621 HydrophobicContact CD1-CE2 4.15Å; E601-Y621 VanDerWaalsContact O-CD2 3.28Å; E601-Y621 WeakPolarHBondContact O-CD2 3.47Å; F602-Y621 HydrophobicContact CD1-CD2 4.27Å; F602-Y621 HydrophobicContact CD1-CG 4.5Å; F602-Y621 HydrophobicContact CE1-CD2 4.11Å; F602-Y621 HydrophobicContact CE1-CG 4.3Å
622	P	89.9	Confident	75.2	Confident	58 Å²	58	74.3 Å²	74.3	38%	0.377	44%	0.444	S	S	.	.	S	Bend	cis	-68.3	160.3	-8	29.5	-35.8	0	0	0	112.3	R584	R584-P622 PolarHBondContact NH1-O 2.93Å; R584-P622 VanDerWaalsContact NH1-O 3.08Å
623	K	85.6	Confident	73.7	Confident	106 Å²	106	78.1 Å²	78.1	46%	0.461	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-62.5	133.7	171.4	-176.5	-179.6	176.9	175.2	0	110.7	E601 D603	E601-K623 HydrophobicContact CB-CB 4.48Å; E601-K623 HydrophobicContact CB-CD 3.87Å; E601-K623 IonicContact OE1-NZ 2.75Å; E601-K623 WeakPolarHBondContact OE2-CD 3.3Å; E601-K623 WeakPolarHBondContact OE2-CE 3.36Å; E601-K623 IonicContact OE2-NZ 2.65Å; E601-K623 PolarHBondContact OE2-NZ 3.11Å; D603-K623 VanDerWaalsContact OD1-CG 3.31Å; D603-K623 WeakPolarHBondContact OD1-CG 3.22Å
624	S	78.2	Confident	72	Confident	39 Å²	39	75.3 Å²	75.3	27%	0.273	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-72.8	134.2	177.7	-150.9	0	0	0	0	110.5	R584 D603 D626	R584-S624 PolarHBondContact NH2-OG 3.1Å; D603-S624 PolarHBondContact OD1-N 3.47Å; D603-S624 VanDerWaalsContact OD2-CB 3.27Å; D603-S624 WeakPolarHBondContact OD2-CB 3.49Å; D603-S624 PolarHBondContact OD2-N 2.83Å; S624-D626 VanDerWaalsContact C-N 3.25Å; S624-D626 PolarHBondContact O-N 3.27Å
625	S	63.5	Low	70.1	Confident	126 Å²	126	77.6 Å²	77.6	88%	0.881	43%	0.427	S	S	*	.	S	Bend	trans	-71.1	-21.2	172.2	32.4	0	0	0	0	112.9	S627	S625-S627 PolarHBondContact O-N 3.39Å
626	D	57.4	Low	67.9	Low	136 Å²	136	75 Å²	75	73%	0.727	42%	0.423	S	S	*	.	S	Bend	trans	-75.4	101.2	164.5	-95.2	-29.4	0	0	0	110.1	S624 G628	S624-D626 VanDerWaalsContact C-N 3.25Å; S624-D626 PolarHBondContact O-N 3.27Å; D626-G628 PolarHBondContact O-N 3.33Å
627	S	41.4	Very low	65.9	Low	131 Å²	131	76.4 Å²	76.4	92%	0.916	43%	0.433	S	S	*	.			trans	-77.2	38.1	179.4	48.9	0	0	0	0	114	S625	S625-S627 PolarHBondContact O-N 3.39Å
628	G	52.1	Low	63.5	Low	49 Å²	49	75.1 Å²	75.1	51%	0.505	44%	0.435	S	S	.	.	S	Bend	trans	-99.3	165.4	168.5	0	0	0	0	0	111.9	D626 V630	D626-G628 PolarHBondContact O-N 3.33Å; G628-V630 PolarHBondContact O-N 3.07Å
629	P	50	Low	60.9	Low	126 Å²	126	80.3 Å²	80.3	82%	0.818	47%	0.469	S	S	*	.			trans	-57.9	134.7	166.9	26.4	-33.4	0	0	0	109.7
630	V	51.8	Low	58.3	Low	20 Å²	20	86.5 Å²	86.5	12%	0.121	50%	0.498	C	S	.	.			trans	-45.1	124	178.8	173.9	0	0	0	0	109.7	G628 Q632 Q634 L635	G628-V630 PolarHBondContact O-N 3.07Å; V630-Q632 PolarHBondContact O-N 3.06Å; V630-Q634 HydrophobicContact CG1-CB 3.8Å; V630-L635 HydrophobicContact CB-CD2 4.02Å; V630-L635 HydrophobicContact CG1-CD2 3.82Å; V630-L635 HydrophobicContact CG1-CG 4.39Å
631	P	48.4	Very low	56	Low	58 Å²	58	88.2 Å²	88.2	38%	0.377	51%	0.506	S	S	.	.			trans	-52.7	138.1	-171.8	-30.7	35.7	0	0	0	112.6	Y633 Q634 L635	P631-Y633 HydrophobicContact CB-CD1 3.58Å; P631-Y633 HydrophobicContact CB-CE1 3.26Å; P631-Y633 HydrophobicContact CG-CE1 4.05Å; P631-Y633 PolarHBondContact O-N 3.14Å; P631-Q634 WeakPolarHBondContact O-CA 3.32Å; P631-Q634 WeakPolarHBondContact O-CB 3.06Å; P631-Q634 PolarHBondContact O-N 2.99Å; P631-L635 PolarHBondContact O-N 3.14Å
632	Q	45.6	Very low	53.4	Low	168 Å²	168	94.8 Å²	94.8	79%	0.785	53%	0.531	S	S	*	.	H	α-helix	trans	-62.9	-18.7	-167	-158.9	159.4	-2.7	0	0	114.2	V630 L635 S636	V630-Q632 PolarHBondContact O-N 3.06Å; Q632-L635 PolarHBondContact O-N 3.11Å; Q632-S636 PolarHBondContact O-N 2.96Å
633	Y	50.4	Low	51	Low	165 Å²	165	95.3 Å²	95.3	65%	0.647	54%	0.54	S	S	*	.	H	α-helix	trans	-73.8	-25.6	171	74.2	-96.1	0	0	0	113.9	P631 L635 S636	P631-Y633 HydrophobicContact CB-CD1 3.58Å; P631-Y633 HydrophobicContact CB-CE1 3.26Å; P631-Y633 HydrophobicContact CG-CE1 4.05Å; P631-Y633 PolarHBondContact O-N 3.14Å; Y633-L635 VanDerWaalsContact C-N 3.34Å; Y633-S636 WeakPolarHBondContact CA-OG 3.33Å; Y633-S636 PolarHBondContact O-OG 3.42Å
634	Q	50	Low	48.9	Very low	47 Å²	47	96.1 Å²	96.1	22%	0.22	55%	0.546	C	S	.	.	H	α-helix	trans	-81.7	-17.3	172	-58.9	-175.8	-5.2	0	0	111.7	R605 V630 P631	R605-Q634 PolarHBondContact NH1-O 3.29Å; V630-Q634 HydrophobicContact CG1-CB 3.8Å; P631-Q634 WeakPolarHBondContact O-CA 3.32Å; P631-Q634 WeakPolarHBondContact O-CB 3.06Å; P631-Q634 PolarHBondContact O-N 2.99Å
635	L	50.4	Low	47.2	Very low	77 Å²	77	95.9 Å²	95.9	40%	0.403	54%	0.543	S	S	.	.	H	α-helix	trans	-83	-25.8	173.7	-57.1	-176.8	0	0	0	112.8	R605 V630 P631 Q632 Y633 V637	R605-L635 HydrophobicContact CG-CD2 4.46Å; R605-L635 WeakPolarHBondContact O-CD2 3.25Å; V630-L635 HydrophobicContact CB-CD2 4.02Å; V630-L635 HydrophobicContact CG1-CD2 3.82Å; V630-L635 HydrophobicContact CG1-CG 4.39Å; P631-L635 PolarHBondContact O-N 3.14Å; Q632-L635 PolarHBondContact O-N 3.11Å; Y633-L635 VanDerWaalsContact C-N 3.34Å; L635-V637 PolarHBondContact O-N 3.41Å
636	S	44.4	Very low	45.9	Very low	75 Å²	75	95.6 Å²	95.6	52%	0.524	53%	0.531	S	S	.	.	S	Bend	trans	-77.6	114.2	175	48.1	0	0	0	0	111.6	Q632 Y633 S638	Q632-S636 PolarHBondContact O-N 2.96Å; Y633-S636 WeakPolarHBondContact CA-OG 3.33Å; Y633-S636 PolarHBondContact O-OG 3.42Å; S636-S638 PolarHBondContact O-N 3.37Å
637	V	49.4	Very low	45.1	Very low	63 Å²	63	92.2 Å²	92.2	38%	0.382	53%	0.529	S	S	.	.			trans	-64.6	121.6	164.2	179.6	0	0	0	0	108.6	L635 I641	L635-V637 PolarHBondContact O-N 3.41Å; V637-I641 HydrophobicContact CG1-CB 3.78Å; V637-I641 HydrophobicContact CG1-CD1 4.41Å; V637-I641 HydrophobicContact CG1-CG2 3.71Å
638	S	43.1	Very low	45.2	Very low	60 Å²	60	90.5 Å²	90.5	42%	0.42	52%	0.517	S	S	.	.			trans	-56.7	144	179.6	-67.7	0	0	0	0	112.1	S636 E640 I641 R642	S636-S638 PolarHBondContact O-N 3.37Å; S638-E640 PolarHBondContact O-N 2.93Å; S638-E640 VanDerWaalsContact O-N 3.15Å; S638-I641 WeakPolarHBondContact O-CB 3.03Å; S638-I641 PolarHBondContact O-N 3.35Å; S638-R642 PolarHBondContact O-N 2.67Å
639	P	39.8	Very low	44.9	Very low	109 Å²	109	93.3 Å²	93.3	71%	0.708	52%	0.519	S	S	*	.	H	α-helix	trans	-55.2	-33.7	-178	-27.4	35.7	0	0	0	114.5	R642 A643	P639-R642 VanDerWaalsContact O-CB 3.32Å; P639-R642 WeakPolarHBondContact O-CB 3.49Å; P639-R642 PolarHBondContact O-N 2.95Å; P639-A643 PolarHBondContact O-N 2.04Å
640	E	42.5	Very low	44.3	Very low	149 Å²	149	90.7 Å²	90.7	70%	0.696	51%	0.514	S	S	*	.	H	α-helix	trans	-67.1	-35.4	178.5	-68.9	132.8	151.7	0	0	113.1	S638 R642 A643 Q644	S638-E640 PolarHBondContact O-N 2.93Å; S638-E640 VanDerWaalsContact O-N 3.15Å; E640-R642 PolarHBondContact O-N 3.17Å; E640-A643 PolarHBondContact O-N 3.28Å; E640-A643 VanDerWaalsContact O-N 3.15Å; E640-Q644 PolarHBondContact O-N 3.17Å
641	I	47.4	Very low	43.5	Very low	35 Å²	35	100 Å²	100	18%	0.179	55%	0.547	C	S	.	.	H	α-helix	trans	-63.5	-36	175.1	-60.8	175.4	0	0	0	110	T578 V637 S638 A643 Q644 V645	T578-I641 HydrophobicContact CG2-CG2 4.09Å; T578-I641 WeakPolarHBondContact O-CG2 3.24Å; V637-I641 HydrophobicContact CG1-CB 3.78Å; V637-I641 HydrophobicContact CG1-CD1 4.41Å; V637-I641 HydrophobicContact CG1-CG2 3.71Å; S638-I641 WeakPolarHBondContact O-CB 3.03Å; S638-I641 PolarHBondContact O-N 3.35Å; I641-A643 VanDerWaalsContact C-N 3.26Å; I641-A643 PolarHBondContact O-N 3.1Å; I641-Q644 PolarHBondContact O-N 3.22Å; I641-V645 HydrophobicContact CG2-CG2 4.23Å; I641-V645 WeakPolarHBondContact O-CB 3.37Å; I641-V645 VanDerWaalsContact O-CG2 3.23Å; I641-V645 WeakPolarHBondContact O-CG2 3.44Å; I641-V645 PolarHBondContact O-N 3.01Å
642	R	39.4	Very low	42.8	Very low	193 Å²	193	99.9 Å²	99.9	73%	0.728	55%	0.548	S	S	*	.	H	α-helix	trans	-63	-31.9	177.5	-160.5	174.9	-172.9	156.8	1.2	112.4	S638 P639 E640	S638-R642 PolarHBondContact O-N 2.67Å; P639-R642 VanDerWaalsContact O-CB 3.32Å; P639-R642 WeakPolarHBondContact O-CB 3.49Å; P639-R642 PolarHBondContact O-N 2.95Å; E640-R642 PolarHBondContact O-N 3.17Å
643	A	39.7	Very low	42.4	Very low	69 Å²	69	96.5 Å²	96.5	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-76.2	-41.6	175.5	0	0	0	0	0	112.6	P639 E640 I641 V645 D646 G647	P639-A643 PolarHBondContact O-N 2.04Å; E640-A643 PolarHBondContact O-N 3.28Å; E640-A643 VanDerWaalsContact O-N 3.15Å; I641-A643 VanDerWaalsContact C-N 3.26Å; I641-A643 PolarHBondContact O-N 3.1Å; A643-V645 VanDerWaalsContact C-N 3.33Å; A643-V645 PolarHBondContact O-N 2.93Å; A643-D646 PolarHBondContact O-N 2.84Å; A643-G647 PolarHBondContact O-N 2.76Å; A643-G647 VanDerWaalsContact O-N 3.11Å
644	Q	42.4	Very low	41.9	Very low	123 Å²	123	93.1 Å²	93.1	58%	0.575	54%	0.537	S	S	*	.	H	α-helix	trans	-64.4	-36.2	175.8	-74.2	-178.9	-20.8	0	0	112.6	E640 I641 D646 G647 S648	E640-Q644 PolarHBondContact O-N 3.17Å; I641-Q644 PolarHBondContact O-N 3.22Å; Q644-D646 VanDerWaalsContact C-N 3.26Å; Q644-D646 PolarHBondContact O-N 3.45Å; Q644-G647 PolarHBondContact O-N 2.94Å; Q644-S648 PolarHBondContact O-N 3.31Å
645	V	42.1	Very low	41.2	Very low	35 Å²	35	95.3 Å²	95.3	21%	0.212	55%	0.55	C	S	.	*	H	α-helix	trans	-57	-35.5	177.9	156.5	0	0	0	0	113.3	R575 T578 I641 A643	R575-V645 PolarHBondContact NH1-O 3.16Å; R575-V645 VanDerWaalsContact NH1-O 3.15Å; T578-V645 HydrophobicContact CG2-CG2 3.52Å; I641-V645 HydrophobicContact CG2-CG2 4.23Å; I641-V645 WeakPolarHBondContact O-CB 3.37Å; I641-V645 VanDerWaalsContact O-CG2 3.23Å; I641-V645 WeakPolarHBondContact O-CG2 3.44Å; I641-V645 PolarHBondContact O-N 3.01Å; A643-V645 VanDerWaalsContact C-N 3.33Å; A643-V645 PolarHBondContact O-N 2.93Å
646	D	37.1	Very low	40.5	Very low	120 Å²	120	96.8 Å²	96.8	64%	0.642	56%	0.555	S	S	*	*	H	α-helix	trans	-96.8	-19.6	-179.4	-77.6	-35.5	0	0	0	113.7	A643 Q644	A643-D646 PolarHBondContact O-N 2.84Å; Q644-D646 VanDerWaalsContact C-N 3.26Å; Q644-D646 PolarHBondContact O-N 3.45Å
647	G	40.7	Very low	40.3	Very low	65 Å²	65	99.2 Å²	99.2	67%	0.67	56%	0.561	S	S	*	*	H	α-helix	trans	-94.8	-35.6	-172.1	0	0	0	0	0	117	A643 Q644	A643-G647 PolarHBondContact O-N 2.76Å; A643-G647 VanDerWaalsContact O-N 3.11Å; Q644-G647 PolarHBondContact O-N 2.94Å
648	S	41.9	Very low	39.7	Very low	95 Å²	95	100.2 Å²	100.2	66%	0.664	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	-23	-152.5	-55.6	0	0	0	0	117.6	Q644	Q644-S648 PolarHBondContact O-N 3.31Å
649	I	46.9	Very low	39.3	Very low	108 Å²	108	101.8 Å²	101.8	55%	0.554	59%	0.587	S	S	*	*	S	Bend	trans	-137.3	106.9	-177.4	-53.6	-179.3	0	0	0	110.4	R575	R575-I649 PolarHBondContact NH2-O 2.88Å
650	G	37.3	Very low	39	Very low	70 Å²	70	103.4 Å²	103.4	72%	0.722	59%	0.587	S	S	*	*			trans	137.5	68.2	174.9	0	0	0	0	0	115.1
651	R	35.6	Very low	38.6	Very low	216 Å²	216	101.4 Å²	101.4	82%	0.815	58%	0.584	S	S	*	*			trans	-113.3	114.7	147.3	-75.3	-169.1	-178.6	166	3.8	107.7
652	S	33.9	Very low	37.8	Very low	55 Å²	55	105.1 Å²	105.1	39%	0.385	61%	0.611	S	S	.	*			trans	-74.6	145.2	168.6	175.2	0	0	0	0	108.4	T654 D655	S652-T654 VanDerWaalsContact CB-OG1 3.29Å; S652-T654 WeakPolarHBondContact CB-OG1 3.45Å; S652-T654 PolarHBondContact O-N 2.79Å; S652-T654 PolarHBondContact OG-N 3.42Å; S652-T654 PolarHBondContact OG-OG1 3.38Å; S652-D655 PolarHBondContact N-OD2 2.93Å; S652-D655 PolarHBondContact O-N 3.41Å
653	P	35.7	Very low	37.3	Very low	98 Å²	98	102.5 Å²	102.5	64%	0.636	62%	0.616	S	S	*	*	H	α-helix	trans	-55.3	-18.8	173.2	-26.3	35.3	0	0	0	114.2	D655	P653-D655 VanDerWaalsContact C-N 3.32Å; P653-D655 PolarHBondContact O-N 3.08Å
654	T	41.3	Very low	36.7	Very low	93 Å²	93	105.6 Å²	105.6	57%	0.571	63%	0.629	S	S	*	*	H	α-helix	trans	-66.3	-28.1	173.8	48.8	0	0	0	0	114.1	S652	S652-T654 VanDerWaalsContact CB-OG1 3.29Å; S652-T654 WeakPolarHBondContact CB-OG1 3.45Å; S652-T654 PolarHBondContact O-N 2.79Å; S652-T654 PolarHBondContact OG-N 3.42Å; S652-T654 PolarHBondContact OG-OG1 3.38Å
655	D	34.9	Very low	36	Very low	94 Å²	94	105.1 Å²	105.1	50%	0.503	64%	0.639	S	S	.	*	H	α-helix	trans	-80.8	-23.6	-172.4	-59.5	-31	0	0	0	112.6	S652 P653	S652-D655 PolarHBondContact N-OD2 2.93Å; S652-D655 PolarHBondContact O-N 3.41Å; P653-D655 VanDerWaalsContact C-N 3.32Å; P653-D655 PolarHBondContact O-N 3.08Å
656	E	35.4	Very low	35.2	Very low	107 Å²	107	113.4 Å²	113.4	50%	0.5	67%	0.672	S	S	.	*	H	α-helix	trans	-70.4	-36.2	175.4	-67	-169.2	144.5	0	0	111.8	A658 S659 M660	E656-A658 VanDerWaalsContact C-N 3.32Å; E656-A658 PolarHBondContact O-N 3.35Å; E656-S659 PolarHBondContact O-N 3.09Å; E656-S659 PolarHBondContact O-OG 3.24Å; E656-M660 HydrophobicContact CB-CE 4.4Å
657	I	39.8	Very low	34.7	Very low	126 Å²	126	116 Å²	116	65%	0.646	69%	0.686	S	S	*	*	H	α-helix	trans	-65.8	-35.7	-177	-56.6	174.8	0	0	0	111.3	S659 M660	I657-S659 PolarHBondContact O-N 3.03Å; I657-M660 PolarHBondContact O-N 3.5Å
658	A	36.1	Very low	33.9	Very low	85 Å²	85	116.2 Å²	116.2	70%	0.702	69%	0.689	S	S	*	*	H	α-helix	trans	-66.4	-22.4	175.4	0	0	0	0	0	113.4	E656	E656-A658 VanDerWaalsContact C-N 3.32Å; E656-A658 PolarHBondContact O-N 3.35Å
659	S	36.3	Very low	33.1	Very low	92 Å²	92	120 Å²	120	64%	0.643	70%	0.701	S	S	*	*	H	α-helix	trans	-88.1	-14	-178.1	76.3	0	0	0	0	114.5	E656 I657	E656-S659 PolarHBondContact O-N 3.09Å; E656-S659 PolarHBondContact O-OG 3.24Å; I657-S659 PolarHBondContact O-N 3.03Å
660	M	33.5	Very low	32.2	Very low	143 Å²	143	119.9 Å²	119.9	70%	0.704	71%	0.71	S	S	*	*	S	Bend	trans	-94.6	4.4	-175	-63.8	-172.5	-168.2	0	0	114.6	E656 I657 P662	E656-M660 HydrophobicContact CB-CE 4.4Å; I657-M660 PolarHBondContact O-N 3.5Å; M660-P662 WeakPolarHBondContact O-CD 3.33Å
661	V	33.8	Very low	31.7	Very low	107 Å²	107	123.5 Å²	123.5	65%	0.648	72%	0.718	S	S	*	*	S	Bend	trans	-93.2	110.6	173.8	-176.7	0	0	0	0	109.5	T663	V661-T663 PolarHBondContact O-N 3.19Å; V661-T663 VanDerWaalsContact O-N 3.15Å
662	P	30.4	Very low	31.2	Very low	114 Å²	114	122.6 Å²	122.6	74%	0.74	72%	0.72	S	S	*	*			trans	-71.4	112.2	179.4	26.5	-31.1	0	0	0	110.7	M660 T664	M660-P662 WeakPolarHBondContact O-CD 3.33Å; P662-T664 PolarHBondContact O-N 3.04Å; P662-T664 VanDerWaalsContact O-N 3.11Å
663	T	28.3	Very low	30.7	Very low	137 Å²	137	128.1 Å²	128.1	84%	0.84	74%	0.742	S	S	*	*			trans	-73.3	98.7	172.3	41.5	0	0	0	0	110.3	V661 S665	V661-T663 PolarHBondContact O-N 3.19Å; V661-T663 VanDerWaalsContact O-N 3.15Å; T663-S665 PolarHBondContact O-N 3.03Å; T663-S665 VanDerWaalsContact O-N 3.12Å
664	T	27.5	Very low	30.2	Very low	135 Å²	135	131.4 Å²	131.4	83%	0.828	75%	0.751	S	S	*	*			trans	-65.8	110.8	172	51.8	0	0	0	0	110.4	P662	P662-T664 PolarHBondContact O-N 3.04Å; P662-T664 VanDerWaalsContact O-N 3.11Å
665	S	26.9	Very low	29.5	Very low	113 Å²	113	132.8 Å²	132.8	79%	0.79	76%	0.759	S	S	*	*			trans	-69	130.8	173.7	56.4	0	0	0	0	111.4	T663	T663-S665 PolarHBondContact O-N 3.03Å; T663-S665 VanDerWaalsContact O-N 3.12Å
666	K	25.9	Very low	29.4	Very low	208 Å²	208	133.9 Å²	133.9	90%	0.904	77%	0.771	S	S	*	*			trans	-143.4	130.5	159.7	-102.3	-175.8	179.2	177.5	0	110.8
667	N	25.8	Very low	29	Very low	174 Å²	174	133.6 Å²	133.6	93%	0.93	78%	0.781	S	S	*	*			trans	-66.4	151.8	176.1	-66	-20.8	0	0	0	111.8
668	G	24.9	Very low	28.3	Very low	71 Å²	71	132.3 Å²	132.3	73%	0.732	79%	0.79	S	S	*	*			trans	158.6	90	157.1	0	0	0	0	0	118.4
669	N	25.5	Very low	27.9	Very low	174 Å²	174	133 Å²	133	93%	0.93	79%	0.789	S	S	*	*			trans	69.6	129	148.2	-67.4	-1.7	0	0	0	123.2
670	S	27.4	Very low	27.5	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	80%	0.8	S	S	*	*			trans	-52.1	143.7	166.8	173.8	0	0	0	0	116.6
671	T	25.7	Very low	27.1	Very low	146 Å²	146	134 Å²	134	90%	0.896	81%	0.808	S	S	*	*				-156.1	155.8	123	16.8	0	0	0	0	112.6
672	K	25.6	Very low	26.8	Very low	196 Å²	196	134.2 Å²	134.2	85%	0.852	81%	0.814	S	S	*	*			trans	-81	149.9	-174.6	-57.4	166.7	176.4	174.2	0	112.5
673	M	24.1	Very low	26.6	Very low	171 Å²	171	134.2 Å²	134.2	84%	0.842	82%	0.817	S	S	*	*				-178.3	136.2	108.4	-106.8	-177.9	151.3	0	0	116.5
674	M	24.2	Very low	26.5	Very low	168 Å²	168	135 Å²	135	83%	0.828	82%	0.816	S	S	*	*			trans	38.3	124.1	145.2	-80.5	170.3	159.6	0	0	124.3
675	V	27.1	Very low	26.5	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	82%	0.819	S	S	*	*			trans	-89.9	140.8	152.3	169.7	0	0	0	0	107.8	S677	V675-S677 WeakPolarHBondContact CG1-OG 3.38Å
676	P	34	Very low	26.5	Very low	118 Å²	118	137 Å²	137	77%	0.766	82%	0.824	S	S	*	*				-136.4	151.3	88.2	17.8	6	0	0	0	113.5
677	S	26.5	Very low	26.4	Very low	100 Å²	100	131 Å²	131	70%	0.699	82%	0.821	S	S	*	*			cis	83.6	142.7	45	-58.5	0	0	0	0	115.3	V675	V675-S677 WeakPolarHBondContact CG1-OG 3.38Å
678	A	25.6	Very low	26.5	Very low	100 Å²	100	131.1 Å²	131.1	83%	0.826	82%	0.821	S	S	*	*			trans	77.6	149.6	175	0	0	0	0	0	117
679	S	26	Very low	26.5	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	83%	0.827	S	S	*	*			cis	-174.1	152.4	-19.5	50	0	0	0	0	111
680	I	28.8	Very low	26.5	Very low	171 Å²	171	134 Å²	134	88%	0.877	82%	0.823	S	S	*	*			trans	33.6	122.3	141.8	-54.8	168.6	0	0	0	118.8
681	G	25.2	Very low	26.4	Very low	84 Å²	84	136.7 Å²	136.7	87%	0.866	83%	0.826	S	S	*	*			trans	-158	114.1	161	0	0	0	0	0	112.2
682	S	26.3	Very low	26.3	Very low	111 Å²	111	137.1 Å²	137.1	78%	0.776	82%	0.816	S	S	*	*			trans	-114.1	140.6	177.5	167.4	0	0	0	0	110.2
683	S	26.3	Very low	26.3	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	81%	0.807	S	S	*	*			trans	-162.2	130.1	153.7	49.7	0	0	0	0	112.8
684	N	27.2	Very low	26.4	Very low	154 Å²	154	130.6 Å²	130.6	82%	0.824	80%	0.802	S	S	*	*			trans	-79.4	150.9	164.4	-67.9	-31.2	0	0	0	110.3
685	T	26.6	Very low	26.4	Very low	146 Å²	146	128.9 Å²	128.9	90%	0.896	80%	0.796	S	S	*	*			trans	-159.6	142.3	135.8	15.9	0	0	0	0	112.9
686	T	27.4	Very low	26.4	Very low	144 Å²	144	130 Å²	130	88%	0.883	80%	0.797	S	S	*	*			trans	-80.1	152.2	175.1	43	0	0	0	0	113.4
687	G	25.1	Very low	26	Very low	83 Å²	83	128.3 Å²	128.3	86%	0.856	80%	0.8	S	S	*	*			trans	-170.3	125.6	165.1	0	0	0	0	0	112.9
688	L	26.4	Very low	26	Very low	176 Å²	176	129.5 Å²	129.5	92%	0.921	80%	0.803	S	S	*	*			trans	-126.1	126.8	-176.5	-164.8	107.6	0	0	0	109.9
689	S	24.8	Very low	25.9	Very low	124 Å²	124	136.4 Å²	136.4	87%	0.867	81%	0.808	S	S	*	*			trans	-172.5	159.4	158.4	47	0	0	0	0	112.8
690	Q	25.4	Very low	25.8	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	81%	0.814	S	S	*	*			trans	-99.5	173.9	-170.8	-66.4	174.7	-49.6	0	0	114.2
691	M	25.3	Very low	25.6	Very low	162 Å²	162	135.5 Å²	135.5	80%	0.798	82%	0.815	S	S	*	*			trans	93	107.6	144.5	-90.8	-160.9	171.8	0	0	121.2
692	K	24.2	Very low	25.6	Very low	156 Å²	156	136.6 Å²	136.6	68%	0.678	81%	0.809	S	S	*	*				112	117.7	100.8	-163.7	170.8	-177.1	-179.1	0	120.1
693	D	25.5	Very low	25.5	Very low	125 Å²	125	138.3 Å²	138.3	67%	0.668	82%	0.815	S	S	*	*			trans	63.3	142.9	145.1	-59.3	-8.4	0	0	0	125.8
694	S	26.5	Very low	25.6	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	81%	0.812	S	S	*	*			trans	72	132.9	152.6	-64.6	0	0	0	0	118.9
695	D	24.4	Very low	25.5	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	81%	0.814	S	S	*	*			cis	-163.7	144.7	38.3	-112.7	-16.7	0	0	0	115.3
696	I	26.6	Very low	25.4	Very low	146 Å²	146	134.5 Å²	134.5	75%	0.749	81%	0.808	S	S	*	*			trans	39.7	124.5	132.5	-58.9	169.7	0	0	0	121.3	V698	I696-V698 HydrophobicContact CG2-CG2 4.45Å
697	G	25.4	Very low	25.3	Very low	82 Å²	82	134 Å²	134	85%	0.845	81%	0.808	S	S	*	*			trans	-156.9	99.8	162.1	0	0	0	0	0	113.2
698	V	27	Very low	25.3	Very low	124 Å²	124	134.1 Å²	134.1	75%	0.752	80%	0.802	S	S	*	*			trans	-88.5	137.4	-170.7	170.8	0	0	0	0	113.4	I696	I696-V698 HydrophobicContact CG2-CG2 4.45Å
699	R	23.8	Very low	25.3	Very low	245 Å²	245	136.3 Å²	136.3	93%	0.925	80%	0.798	S	S	*	*			trans	-161.5	122.3	138.5	-115.5	173.5	-161.5	175.8	7.2	114.1
700	C	24.1	Very low	25.3	Very low	124 Å²	124	141.5 Å²	141.5	84%	0.838	80%	0.798	S	S	*	*			trans	-103.1	151.4	162.2	-65.6	0	0	0	0	110
701	S	23.5	Very low	25.1	Very low	129 Å²	129	137.7 Å²	137.7	90%	0.902	79%	0.791	S	S	*	*			trans	-147.3	132.9	143.9	55.3	0	0	0	0	109.6
702	S	25.5	Very low	25.1	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	79%	0.79	S	S	*	*			trans	-115.6	155.2	-177.1	50.4	0	0	0	0	110.2
703	T	25.2	Very low	25.2	Very low	147 Å²	147	133.5 Å²	133.5	90%	0.902	78%	0.783	S	S	*	*			trans	-141.9	141.1	151.8	-37.5	0	0	0	0	109.5
704	V	27.7	Very low	25.2	Very low	120 Å²	120	136 Å²	136	73%	0.727	79%	0.79	S	S	*	*			trans	-116	143.3	-172.6	174.1	0	0	0	0	109.5
705	A	24.8	Very low	25.2	Very low	104 Å²	104	136 Å²	136	86%	0.86	79%	0.79	S	S	*	*			trans	-143.4	135.3	152.4	0	0	0	0	0	109.1
706	S	24.5	Very low	25.3	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	79%	0.792	S	S	*	*			trans	-142.6	149.9	-177.2	62.4	0	0	0	0	110.7
707	C	24.8	Very low	25.2	Very low	133 Å²	133	134.1 Å²	134.1	90%	0.899	80%	0.798	S	S	*	*			trans	-153.5	145.4	152.6	-143.8	0	0	0	0	111.1
708	A	26.2	Very low	25.3	Very low	86 Å²	86	136.4 Å²	136.4	71%	0.711	80%	0.796	S	S	*	*			trans	-95.9	-172.1	-179.9	0	0	0	0	0	110.1
709	R	26.5	Very low	25.1	Very low	222 Å²	222	135.3 Å²	135.3	84%	0.838	79%	0.793	S	S	*	*			cis	-174.6	157.4	26.8	-148.6	178.5	-141.4	175.6	4.5	111
710	R	23.8	Very low	25.2	Very low	233 Å²	233	131 Å²	131	88%	0.879	79%	0.787	S	S	*	*			trans	89.6	135.1	159.5	-63.2	178	165.3	164.8	-5.3	117
711	S	22.3	Very low	25.6	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	78%	0.78	S	S	*	*			cis	128.5	142.3	-3.6	-177.3	0	0	0	0	111.6
712	M	25.3	Very low	25.7	Very low	155 Å²	155	130.9 Å²	130.9	76%	0.764	78%	0.779	S	S	*	*			trans	97.2	101.4	178.5	-51.8	-85	76.9	0	0	113.6
713	S	25.1	Very low	25.7	Very low	76 Å²	76	132 Å²	132	53%	0.531	78%	0.782	S	S	.	*				70.4	132.7	64.3	78.3	0	0	0	0	112.5
714	H	27.1	Very low	25.7	Very low	176 Å²	176	130.3 Å²	130.3	82%	0.815	78%	0.776	S	S	*	*			cis	-157.2	176.7	26.5	-93.8	-67.7	0	0	0	109.2
715	S	25.9	Very low	25.6	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	79%	0.785	S	S	*	*			cis	-173.2	141.7	-11	45.8	0	0	0	0	112
716	G	25.2	Very low	25.6	Very low	73 Å²	73	137.4 Å²	137.4	75%	0.753	79%	0.788	S	S	*	*			trans	81.6	152.8	155.5	0	0	0	0	0	118.2
717	L	26.1	Very low	25.6	Very low	165 Å²	165	135.9 Å²	135.9	86%	0.864	79%	0.789	S	S	*	*			cis	-139.1	123.2	-6.6	-97.4	100.7	0	0	0	111.3
718	T	26.1	Very low	25.6	Very low	131 Å²	131	138.6 Å²	138.6	80%	0.804	79%	0.789	S	S	*	*				26.2	125	128.2	56.7	0	0	0	0	122.1
719	S	23.8	Very low	26.5	Very low	100 Å²	100	139.5 Å²	139.5	70%	0.699	79%	0.787	S	S	*	*			trans	-107.6	179.7	158.3	52.5	0	0	0	0	111.5
720	I	26	Very low	26.8	Very low	156 Å²	156	135.2 Å²	135.2	80%	0.8	79%	0.788	S	S	*	*			trans	82	148.3	167.4	-51.7	157.2	0	0	0	114.9
721	P	32.8	Very low	26.9	Very low	106 Å²	106	130.8 Å²	130.8	69%	0.688	78%	0.782	S	S	*	*			cis	-120.8	-179.6	-17.2	29.6	-10.7	0	0	0	114.1
722	V	25.7	Very low	27.1	Very low	144 Å²	144	131.6 Å²	131.6	87%	0.873	78%	0.778	S	S	*	*			trans	-108.8	137	159.5	174	0	0	0	0	109.5
723	T	25.4	Very low	27.2	Very low	130 Å²	130	132.5 Å²	132.5	80%	0.798	78%	0.778	S	S	*	*			trans	-130.4	137.2	170.5	45.7	0	0	0	0	110.6
724	S	24	Very low	27.2	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	79%	0.79	S	S	*	*			trans	-84	144.8	179.5	49.3	0	0	0	0	113.3
725	L	25.8	Very low	27.1	Very low	178 Å²	178	135.7 Å²	135.7	93%	0.932	79%	0.789	S	S	*	*			trans	-158.7	148.9	151.4	-126.3	123.8	0	0	0	111.9
726	E	25.3	Very low	27.1	Very low	194 Å²	194	137.4 Å²	137.4	91%	0.907	79%	0.788	S	S	*	*			trans	-81	164.9	-174.4	-62.1	168.9	101	0	0	114.1
727	G	24.2	Very low	27	Very low	78 Å²	78	140 Å²	140	80%	0.804	79%	0.789	S	S	*	*			trans	167.1	108.9	164.4	0	0	0	0	0	114.6
728	H	24.3	Very low	27	Very low	191 Å²	191	137.2 Å²	137.2	88%	0.884	78%	0.783	S	S	*	*			trans	-94.9	177.4	175.4	-125	-28.3	0	0	0	111.5
729	P	46.6	Very low	26.9	Very low	105 Å²	105	136 Å²	136	68%	0.682	78%	0.78	S	S	*	*				-106.1	178.8	-124.3	42.3	-32.6	0	0	0	115.1
730	P	32.1	Very low	27.1	Very low	132 Å²	132	135.7 Å²	135.7	86%	0.857	78%	0.778	S	S	*	*			trans	-128.4	171.4	144.2	36.5	-24.7	0	0	0	114.4
731	N	24.9	Very low	27.2	Very low	140 Å²	140	135.6 Å²	135.6	75%	0.749	78%	0.778	S	S	*	*			trans	-121.4	169.7	-165.8	-168	0.8	0	0	0	111.1
732	N	27.3	Very low	26.8	Very low	117 Å²	117	138.2 Å²	138.2	63%	0.626	78%	0.781	S	S	*	*			trans	75.9	149.4	171.8	-62.8	-47.5	0	0	0	117.6
733	K	28.3	Very low	26.9	Very low	175 Å²	175	138 Å²	138	76%	0.761	77%	0.77	S	S	*	*			cis	-169.1	176.6	-2.3	-116.8	167.3	-172.5	169.2	0	113.1
734	Q	24.8	Very low	26.9	Very low	167 Å²	167	140.1 Å²	140.1	78%	0.78	77%	0.771	S	S	*	*			trans	88.2	143.4	163.6	-55	-171.1	-21.4	0	0	116.9
735	L	24.6	Very low	27.1	Very low	151 Å²	151	138.9 Å²	138.9	79%	0.791	77%	0.767	S	S	*	*			cis	-124.3	154.1	-1.3	-69.8	83.3	0	0	0	108.7
736	I	26.1	Very low	28.2	Very low	141 Å²	141	136 Å²	136	72%	0.723	76%	0.76	S	S	*	*			cis	77.6	114.7	38.2	-56.7	-178.9	0	0	0	116.2
737	V	23.9	Very low	28.2	Very low	127 Å²	127	135 Å²	135	77%	0.77	76%	0.755	S	S	*	*			trans	171.9	100.7	130.4	157.1	0	0	0	0	107.2
738	S	25.6	Very low	28.3	Very low	107 Å²	107	139.7 Å²	139.7	75%	0.748	76%	0.755	S	S	*	*				72.7	136.8	98.1	-48.3	0	0	0	0	114.9
739	S	24.7	Very low	28.3	Very low	106 Å²	106	135.2 Å²	135.2	74%	0.741	75%	0.746	S	S	*	*			cis	-166.1	159.9	39.8	52.2	0	0	0	0	116.8
740	S	26.3	Very low	28.3	Very low	94 Å²	94	135.9 Å²	135.9	66%	0.657	75%	0.75	S	S	*	*			trans	57.1	111.6	152.3	48.4	0	0	0	0	121.3
741	I	28.1	Very low	28	Very low	154 Å²	154	141 Å²	141	79%	0.79	75%	0.752	S	S	*	*				75.5	116.5	76.9	-66	160.9	0	0	0	111.9
742	Q	25.8	Very low	28	Very low	160 Å²	160	142 Å²	142	75%	0.748	75%	0.75	S	S	*	*				-169	159.8	67.5	-156.2	153.6	-12.9	0	0	115.8
743	Q	26.7	Very low	28.1	Very low	140 Å²	140	142 Å²	142	65%	0.654	75%	0.75	S	S	*	*			trans	-32.2	153.5	174.3	-53.8	146.4	-51	0	0	118.4
744	H	26.6	Very low	28.1	Very low	175 Å²	175	138.9 Å²	138.9	81%	0.81	75%	0.746	S	S	*	*				-170.5	-178.2	63.5	-120.3	-72.5	0	0	0	115.8
745	A	27.8	Very low	28.3	Very low	85 Å²	85	139.3 Å²	139.3	70%	0.702	75%	0.745	S	S	*	*			trans	-80.7	-179.6	-163	0	0	0	0	0	117.6
746	P	48.8	Very low	28.6	Very low	118 Å²	118	137.2 Å²	137.2	77%	0.766	73%	0.734	S	S	*	*			trans	-110.3	-169	-156.4	44.1	-38.3	0	0	0	116.8
747	Q	24.8	Very low	28.8	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.804	74%	0.738	S	S	*	*			trans	108.4	116.4	167.8	-63.3	-178	-1.7	0	0	116.3
748	H	26.2	Very low	29.1	Very low	177 Å²	177	140.7 Å²	140.7	82%	0.819	74%	0.74	S	S	*	*				-169.5	164.6	113.1	-120.7	-85.8	0	0	0	114.4
749	S	24.8	Very low	29.4	Very low	97 Å²	97	143.7 Å²	143.7	68%	0.678	74%	0.743	S	S	*	*			trans	-91.2	172.5	-171.2	49.2	0	0	0	0	114.9
750	P	47.2	Very low	29.5	Very low	119 Å²	119	146 Å²	146	77%	0.773	75%	0.747	S	S	*	*			trans	-101.5	157.8	-163.1	38.8	-35.3	0	0	0	115.8
751	R	24.5	Very low	29.6	Very low	239 Å²	239	148.4 Å²	148.4	90%	0.902	75%	0.752	S	S	*	*			trans	176.4	153.6	155	-100.9	162.3	-179.8	-172.7	-0.2	106.4
752	K	26.3	Very low	29.6	Very low	162 Å²	162	146.8 Å²	146.8	70%	0.704	76%	0.755	S	S	*	*			cis	-172	176.3	32.1	-140.9	-179.9	163.6	-154.5	0	111.6
753	D	28.1	Very low	29.8	Very low	117 Å²	117	146.6 Å²	146.6	63%	0.626	76%	0.759	S	S	*	*			trans	80	136.5	147.4	-66.2	-19.6	0	0	0	119.1
754	T	29.6	Very low	29.8	Very low	109 Å²	109	146.2 Å²	146.2	67%	0.669	77%	0.77	S	S	*	*			cis	-163.6	155.7	-16.2	-5.9	0	0	0	0	111.7
755	K	29	Very low	29.9	Very low	175 Å²	175	145.4 Å²	145.4	76%	0.761	77%	0.772	S	S	*	*			trans	65	153.9	149	-79	175.5	156.8	-171	0	119.8
756	D	30.8	Very low	29.9	Very low	107 Å²	107	145 Å²	145	57%	0.572	78%	0.775	S	S	*	*			cis	-152.6	146.5	3.3	-116.3	-40	0	0	0	110.8
757	K	29.6	Very low	29	Very low	183 Å²	183	142.8 Å²	142.8	80%	0.796	77%	0.774	S	S	*	*			trans	44.8	131.9	149	-61.2	174.8	-177.6	-173.1	0	121.2
758	L	30.5	Very low	29.3	Very low	158 Å²	158	142.3 Å²	142.3	83%	0.827	78%	0.777	S	S	*	*				-157.6	163.4	60	-156.5	73.2	0	0	0	112.7
759	E	30.3	Very low	29.4	Very low	171 Å²	171	140.6 Å²	140.6	80%	0.799	77%	0.773	S	S	*	*			trans	-70.2	158	178	-65.8	149.5	145.2	0	0	112
760	D	28.3	Very low	29.8	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	77%	0.773	S	S	*	*				-164.1	168.5	60.1	-149.9	-14.9	0	0	0	114
761	N	28.1	Very low	29	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	78%	0.778	S	S	*	*			trans	-87.9	152.7	-171.2	-69.9	-56.9	0	0	0	115.1
762	S	28.6	Very low	29.4	Very low	120 Å²	120	147 Å²	147	84%	0.839	80%	0.797	S	S	*	*				-172.7	136.7	118.7	25.6	0	0	0	0	112.8
763	D	28.3	Very low	29.5	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	80%	0.801	S	S	*	*			trans	-67.4	157.7	172.2	-53.5	-85.3	0	0	0	112.4
764	C	27.6	Very low	29.6	Very low	132 Å²	132	147.8 Å²	147.8	89%	0.892	81%	0.811	S	S	*	*				-159.6	130.5	115.3	-134.2	0	0	0	0	113.7
765	N	28.3	Very low	29.6	Very low	159 Å²	159	150 Å²	150	85%	0.85	82%	0.818	S	S	*	*			trans	-74.5	151.8	167.1	-163.8	11.2	0	0	0	109.9
766	G	28.5	Very low	29.6	Very low	75 Å²	75	148.5 Å²	148.5	77%	0.773	82%	0.822	S	S	*	*			trans	177.2	90.6	-180	0	0	0	0	0	114.6
767	G	29.3	Very low	29.6	Very low	72 Å²	72	151.1 Å²	151.1	74%	0.742	84%	0.837	S	S	*	*			trans	-99.6	-168	164.7	0	0	0	0	0	112.6
768	D	31.8	Very low	29.5	Very low	162 Å²	162	149 Å²	149	87%	0.866	84%	0.84	S	S	*	*			trans	88.3	150.8	161	-89.2	-19.9	0	0	0	122.7
769	L	28.2	Very low	29.5	Very low	141 Å²	141	148.4 Å²	148.4	74%	0.738	84%	0.841	S	S	*	*			trans	87.6	88.3	162.9	-94.8	74.5	0	0	0	122.2
770	T	32.9	Very low	29.4	Very low	109 Å²	109	146.6 Å²	146.6	67%	0.669	84%	0.844	S	S	*	*				50.5	140	114.3	62	0	0	0	0	124.1
771	R	30.2	Very low	29.5	Very low	235 Å²	235	146 Å²	146	89%	0.887	85%	0.846	S	S	*	*			trans	62.5	113.8	139	-75.7	179.6	172.2	179.2	-2.4	118.9
772	L	32.3	Very low	29.6	Very low	247 Å²	247	146.1 Å²	146.1	100%	1.293	85%	0.853	S	S	*	*				-147.1	0	102.2	-108.2	160.7	0	0	0	110.2

Retrieved 772 of 772 residues in 223.6 ms (Link to these results)

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