A0A024QYR9_MOUSE Loading...

Phosphatidylinositol 3,4,5-trisphosphate 3-phosphatase and dual-specificity protein phosphatase PTEN

AlphaFold DB , UniProt , Accession A0A024QYR9, Species MOUSE (Mus musculus, Mouse), Gene Pten, Length 572 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	35.9	Very low	249 Å²	249	135.5 Å²	135.5	100%	1.227	87%	0.865	S	S	*	*				0	166.3	0	-85.7	168.6	160.6	0	0	108.8
2	E	38	Very low	35.5	Very low	147 Å²	147	133.1 Å²	133.1	69%	0.687	87%	0.866	S	S	*	*			trans	-60.9	168	178.7	-63	-176.5	121.9	0	0	112.9
3	R	40.3	Very low	35.4	Very low	227 Å²	227	130.2 Å²	130.2	86%	0.857	86%	0.86	S	S	*	*			cis	-167.8	160.8	-16.2	-100.4	175.3	-147.1	-145.9	13.3	103.6
4	G	33.8	Very low	36.4	Very low	73 Å²	73	130.2 Å²	130.2	75%	0.753	86%	0.86	S	S	*	*			cis	160.2	153	-4.5	0	0	0	0	0	110.3
5	G	33.8	Very low	36	Very low	79 Å²	79	126.7 Å²	126.7	81%	0.814	86%	0.855	S	S	*	*			trans	77.6	143.9	162.1	0	0	0	0	0	118.5
6	E	34.8	Very low	36	Very low	204 Å²	204	134.9 Å²	134.9	95%	0.953	86%	0.863	S	S	*	*			cis	-154.6	167.3	-16.8	-155.6	156.5	-156	0	0	110.3
7	A	36.2	Very low	35.8	Very low	98 Å²	98	131.7 Å²	131.7	81%	0.81	86%	0.861	S	S	*	*			trans	-105.3	165.9	-161.4	0	0	0	0	0	115.3
8	A	40.2	Very low	35.6	Very low	104 Å²	104	131.1 Å²	131.1	86%	0.86	86%	0.86	S	S	*	*			trans	-84.6	157.1	175.6	0	0	0	0	0	113.2
9	A	32.4	Very low	35.5	Very low	105 Å²	105	134.4 Å²	134.4	87%	0.868	86%	0.862	S	S	*	*			trans	-148.1	161.2	165.7	0	0	0	0	0	110.2
10	A	36.4	Very low	35.3	Very low	100 Å²	100	133.5 Å²	133.5	83%	0.826	86%	0.86	S	S	*	*			trans	-145.9	166	-172.1	0	0	0	0	0	113.6
11	A	34.6	Very low	35.8	Very low	104 Å²	104	132.8 Å²	132.8	86%	0.86	86%	0.855	S	S	*	*			trans	67.3	119.1	164.4	0	0	0	0	0	119.4
12	A	31.2	Very low	35.6	Very low	107 Å²	107	127.9 Å²	127.9	88%	0.884	84%	0.839	S	S	*	*				-170.4	151.6	129.9	0	0	0	0	0	112.1
13	A	33.8	Very low	35.3	Very low	95 Å²	95	127 Å²	127	79%	0.785	84%	0.844	S	S	*	*			trans	-131.2	174.5	161.8	0	0	0	0	0	106.7
14	P	49.9	Very low	34.9	Very low	131 Å²	131	124.2 Å²	124.2	85%	0.851	85%	0.845	S	S	*	*			cis	-131.6	-175.1	5.5	42.6	-26.3	0	0	0	114.3
15	G	30.5	Very low	34.8	Very low	77 Å²	77	125.5 Å²	125.5	79%	0.794	85%	0.848	S	S	*	*			trans	-156.1	144.8	169.8	0	0	0	0	0	112.8
16	R	35.2	Very low	34.7	Very low	259 Å²	259	133.6 Å²	133.6	98%	0.977	85%	0.854	S	S	*	*			trans	-90.5	140.9	174.5	-71.3	-179.6	173.5	-175.7	-2.5	110.6
17	G	32.8	Very low	34.5	Very low	80 Å²	80	128.9 Å²	128.9	83%	0.825	85%	0.85	S	S	*	*			trans	-116.6	144.8	162.7	0	0	0	0	0	110.3
18	S	31.8	Very low	34.2	Very low	121 Å²	121	127.7 Å²	127.7	85%	0.846	85%	0.847	S	S	*	*			trans	-125.9	126.7	-178.2	55.2	0	0	0	0	110.5
19	E	34.2	Very low	33.7	Very low	193 Å²	193	130.9 Å²	130.9	90%	0.902	85%	0.85	S	S	*	*			trans	-109.3	133.8	176.7	-66.9	-166.6	136.4	0	0	111.9
20	S	31.4	Very low	33.7	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	85%	0.848	S	S	*	*			trans	-172.3	157.1	174.3	-72.8	0	0	0	0	108.2
21	P	44.9	Very low	33.3	Very low	118 Å²	118	129.5 Å²	129.5	77%	0.766	85%	0.846	S	S	*	*				-131.8	160.8	-61.3	35.8	-20	0	0	0	111.9
22	V	31.7	Very low	33.3	Very low	146 Å²	146	133.4 Å²	133.4	89%	0.885	85%	0.846	S	S	*	*			trans	-131.9	133	168.6	-177.5	0	0	0	0	111.3
23	T	31.2	Very low	33.4	Very low	129 Å²	129	136.8 Å²	136.8	79%	0.791	85%	0.848	S	S	*	*			trans	-84.7	144.3	-172.9	-44.4	0	0	0	0	112.5
24	I	32.6	Very low	33.2	Very low	169 Å²	169	139.4 Å²	139.4	87%	0.867	85%	0.849	S	S	*	*			trans	-122.6	141.6	158.6	-64.2	-176.9	0	0	0	109.1
25	A	30.3	Very low	32.2	Very low	100 Å²	100	138.3 Å²	138.3	83%	0.826	84%	0.844	S	S	*	*			trans	-87.6	175.5	-167	0	0	0	0	0	114.4
26	R	32.4	Very low	32.5	Very low	249 Å²	249	140.8 Å²	140.8	94%	0.94	85%	0.846	S	S	*	*			trans	-113.3	118.1	-164	-175.5	-176.7	-174.5	-177.6	2.1	112.3
27	A	31.8	Very low	32.4	Very low	104 Å²	104	136.3 Å²	136.3	86%	0.86	84%	0.84	S	S	*	*			trans	-154.8	149.3	159.4	0	0	0	0	0	109.9
28	G	29	Very low	32.4	Very low	74 Å²	74	140.4 Å²	140.4	76%	0.763	84%	0.842	S	S	*	*			cis	141	55.6	-9.3	0	0	0	0	0	116.1
29	N	29.1	Very low	32.4	Very low	170 Å²	170	142.5 Å²	142.5	91%	0.909	84%	0.844	S	S	*	*			trans	-157.5	165.7	151.9	-130.9	-22.4	0	0	0	113.7
30	A	32.5	Very low	32.4	Very low	101 Å²	101	138.2 Å²	138.2	84%	0.835	83%	0.832	S	S	*	*			trans	-97.7	166.1	-173.7	0	0	0	0	0	113.9
31	G	28.5	Very low	32.7	Very low	75 Å²	75	139 Å²	139	77%	0.773	84%	0.835	S	S	*	*			trans	-175.1	97.2	172.4	0	0	0	0	0	111.5
32	E	35	Very low	32	Very low	187 Å²	187	139.6 Å²	139.6	87%	0.874	84%	0.836	S	S	*	*			trans	-69.6	145.8	169	-63	174.4	102.3	0	0	110.4
33	L	32	Very low	32.2	Very low	178 Å²	178	144.6 Å²	144.6	93%	0.932	84%	0.839	S	S	*	*			trans	-145.2	137.8	157.4	-110.6	171.1	0	0	0	110.3
34	L	31.1	Very low	32.3	Very low	150 Å²	150	150.5 Å²	150.5	79%	0.785	85%	0.847	S	S	*	*			trans	-99	153.2	-161	-73.9	153.4	0	0	0	113.1
35	S	28.7	Very low	32.2	Very low	107 Å²	107	154.1 Å²	154.1	75%	0.748	85%	0.85	S	S	*	*			trans	-60.8	137.9	168.5	-51.8	0	0	0	0	111.7	L37	S35-L37 PolarHBondContact O-N 3.36Å
36	P	37.3	Very low	32.3	Very low	130 Å²	130	161 Å²	161	84%	0.844	85%	0.854	S	S	*	*			trans	-75.1	108	173.3	29.9	-33	0	0	0	111
37	L	31.4	Very low	32.3	Very low	164 Å²	164	161.1 Å²	161.1	86%	0.859	86%	0.855	S	S	*	*			trans	-83.1	140.5	168.4	-79	164.7	0	0	0	110.8	S35	S35-L37 PolarHBondContact O-N 3.36Å
38	L	33.8	Very low	32.3	Very low	166 Å²	166	166.7 Å²	166.7	87%	0.869	85%	0.854	S	S	*	*			trans	-72.4	143.1	171.4	-68.4	94.3	0	0	0	111
39	L	32.4	Very low	32.4	Very low	166 Å²	166	170.8 Å²	170.8	87%	0.869	85%	0.852	S	S	*	*			trans	-134.1	149.2	164.5	-77.9	176.2	0	0	0	110.9
40	P	34	Very low	32.6	Very low	102 Å²	102	169.5 Å²	169.5	66%	0.662	85%	0.851	S	S	*	*			trans	-83.5	160.1	-165.8	33.1	-37.2	0	0	0	114.3
41	P	36.5	Very low	32.6	Very low	134 Å²	134	173.7 Å²	173.7	87%	0.87	85%	0.853	S	S	*	*			trans	-71.3	133.8	-178.6	29.2	-35.4	0	0	0	112.6
42	T	30.7	Very low	32.7	Very low	130 Å²	130	173.6 Å²	173.6	80%	0.798	85%	0.852	S	S	*	*			trans	-108	133.4	173.5	51.8	0	0	0	0	112	R44	T42-R44 PolarHBondContact O-N 3.38Å
43	R	36.3	Very low	33.1	Very low	252 Å²	252	171.2 Å²	171.2	95%	0.951	85%	0.853	S	S	*	*			trans	-61.4	131	174.8	-73.4	172.4	163.1	174.4	-5.7	111.2
44	R	32.5	Very low	32.9	Very low	252 Å²	252	166.2 Å²	166.2	95%	0.951	84%	0.844	S	S	*	*			trans	-134.2	161.5	155.8	-94.7	-172.6	175.9	-169.2	-1	113.6	T42	T42-R44 PolarHBondContact O-N 3.38Å
45	R	31.5	Very low	33.3	Very low	245 Å²	245	165.3 Å²	165.3	93%	0.925	85%	0.847	S	S	*	*			trans	-91.2	158.1	-159.6	-74.8	174.1	163.4	173.9	-6.7	114.1
46	R	32.4	Very low	33.6	Very low	245 Å²	245	166.7 Å²	166.7	93%	0.925	85%	0.851	S	S	*	*			trans	-45.5	143.8	163.3	-66.1	175.2	170.3	175.4	-4.4	113.4
47	R	31	Very low	33.5	Very low	251 Å²	251	168.6 Å²	168.6	95%	0.947	85%	0.853	S	S	*	*			trans	-134.8	163.4	144	-85.3	-169.5	166.7	-172.1	-4.4	109
48	R	32	Very low	33.5	Very low	222 Å²	222	166.1 Å²	166.1	84%	0.838	85%	0.849	S	S	*	*			trans	-119.3	150.6	-174.4	-85.2	-176.6	168.8	175.9	-5.7	111.6
49	H	31	Very low	33.5	Very low	159 Å²	159	166 Å²	166	74%	0.736	85%	0.849	S	S	*	*			trans	63.1	152.2	161.9	-61.4	-38.8	0	0	0	115.4
50	V	32.9	Very low	33.9	Very low	144 Å²	144	164 Å²	164	87%	0.873	85%	0.846	S	S	*	*			cis	-131	169.2	44.7	172	0	0	0	0	112.9
51	Q	32.8	Very low	33.9	Very low	188 Å²	188	165 Å²	165	88%	0.879	86%	0.855	S	S	*	*			trans	-93.3	152.2	178.3	-68.2	171.3	-42.7	0	0	113.1
52	G	30.6	Very low	33.8	Very low	74 Å²	74	163 Å²	163	76%	0.763	85%	0.85	S	S	*	*			trans	-165.3	151.8	168.7	0	0	0	0	0	110.3
53	P	43.5	Very low	34.1	Very low	137 Å²	137	161.9 Å²	161.9	89%	0.89	85%	0.854	S	S	*	*			trans	-114.2	152	-147.7	39.3	-32.3	0	0	0	118.2
54	G	29.1	Very low	33.9	Very low	72 Å²	72	154.8 Å²	154.8	74%	0.742	85%	0.849	S	S	*	*			trans	94.3	165	154.8	0	0	0	0	0	117.1
55	P	39.1	Very low	34.1	Very low	131 Å²	131	147.3 Å²	147.3	85%	0.851	84%	0.841	S	S	*	*			cis	-105.9	-177.7	-3.9	40.1	-31.9	0	0	0	113.5
56	V	34.7	Very low	34.6	Very low	136 Å²	136	141.4 Å²	141.4	82%	0.824	83%	0.834	S	S	*	*			trans	-105.6	134.5	178.3	176.8	0	0	0	0	110.8
57	L	34.4	Very low	35.3	Very low	170 Å²	170	135.9 Å²	135.9	89%	0.89	83%	0.83	S	S	*	*			trans	-136.5	152.8	159.4	-79	177.6	0	0	0	110.2
58	S	31.4	Very low	35.3	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	83%	0.83	S	S	*	*			trans	-96	145.1	-162.1	43.2	0	0	0	0	114.5
59	L	34.6	Very low	35.6	Very low	165 Å²	165	126.6 Å²	126.6	86%	0.864	83%	0.829	S	S	*	*			trans	-111	144.2	165.8	-72.6	168.2	0	0	0	109.8
60	P	41.4	Very low	35.6	Very low	124 Å²	124	131 Å²	131	81%	0.805	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-72.1	155.1	175.9	30.5	-34.5	0	0	0	112.2
61	S	33.2	Very low	35.7	Very low	122 Å²	122	128.4 Å²	128.4	85%	0.853	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-83.3	145.4	-174.2	-165.2	0	0	0	0	113
62	A	34.2	Very low	36.3	Very low	93 Å²	93	125.6 Å²	125.6	77%	0.769	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-77.1	144.4	169.6	0	0	0	0	0	111.2
63	A	36.5	Very low	36.5	Very low	105 Å²	105	131.3 Å²	131.3	87%	0.868	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.9	177	0	0	0	0	0	112.3
64	A	33.6	Very low	36	Very low	103 Å²	103	129.3 Å²	129.3	85%	0.851	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-88.8	150.3	-174	0	0	0	0	0	113.6
65	A	35.7	Very low	36.1	Very low	95 Å²	95	131.1 Å²	131.1	79%	0.785	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-90.8	144.7	170.2	0	0	0	0	0	111.8
66	P	42.4	Very low	35.6	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-77	162.4	176	32	-34.8	0	0	0	113.1
67	P	46.3	Very low	35.3	Very low	130 Å²	130	126.1 Å²	126.1	84%	0.844	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-91.6	163.2	-160.8	35.6	-37.7	0	0	0	116.5
68	L	32.3	Very low	35	Very low	178 Å²	178	121.9 Å²	121.9	93%	0.932	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-67.8	144.6	173.8	-71.5	158.8	0	0	0	113.3
69	A	37.1	Very low	35	Very low	100 Å²	100	122.5 Å²	122.5	83%	0.826	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-94.8	151.4	168.1	0	0	0	0	0	111.9
70	R	30.9	Very low	34.7	Very low	250 Å²	250	125 Å²	125	94%	0.943	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-86.9	147.1	177.8	-91.7	177.7	163.3	160.1	-7.4	112.4
71	A	36	Very low	34.2	Very low	90 Å²	90	124.4 Å²	124.4	74%	0.744	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-90.4	158.8	162.3	0	0	0	0	0	111.6
72	P	45.2	Very low	34	Very low	129 Å²	129	126 Å²	126	84%	0.838	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-88.1	156.5	164.8	35.7	-32.7	0	0	0	112.2
73	E	34.2	Very low	33.8	Very low	194 Å²	194	128.6 Å²	128.6	91%	0.907	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-90.3	160.5	174	-56.4	176.6	105.3	0	0	112.2
74	A	32.9	Very low	33.8	Very low	96 Å²	96	134.7 Å²	134.7	79%	0.793	84%	0.835	S	S	*	*				178.2	130.5	115.6	0	0	0	0	0	113.1
75	A	31.7	Very low	33.8	Very low	109 Å²	109	135.2 Å²	135.2	90%	0.901	83%	0.83	S	S	*	*			trans	52.6	144.5	159.1	0	0	0	0	0	120.4
76	G	29.3	Very low	34.1	Very low	83 Å²	83	136.2 Å²	136.2	86%	0.856	83%	0.832	S	S	*	*			cis	141.4	117.9	-7.6	0	0	0	0	0	112.9
77	G	28.3	Very low	33.7	Very low	80 Å²	80	135.6 Å²	135.6	83%	0.825	83%	0.83	S	S	*	*			trans	154.3	129.1	166.5	0	0	0	0	0	116.6
78	G	28.1	Very low	33.7	Very low	81 Å²	81	134.2 Å²	134.2	84%	0.835	82%	0.821	S	S	*	*			trans	83.4	110.9	136.8	0	0	0	0	0	119.3
79	S	30.8	Very low	33.7	Very low	125 Å²	125	133.2 Å²	133.2	87%	0.874	81%	0.811	S	S	*	*			trans	-44.2	148.4	159.2	-40.1	0	0	0	0	114.6
80	R	28.8	Very low	33.4	Very low	216 Å²	216	133.2 Å²	133.2	82%	0.815	81%	0.805	S	S	*	*				-177.4	158.1	99.7	-152.1	174.6	165	142.5	-8.5	111	E82	R80-E82 IonicContact CZ-OE1 2.74Å; R80-E82 IonicContact NE-OE1 2.96Å; R80-E82 PolarHBondContact NE-OE1 3.16Å; R80-E82 IonicContact NH2-OE1 3.32Å; R80-E82 PolarHBondContact NH2-OE1 2.79Å
81	C	31.1	Very low	33.4	Very low	113 Å²	113	125.9 Å²	125.9	76%	0.764	80%	0.798	S	S	*	*			trans	-82.3	141.9	159.9	-49.2	0	0	0	0	109.4
82	E	29.4	Very low	33.1	Very low	155 Å²	155	126.1 Å²	126.1	72%	0.724	80%	0.8	S	S	*	*			trans	-170.9	174.3	142.6	-106.3	155.6	-124	0	0	111.1	R80	R80-E82 IonicContact CZ-OE1 2.74Å; R80-E82 IonicContact NE-OE1 2.96Å; R80-E82 PolarHBondContact NE-OE1 3.16Å; R80-E82 IonicContact NH2-OE1 3.32Å; R80-E82 PolarHBondContact NH2-OE1 2.79Å
83	D	29.4	Very low	32.4	Very low	147 Å²	147	126 Å²	126	79%	0.786	80%	0.803	S	S	*	*			trans	-71.4	166.8	-155	-60.6	-72.8	0	0	0	117.9	P85	D83-P85 WeakPolarHBondContact O-CD 3.34Å
84	Y	35.4	Very low	32.2	Very low	233 Å²	233	121.6 Å²	121.6	91%	0.914	80%	0.799	S	S	*	*			trans	-62.1	119.3	164.3	-85.5	-96.2	0	0	0	110.9	S86	Y84-S86 PolarHBondContact O-N 3.02Å; Y84-S86 VanDerWaalsContact O-N 3.16Å
85	P	34.1	Very low	32.1	Very low	115 Å²	115	122.1 Å²	122.1	75%	0.747	80%	0.803	S	S	*	*			trans	-75.9	106.8	172.3	30.6	-32.4	0	0	0	110.1	D83	D83-P85 WeakPolarHBondContact O-CD 3.34Å
86	S	42.6	Very low	31.9	Very low	116 Å²	116	128.4 Å²	128.4	81%	0.811	80%	0.804	S	S	*	*			trans	-68.8	145.4	152.3	51.6	0	0	0	0	108.9	Y84	Y84-S86 PolarHBondContact O-N 3.02Å; Y84-S86 VanDerWaalsContact O-N 3.16Å
87	S	33.8	Very low	33	Very low	107 Å²	107	129.6 Å²	129.6	75%	0.748	80%	0.796	S	S	*	*			trans	-150.6	148.9	-179.5	-80.6	0	0	0	0	112.2
88	P	46.7	Very low	33	Very low	101 Å²	101	134.1 Å²	134.1	66%	0.656	80%	0.801	S	S	*	*			trans	-134.8	-164.3	-133.9	30.4	-6.5	0	0	0	114.4
89	H	31.5	Very low	33	Very low	158 Å²	158	134.2 Å²	134.2	73%	0.731	79%	0.794	S	S	*	*			trans	83.4	128.5	172.1	-57.3	-65.2	0	0	0	115.9
90	S	30.9	Very low	33	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	79%	0.787	S	S	*	*			cis	75.3	144	26.4	92.5	0	0	0	0	114.5
91	A	31.5	Very low	33	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	79%	0.787	S	S	*	*			cis	-173.5	-163.4	-18.5	0	0	0	0	0	105.2
92	A	29.6	Very low	32.9	Very low	96 Å²	96	131 Å²	131	79%	0.793	78%	0.778	S	S	*	*			cis	-157.8	156	1.1	0	0	0	0	0	109.2
93	S	29.6	Very low	32.9	Very low	127 Å²	127	131 Å²	131	89%	0.888	78%	0.776	S	S	*	*			trans	-160.4	140.1	150.4	-167.9	0	0	0	0	111.8
94	A	31	Very low	32.8	Very low	100 Å²	100	132.2 Å²	132.2	83%	0.826	78%	0.776	S	S	*	*			trans	-146.3	137.3	175	0	0	0	0	0	110.4
95	A	29.9	Very low	32.5	Very low	108 Å²	108	125.2 Å²	125.2	89%	0.893	77%	0.767	S	S	*	*			trans	-153.8	150.1	165.6	0	0	0	0	0	111.9
96	R	28.6	Very low	32.2	Very low	241 Å²	241	128.1 Å²	128.1	91%	0.909	77%	0.77	S	S	*	*			trans	-137.6	177.7	175.8	-103.9	-175.7	171.9	-170.5	-1.2	105.9
97	P	52	Low	31.5	Very low	107 Å²	107	127.9 Å²	127.9	70%	0.695	77%	0.769	S	S	*	*			cis	-127.9	-169.2	-38.9	38.6	-22.8	0	0	0	109.8
98	L	27.5	Very low	31.2	Very low	175 Å²	175	130.5 Å²	130.5	92%	0.916	77%	0.774	S	S	*	*			trans	175.4	176.7	137	-95.4	164	0	0	0	111.4
99	A	29.5	Very low	30.4	Very low	84 Å²	84	134.1 Å²	134.1	69%	0.694	78%	0.782	S	S	*	*				-150.5	170.5	-129.2	0	0	0	0	0	114.5
100	A	29.7	Very low	30.6	Very low	88 Å²	88	132.7 Å²	132.7	73%	0.727	79%	0.787	S	S	*	*			trans	66.5	163.8	174	0	0	0	0	0	114.8
101	E	29.4	Very low	30.6	Very low	175 Å²	175	134 Å²	134	82%	0.818	80%	0.796	S	S	*	*			cis	-161.7	-176.8	-27.5	-110.9	177.2	121.6	0	0	106.7
102	E	28	Very low	30.5	Very low	122 Å²	122	134.8 Å²	134.8	57%	0.57	80%	0.795	S	S	*	*			cis	-161.9	173.1	11.5	-142.3	-164.6	136.1	0	0	110.4
103	K	29.2	Very low	30.6	Very low	157 Å²	157	135.8 Å²	135.8	68%	0.683	80%	0.797	S	S	*	*			trans	62.6	171.5	152.3	-74.3	164.6	170.5	120.8	0	120.8
104	Q	27.6	Very low	30.6	Very low	171 Å²	171	141 Å²	141	80%	0.799	80%	0.797	S	S	*	*				-169.9	141.5	-58.5	-138.2	178.1	9.7	0	0	111.4
105	A	29	Very low	30.5	Very low	86 Å²	86	148.3 Å²	148.3	71%	0.711	80%	0.803	S	S	*	*			trans	60.7	170.1	153.4	0	0	0	0	0	119.3
106	Q	28	Very low	30.5	Very low	176 Å²	176	148 Å²	148	82%	0.822	79%	0.794	S	S	*	*			cis	-163.1	150.4	-35.6	-103.9	-179.4	0.1	0	0	109.6
107	S	27.4	Very low	30.6	Very low	111 Å²	111	141.9 Å²	141.9	78%	0.776	79%	0.788	S	S	*	*			trans	64.7	155	160.8	72	0	0	0	0	116.9
108	L	28.7	Very low	29.6	Very low	163 Å²	163	145.2 Å²	145.2	85%	0.853	79%	0.794	S	S	*	*			cis	-154.4	-171.1	49.2	-108.4	168.4	0	0	0	113.7
109	Q	29.8	Very low	29.6	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	79%	0.789	S	S	*	*			trans	-84.5	163.1	-169.1	-82.6	-173.4	-12.6	0	0	116.6
110	P	36	Very low	30.8	Very low	128 Å²	128	148.5 Å²	148.5	83%	0.831	79%	0.793	S	S	*	*			trans	-77.6	160.9	179.3	33	-37.8	0	0	0	114.5
111	S	29.9	Very low	31.1	Very low	127 Å²	127	148.3 Å²	148.3	89%	0.888	79%	0.792	S	S	*	*			trans	-120.4	175.9	173.5	66.8	0	0	0	0	112.1
112	S	29.6	Very low	31.4	Very low	112 Å²	112	144.4 Å²	144.4	78%	0.783	79%	0.79	S	S	*	*			trans	-138.1	149.7	-148.6	68.8	0	0	0	0	117.7
113	S	31.3	Very low	31.6	Very low	117 Å²	117	145.2 Å²	145.2	82%	0.818	80%	0.802	S	S	*	*			trans	-158.9	125.8	151.2	54.3	0	0	0	0	108.4
114	R	31.1	Very low	31.9	Very low	237 Å²	237	147.1 Å²	147.1	89%	0.894	81%	0.814	S	S	*	*			cis	89.8	84.9	40	-80.8	-161.5	167.7	-157	-0.3	116.2
115	R	28.9	Very low	32	Very low	253 Å²	253	142.3 Å²	142.3	96%	0.955	81%	0.81	S	S	*	*			trans	-170.4	157.3	136.5	-108.3	-179.2	178.2	-154.2	-1	110.3
116	S	29	Very low	32.2	Very low	102 Å²	102	147.8 Å²	147.8	71%	0.713	82%	0.821	S	S	*	*				165.2	94.4	-58.3	172.1	0	0	0	0	111.4
117	S	30.3	Very low	32.5	Very low	111 Å²	111	144.2 Å²	144.2	78%	0.776	82%	0.822	S	S	*	*			trans	173.5	148.3	161	50.8	0	0	0	0	110.8
118	H	31	Very low	32.6	Very low	177 Å²	177	143.1 Å²	143.1	82%	0.819	82%	0.819	S	S	*	*			cis	-155.5	171.7	-32.8	-117.8	-58.6	0	0	0	109.5
119	Y	28.7	Very low	32.9	Very low	209 Å²	209	140 Å²	140	82%	0.82	82%	0.817	S	S	*	*			trans	-87.7	178.7	-170.4	-91.7	-72.9	0	0	0	114.1	A121	Y119-A121 HydrophobicContact CD1-CB 4.28Å
120	P	53.2	Low	33	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	81%	0.809	S	S	*	*			cis	-123.5	168.2	25.4	22.3	3.3	0	0	0	116
121	A	36.6	Very low	32.9	Very low	84 Å²	84	143.2 Å²	143.2	69%	0.694	81%	0.811	S	S	*	*			cis	88.7	147.2	29.3	0	0	0	0	0	115.2	Y119	Y119-A121 HydrophobicContact CD1-CB 4.28Å
122	A	35.8	Very low	32.8	Very low	94 Å²	94	141 Å²	141	78%	0.777	81%	0.807	S	S	*	*			cis	-110.1	-128.4	8.3	0	0	0	0	0	114.3
123	V	32.6	Very low	32.9	Very low	138 Å²	138	140.8 Å²	140.8	84%	0.836	81%	0.813	S	S	*	*			cis	-139.2	-148.1	13.1	-152.9	0	0	0	0	111.4
124	Q	35.3	Very low	32.9	Very low	197 Å²	197	140.9 Å²	140.9	92%	0.921	81%	0.813	S	S	*	*			trans	-151.4	163.1	-159.6	-64.6	-179	-57.5	0	0	118.1
125	G	29.2	Very low	33.1	Very low	70 Å²	70	133.5 Å²	133.5	72%	0.722	80%	0.803	S	S	*	*			trans	131.4	116.5	167	0	0	0	0	0	112.4
126	Q	33.1	Very low	33.1	Very low	202 Å²	202	128.4 Å²	128.4	94%	0.944	80%	0.8	S	S	*	*			cis	66.6	131.3	33.6	-64.8	-171.6	-18.3	0	0	114.6
127	A	34.2	Very low	33.3	Very low	101 Å²	101	127.9 Å²	127.9	84%	0.835	80%	0.802	S	S	*	*			cis	-158.8	-172.3	-10.1	0	0	0	0	0	108.3
128	A	30.8	Very low	33.4	Very low	88 Å²	88	131.7 Å²	131.7	73%	0.727	81%	0.805	S	S	*	*			cis	-152	173	5.2	0	0	0	0	0	109.6
129	A	33.8	Very low	33.2	Very low	96 Å²	96	128.5 Å²	128.5	79%	0.793	80%	0.802	S	S	*	*				53.5	138.8	83.4	0	0	0	0	0	116.4
130	E	32.5	Very low	33.5	Very low	144 Å²	144	130.3 Å²	130.3	67%	0.673	81%	0.808	S	S	*	*			cis	-148.2	152.6	15	-79.6	-160.1	104.4	0	0	116.3
131	R	34.4	Very low	32.4	Very low	230 Å²	230	129.3 Å²	129.3	87%	0.868	81%	0.81	S	S	*	*				34	146.6	129.4	-52.6	179.7	172.8	149.8	-12.8	125.2
132	G	27.2	Very low	32.4	Very low	79 Å²	79	133 Å²	133	81%	0.814	82%	0.816	S	S	*	*			trans	169.5	134.6	152.8	0	0	0	0	0	114.1
133	A	32	Very low	32	Very low	109 Å²	109	134.2 Å²	134.2	90%	0.901	82%	0.819	S	S	*	*			trans	-163.9	151.3	-178.3	0	0	0	0	0	115.1
134	S	32	Very low	32	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	82%	0.816	S	S	*	*			trans	-173.4	138.5	152.7	-158.7	0	0	0	0	115.1
135	A	34.8	Very low	31.8	Very low	82 Å²	82	133.3 Å²	133.3	68%	0.678	81%	0.813	S	S	*	*			trans	24.5	164.1	138.1	0	0	0	0	0	123.4
136	T	28.7	Very low	32	Very low	146 Å²	146	137.7 Å²	137.7	90%	0.896	82%	0.815	S	S	*	*			cis	-157.6	-157.7	31.7	-28.2	0	0	0	0	113.3
137	A	32.4	Very low	31.8	Very low	92 Å²	92	138 Å²	138	76%	0.76	81%	0.813	S	S	*	*			trans	-139.2	-157.9	-169.5	0	0	0	0	0	113.2
138	K	32.3	Very low	31.5	Very low	190 Å²	190	142.5 Å²	142.5	83%	0.826	81%	0.814	S	S	*	*			cis	-174.9	109.2	27.3	-164.1	179.5	-172.6	177.7	0	116.9
139	S	28.7	Very low	32	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	81%	0.812	S	S	*	*			trans	67	155.6	150.5	-53.8	0	0	0	0	124.7
140	R	33.6	Very low	32	Very low	247 Å²	247	150 Å²	150	93%	0.932	82%	0.816	S	S	*	*			trans	76.5	156.1	155.8	-84.1	179.4	178.6	-174.7	-0.8	118.6
141	A	30.1	Very low	32	Very low	98 Å²	98	151.1 Å²	151.1	81%	0.81	82%	0.821	S	S	*	*			cis	-148.4	-168.2	3.4	0	0	0	0	0	113.7
142	I	36	Very low	31.8	Very low	162 Å²	162	147.4 Å²	147.4	83%	0.831	81%	0.814	S	S	*	*			trans	-107.5	147.7	-176.7	-63.6	160.1	0	0	0	112.2
143	S	29	Very low	32	Very low	119 Å²	119	150.6 Å²	150.6	83%	0.832	81%	0.808	S	S	*	*			trans	-155.9	171.9	152.9	73	0	0	0	0	113.2
144	I	32.8	Very low	31.9	Very low	152 Å²	152	151.9 Å²	151.9	78%	0.779	80%	0.799	S	S	*	*			trans	-135.7	139.5	-172.5	-60.2	169.3	0	0	0	109.3
145	L	31.2	Very low	31.9	Very low	164 Å²	164	153.2 Å²	153.2	86%	0.859	80%	0.796	S	S	*	*			trans	-172.7	169.7	142.1	-106.8	161.7	0	0	0	114.3
146	Q	32.3	Very low	31.9	Very low	163 Å²	163	155.5 Å²	155.5	76%	0.762	80%	0.804	S	S	*	*			trans	-103.6	155.6	-167.5	-53	158.5	-40.6	0	0	113
147	K	28.4	Very low	32.4	Very low	208 Å²	208	153.4 Å²	153.4	90%	0.904	80%	0.795	S	S	*	*				-175.6	152.4	122.7	-99.7	157.3	-173.8	177.3	0	114
148	K	29.1	Very low	32.3	Very low	196 Å²	196	157.7 Å²	157.7	85%	0.852	80%	0.804	S	S	*	*			trans	-122.1	157.4	167	-121	177.5	-175.7	177.4	0	105.9
149	P	40.7	Very low	32.2	Very low	106 Å²	106	153.6 Å²	153.6	69%	0.688	80%	0.799	S	S	*	*				-160.5	164.3	75.2	41.9	-21.5	0	0	0	119.3
150	R	33.2	Very low	32.5	Very low	234 Å²	234	153 Å²	153	88%	0.883	80%	0.796	S	S	*	*			trans	59.6	153.3	141	-73.8	175.3	-178.5	-173.5	0.4	121.2
151	H	33.6	Very low	32.2	Very low	168 Å²	168	150 Å²	150	78%	0.778	79%	0.789	S	S	*	*			cis	-170	173.1	-28.1	-149	-88.7	0	0	0	110.7
152	Q	29	Very low	32.2	Very low	153 Å²	153	153.2 Å²	153.2	72%	0.715	79%	0.785	S	S	*	*			trans	81.4	143.5	170.8	-58.1	-170.3	-5	0	0	115.6
153	Q	31.7	Very low	32	Very low	145 Å²	145	153.5 Å²	153.5	68%	0.678	78%	0.781	S	S	*	*			cis	-156.8	171.8	-9.5	-110.1	177.8	114.1	0	0	107.1
154	L	30.3	Very low	32.3	Very low	137 Å²	137	153 Å²	153	72%	0.717	78%	0.778	S	S	*	*			cis	-148.9	-156	6.9	-136.3	178.7	0	0	0	109.3
155	L	32.5	Very low	32.3	Very low	145 Å²	145	153.7 Å²	153.7	76%	0.759	78%	0.777	S	S	*	*			trans	-136.2	166.7	166.1	-65.7	173.5	0	0	0	109.1
156	P	35.1	Very low	32.6	Very low	130 Å²	130	156.7 Å²	156.7	84%	0.844	78%	0.777	S	S	*	*				-139	169.6	86.9	38.3	-24.5	0	0	0	114.7
157	S	39.4	Very low	32.9	Very low	103 Å²	103	156.7 Å²	156.7	72%	0.72	78%	0.782	S	S	*	*			trans	-113.2	149.1	-178.8	56.5	0	0	0	0	112.9
158	L	29.6	Very low	33.6	Very low	181 Å²	181	151.1 Å²	151.1	95%	0.948	77%	0.767	S	S	*	*			trans	-136.1	153.8	151.9	-78.4	-179.6	0	0	0	110.2
159	S	30.1	Very low	34.8	Very low	104 Å²	104	146.3 Å²	146.3	73%	0.727	75%	0.75	S	S	*	*			trans	-113	163.3	-171.7	58.5	0	0	0	0	113.4
160	S	35	Very low	35	Very low	99 Å²	99	147.8 Å²	147.8	69%	0.692	75%	0.75	S	S	*	*			trans	59.9	114.3	157.8	59.5	0	0	0	0	119.1
161	F	27.3	Very low	35.9	Very low	182 Å²	182	139.1 Å²	139.1	80%	0.798	72%	0.723	S	S	*	*				-172	109.8	121.1	-117	-133.7	0	0	0	111.2
162	F	30	Very low	37	Very low	166 Å²	166	133.2 Å²	133.2	73%	0.728	70%	0.703	S	S	*	*			trans	55	154.4	163.5	-55.7	-91.8	0	0	0	118.2
163	F	31.1	Very low	38.2	Very low	168 Å²	168	129.2 Å²	129.2	74%	0.737	69%	0.686	S	S	*	*			cis	-123.8	155.4	11.3	-107.8	-97.2	0	0	0	112.4	H165	F163-H165 PolarHBondContact O-N 3.22Å
164	S	35.8	Very low	39.4	Very low	110 Å²	110	125.7 Å²	125.7	77%	0.769	67%	0.671	S	S	*	*			trans	-92.8	92.9	167.3	-171	0	0	0	0	110.5	R166	S164-R166 PolarHBondContact O-N 2.7Å
165	H	32.7	Very low	40.6	Very low	165 Å²	165	120.7 Å²	120.7	76%	0.764	64%	0.643	S	S	*	*			trans	-81.9	95.7	165.9	-74.9	-74.5	0	0	0	109.6	F163 L167	F163-H165 PolarHBondContact O-N 3.22Å; H165-L167 PolarHBondContact O-N 3.31Å
166	R	37.8	Very low	41.7	Very low	227 Å²	227	118.5 Å²	118.5	86%	0.857	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-61.6	122.7	158.2	-72.7	-175.8	177.9	178.5	-0.8	107.8	S164	S164-R166 PolarHBondContact O-N 2.7Å
167	L	39.4	Very low	42.4	Very low	164 Å²	164	117.4 Å²	117.4	86%	0.859	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-59.8	136.2	160	-69.3	167.4	0	0	0	107.8	H165	H165-L167 PolarHBondContact O-N 3.31Å
168	P	42.4	Very low	43.3	Very low	90 Å²	90	115.2 Å²	115.2	58%	0.584	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-62.9	138.7	174.7	27.6	-34.2	0	0	0	109.7	M170 I173	P168-M170 PolarHBondContact O-N 3.4Å; P168-I173 HydrophobicContact CB-CD1 4.09Å; P168-I173 HydrophobicContact CG-CD1 4.03Å
169	D	54.4	Low	44.4	Very low	96 Å²	96	106.8 Å²	106.8	51%	0.513	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-65.3	119.4	-179.6	-173.7	-28.8	0	0	0	109.8	T171 A172 I173	D169-T171 VanDerWaalsContact CG-OG1 3.25Å; D169-T171 PolarHBondContact O-N 3.35Å; D169-T171 VanDerWaalsContact O-N 3.17Å; D169-T171 WeakPolarHBondContact OD1-CA 3.34Å; D169-T171 WeakPolarHBondContact OD1-CB 3.4Å; D169-T171 PolarHBondContact OD1-N 2.86Å; D169-T171 PolarHBondContact OD1-OG1 2.76Å; D169-T171 PolarHBondContact OD2-OG1 3.16Å; D169-A172 HydrophobicContact CB-CB 4.04Å; D169-A172 WeakPolarHBondContact O-CB 3.35Å; D169-A172 PolarHBondContact O-N 2.99Å; D169-I173 PolarHBondContact O-N 3.1Å; D169-I173 VanDerWaalsContact O-N 3.1Å
170	M	45.5	Very low	46.1	Very low	137 Å²	137	109 Å²	109	68%	0.675	55%	0.546	S	S	*	.	H	α-helix	trans	-57.1	-30.6	179.3	-67.3	-68.7	-73.5	0	0	112.2	P168 I173 I174	P168-M170 PolarHBondContact O-N 3.4Å; M170-I173 HydrophobicContact SD-CD1 4.32Å; M170-I174 WeakPolarHBondContact O-CD1 3.39Å; M170-I174 VanDerWaalsContact O-CG1 3.24Å; M170-I174 WeakPolarHBondContact O-CG1 3.35Å; M170-I174 PolarHBondContact O-N 3.3Å; M170-I174 VanDerWaalsContact O-N 3.09Å
171	T	51.6	Low	47.7	Very low	52 Å²	52	108 Å²	108	32%	0.319	53%	0.533	S	S	.	.	H	α-helix	trans	-72.3	-34.2	175.7	73.1	0	0	0	0	112.2	D169 K175 V214	D169-T171 VanDerWaalsContact CG-OG1 3.25Å; D169-T171 PolarHBondContact O-N 3.35Å; D169-T171 VanDerWaalsContact O-N 3.17Å; D169-T171 WeakPolarHBondContact OD1-CA 3.34Å; D169-T171 WeakPolarHBondContact OD1-CB 3.4Å; D169-T171 PolarHBondContact OD1-N 2.86Å; D169-T171 PolarHBondContact OD1-OG1 2.76Å; D169-T171 PolarHBondContact OD2-OG1 3.16Å; T171-K175 VanDerWaalsContact O-CB 3.32Å; T171-K175 WeakPolarHBondContact O-CB 3.36Å; T171-K175 VanDerWaalsContact O-CG 3.24Å; T171-K175 WeakPolarHBondContact O-CG 3.22Å; T171-K175 PolarHBondContact O-N 3.36Å; T171-V214 HydrophobicContact CG2-CG1 4.21Å
172	A	55.7	Low	50.1	Low	43 Å²	43	99.9 Å²	99.9	36%	0.355	50%	0.497	S	S	.	.	H	α-helix	trans	-67.3	-42.3	174.1	0	0	0	0	0	111.2	D169 I174 K175 E176	D169-A172 HydrophobicContact CB-CB 4.04Å; D169-A172 WeakPolarHBondContact O-CB 3.35Å; D169-A172 PolarHBondContact O-N 2.99Å; A172-I174 PolarHBondContact O-N 3.06Å; A172-K175 PolarHBondContact O-N 3.06Å; A172-E176 PolarHBondContact O-N 2.78Å
173	I	55.6	Low	52.4	Low	69 Å²	69	97.9 Å²	97.9	35%	0.354	49%	0.485	S	S	.	.	H	α-helix	trans	-59.4	-48.6	175	-62.3	171.5	0	0	0	110.6	P168 D169 M170 K175 E176 I177	P168-I173 HydrophobicContact CB-CD1 4.09Å; P168-I173 HydrophobicContact CG-CD1 4.03Å; D169-I173 PolarHBondContact O-N 3.1Å; D169-I173 VanDerWaalsContact O-N 3.1Å; M170-I173 HydrophobicContact SD-CD1 4.32Å; I173-K175 PolarHBondContact O-N 3.29Å; I173-E176 PolarHBondContact O-N 3.16Å; I173-I177 HydrophobicContact CG2-CD1 3.92Å; I173-I177 VanDerWaalsContact O-CG1 3.31Å; I173-I177 WeakPolarHBondContact O-CG1 3.29Å; I173-I177 PolarHBondContact O-N 2.72Å
174	I	56.3	Low	55	Low	71 Å²	71	91.3 Å²	91.3	36%	0.364	46%	0.455	S	S	.	.	H	α-helix	trans	-62.6	-42.2	178.5	-69.3	165.6	0	0	0	111.1	M170 A172 I177 V178	M170-I174 WeakPolarHBondContact O-CD1 3.39Å; M170-I174 VanDerWaalsContact O-CG1 3.24Å; M170-I174 WeakPolarHBondContact O-CG1 3.35Å; M170-I174 PolarHBondContact O-N 3.3Å; M170-I174 VanDerWaalsContact O-N 3.09Å; A172-I174 PolarHBondContact O-N 3.06Å; I174-I177 PolarHBondContact O-N 2.66Å; I174-V178 WeakPolarHBondContact O-CG2 3.08Å; I174-V178 PolarHBondContact O-N 3.06Å
175	K	55.4	Low	57.3	Low	33 Å²	33	87 Å²	87	14%	0.143	42%	0.422	C	S	.	.	H	α-helix	trans	-64.1	-39	175.8	-78.2	171.3	179	177.4	0	112.5	T171 A172 I173 V178 S179 R184 G213 V214 R216	T171-K175 VanDerWaalsContact O-CB 3.32Å; T171-K175 WeakPolarHBondContact O-CB 3.36Å; T171-K175 VanDerWaalsContact O-CG 3.24Å; T171-K175 WeakPolarHBondContact O-CG 3.22Å; T171-K175 PolarHBondContact O-N 3.36Å; A172-K175 PolarHBondContact O-N 3.06Å; I173-K175 PolarHBondContact O-N 3.29Å; K175-V178 PolarHBondContact O-N 3.05Å; K175-S179 PolarHBondContact O-N 3.09Å; K175-S179 PolarHBondContact O-OG 3.02Å; K175-R184 PolarHBondContact O-NH1 3.16Å; K175-G213 VanDerWaalsContact CE-O 3.22Å; K175-G213 WeakPolarHBondContact CE-O 3.13Å; K175-G213 PolarHBondContact NZ-O 2.89Å; K175-V214 WeakPolarHBondContact CE-O 2.99Å; K175-V214 WeakPolarHBondContact CG-O 3.4Å; K175-R216 WeakPolarHBondContact CE-O 3.4Å
176	E	54.5	Low	59.8	Low	98 Å²	98	84.7 Å²	84.7	46%	0.458	41%	0.412	S	S	.	.	H	α-helix	trans	-63.4	-48.4	175.9	-176.6	158.8	-145.9	0	0	111	A172 I173 V178 S179 R180 R330	A172-E176 PolarHBondContact O-N 2.78Å; I173-E176 PolarHBondContact O-N 3.16Å; E176-V178 VanDerWaalsContact C-N 3.26Å; E176-V178 PolarHBondContact O-N 2.94Å; E176-S179 WeakPolarHBondContact CA-OG 3.34Å; E176-S179 CarbonylContact O-C 3.55Å; E176-S179 PolarHBondContact O-N 2.82Å; E176-S179 PolarHBondContact O-OG 3.19Å; E176-R180 PolarHBondContact O-N 2.67Å; E176-R330 IonicContact OE1-NH1 3.18Å
177	I	51	Low	61.8	Low	108 Å²	108	79.2 Å²	79.2	55%	0.554	40%	0.396	S	S	*	.	H	α-helix	trans	-55.6	-39.8	175.9	-68.3	165.4	0	0	0	111.6	I173 I174 R180	I173-I177 HydrophobicContact CG2-CD1 3.92Å; I173-I177 VanDerWaalsContact O-CG1 3.31Å; I173-I177 WeakPolarHBondContact O-CG1 3.29Å; I173-I177 PolarHBondContact O-N 2.72Å; I174-I177 PolarHBondContact O-N 2.66Å; I177-R180 WeakPolarHBondContact O-CG 3.41Å; I177-R180 PolarHBondContact O-N 3.31Å
178	V	57.1	Low	63.8	Low	57 Å²	57	77 Å²	77	35%	0.345	38%	0.384	S	S	.	.	H	α-helix	trans	-77.4	-27.9	178.5	173.6	0	0	0	0	112.7	I174 K175 E176 Y215	I174-V178 WeakPolarHBondContact O-CG2 3.08Å; I174-V178 PolarHBondContact O-N 3.06Å; K175-V178 PolarHBondContact O-N 3.05Å; E176-V178 VanDerWaalsContact C-N 3.26Å; E176-V178 PolarHBondContact O-N 2.94Å; V178-Y215 WeakPolarHBondContact CB-O 3.21Å; V178-Y215 HydrophobicContact CG1-CD2 4.23Å; V178-Y215 WeakPolarHBondContact CG1-O 3.38Å; V178-Y215 HydrophobicContact CG2-CD2 4.02Å
179	S	54.7	Low	65.7	Low	4 Å²	4	76 Å²	76	3%	0.028	39%	0.392	C	S	.	.	H	α-helix	trans	-73.9	-29.5	168.4	42.1	0	0	0	0	113.8	K175 E176 N181 K182 R184	K175-S179 PolarHBondContact O-N 3.09Å; K175-S179 PolarHBondContact O-OG 3.02Å; E176-S179 WeakPolarHBondContact CA-OG 3.34Å; E176-S179 CarbonylContact O-C 3.55Å; E176-S179 PolarHBondContact O-N 2.82Å; E176-S179 PolarHBondContact O-OG 3.19Å; S179-N181 PolarHBondContact O-N 2.82Å; S179-K182 WeakPolarHBondContact O-CB 3.31Å; S179-K182 WeakPolarHBondContact O-CE 3.5Å; S179-K182 WeakPolarHBondContact O-CG 3.46Å; S179-K182 PolarHBondContact O-N 3.08Å; S179-K182 VanDerWaalsContact O-N 3.1Å; S179-R184 VanDerWaalsContact CB-NH1 3.34Å; S179-R184 WeakPolarHBondContact OG-CD 3.37Å; S179-R184 PolarHBondContact OG-NH1 3.08Å
180	R	65.2	Low	67.2	Low	151 Å²	151	72.3 Å²	72.3	57%	0.57	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	-127.9	-171.5	-51.5	-175.9	-159.9	-148.6	3.2	110.5	E176 I177 K182 N558	E176-R180 PolarHBondContact O-N 2.67Å; I177-R180 WeakPolarHBondContact O-CG 3.41Å; I177-R180 PolarHBondContact O-N 3.31Å; R180-K182 PolarHBondContact O-N 3Å; R180-K182 VanDerWaalsContact O-N 3.16Å; R180-N558 PolarHBondContact NH1-OD1 3.22Å; R180-N558 PolarHBondContact NH2-OD1 2.9Å
181	N	68.6	Low	69.3	Low	78 Å²	78	68.2 Å²	68.2	42%	0.417	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	12.2	-177.3	-57	-17.2	0	0	0	114.3	S179 T329 R330 D331	S179-N181 PolarHBondContact O-N 2.82Å; N181-T329 CarbonylContact O-C 3.53Å; N181-T329 VanDerWaalsContact O-CA 3.27Å; N181-T329 WeakPolarHBondContact O-CA 3.43Å; N181-T329 WeakPolarHBondContact O-CB 3.37Å; N181-R330 HydrophobicContact CB-CB 4.49Å; N181-R330 PolarHBondContact O-N 3.02Å; N181-D331 HydrophobicContact CB-CB 4.11Å; N181-D331 VanDerWaalsContact ND2-CG 3.31Å; N181-D331 PolarHBondContact ND2-OD2 2.91Å
182	K	77.1	Confident	71.1	Confident	11 Å²	11	65.9 Å²	65.9	5%	0.048	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-75.4	148.9	174	-70.2	176.3	-70.1	175.1	0	111	S179 R180 D193 A295	S179-K182 WeakPolarHBondContact O-CB 3.31Å; S179-K182 WeakPolarHBondContact O-CE 3.5Å; S179-K182 WeakPolarHBondContact O-CG 3.46Å; S179-K182 PolarHBondContact O-N 3.08Å; S179-K182 VanDerWaalsContact O-N 3.1Å; R180-K182 PolarHBondContact O-N 3Å; R180-K182 VanDerWaalsContact O-N 3.16Å; K182-D193 IonicContact NZ-OD1 3.43Å; K182-D193 IonicContact NZ-OD2 2.71Å; K182-D193 PolarHBondContact NZ-OD2 3.5Å; K182-A295 WeakPolarHBondContact CD-O 3.34Å; K182-A295 PolarHBondContact NZ-O 3.32Å
183	R	78.7	Confident	72.9	Confident	123 Å²	123	64.5 Å²	64.5	46%	0.464	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-75.7	125.4	169.7	-56	-161.7	-166.9	-163.8	2.8	108.8	T195 E326 V327 R328 T329 R330	R183-T195 HydrophobicContact CB-CG2 4.27Å; R183-T195 PolarHBondContact O-OG1 3.11Å; R183-E326 VanDerWaalsContact CZ-O 3.25Å; R183-E326 PolarHBondContact NE-O 2.92Å; R183-E326 PolarHBondContact NH2-O 2.99Å; R183-V327 WeakPolarHBondContact CD-O 3.45Å; R183-V327 PolarHBondContact NE-O 2.96Å; R183-R328 PolarHBondContact N-O 3.14Å; R183-R328 PolarHBondContact O-NH1 2.94Å; R183-R328 VanDerWaalsContact O-NH1 3.12Å; R183-T329 PolarHBondContact NE-O 3.36Å; R183-R330 HydrophobicContact CG-CG 4.46Å
184	R	86.3	Confident	74.7	Confident	31 Å²	31	61.2 Å²	61.2	12%	0.117	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-93.9	152.6	173.8	-59.9	-179.2	73.6	81.9	5	109.7	K175 S179 Q186 D191 L192	K175-R184 PolarHBondContact O-NH1 3.16Å; S179-R184 VanDerWaalsContact CB-NH1 3.34Å; S179-R184 WeakPolarHBondContact OG-CD 3.37Å; S179-R184 PolarHBondContact OG-NH1 3.08Å; R184-Q186 HydrophobicContact CB-CG 4.04Å; R184-D191 IonicContact CZ-OD1 2.66Å; R184-D191 IonicContact CZ-OD2 3.48Å; R184-D191 IonicContact NE-OD1 3.13Å; R184-D191 PolarHBondContact NE-OD1 2.85Å; R184-D191 IonicContact NE-OD2 2.78Å; R184-D191 PolarHBondContact NE-OD2 3.26Å; R184-D191 VanDerWaalsContact NH2-CG 3.29Å; R184-D191 PolarHBondContact NH2-O 3.08Å; R184-D191 IonicContact NH2-OD1 2.62Å; R184-D191 PolarHBondContact NH2-OD1 2.7Å; R184-D191 IonicContact NH2-OD2 3.69Å; R184-D191 PolarHBondContact NH2-OD2 2.78Å; R184-L192 CarbonylContact C-O 3.59Å; R184-L192 VanDerWaalsContact CA-O 3.27Å; R184-L192 WeakPolarHBondContact CA-O 3.3Å; R184-L192 WeakPolarHBondContact CB-O 3.25Å
185	Y	83.6	Confident	76.6	Confident	20 Å²	20	58.6 Å²	58.6	8%	0.078	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-87.7	118.8	166.3	-172.5	-97.6	0	0	0	108.7	E187 F190 D191 L192 L194 Y196 F225 K229	Y185-E187 HydrophobicContact CE1-CB 3.84Å; Y185-E187 HydrophobicContact CE2-CB 4.21Å; Y185-E187 HydrophobicContact CE2-CG 4.08Å; Y185-E187 WeakPolarHBondContact CE2-OE2 3.29Å; Y185-E187 WeakPolarHBondContact OH-CB 3.42Å; Y185-E187 PolarHBondContact OH-OE2 3.44Å; Y185-F190 HydrophobicContact CD1-CB 4.09Å; Y185-F190 HydrophobicContact CE1-CB 4.31Å; Y185-D191 WeakPolarHBondContact O-CA 3.4Å; Y185-L192 PolarHBondContact N-O 3.37Å; Y185-L192 PolarHBondContact O-N 2.99Å; Y185-L194 HydrophobicContact CG-CD2 4.42Å; Y185-L194 PolarHBondContact N-O 3.3Å; Y185-Y196 HydrophobicContact CD2-CE2 4.38Å; Y185-Y196 HydrophobicContact CE2-CE2 4.24Å; Y185-F225 HydrophobicContact CD1-CD2 4.24Å; Y185-F225 AromaticContact CD1-CE2 3.64Å; Y185-F225 HydrophobicContact CD1-CE2 3.64Å; Y185-F225 HydrophobicContact CD1-CZ 4.3Å; Y185-F225 HydrophobicContact CE1-CD2 4.04Å; Y185-F225 AromaticContact CE1-CE2 3.36Å; Y185-F225 HydrophobicContact CE1-CE2 3.36Å; Y185-F225 HydrophobicContact CE1-CZ 4.26Å; Y185-F225 HydrophobicContact CE2-CE2 4.45Å; Y185-F225 HydrophobicContact CG-CE2 4.29Å; Y185-F225 AromaticContact CZ-CE2 3.8Å; Y185-K229 PolarHBondContact OH-NZ 2.78Å
186	Q	84	Confident	78.7	Confident	116 Å²	116	60 Å²	60	54%	0.542	30%	0.299	S	S	.	.			trans	-134.9	58	-171.4	-71.6	-174.5	-29.7	0	0	111.2	R184 F190 D191	R184-Q186 HydrophobicContact CB-CG 4.04Å; Q186-F190 WeakPolarHBondContact CA-O 3.26Å; Q186-D191 WeakPolarHBondContact CG-OD1 3.3Å; Q186-D191 PolarHBondContact NE2-OD1 3.43Å
187	E	80.6	Confident	80.8	Confident	111 Å²	111	55.7 Å²	55.7	52%	0.519	28%	0.279	S	S	.	.			trans	-135.6	160.5	-177.6	-55.8	172.5	178.9	0	0	109.9	Y185 G189 F190	Y185-E187 HydrophobicContact CE1-CB 3.84Å; Y185-E187 HydrophobicContact CE2-CB 4.21Å; Y185-E187 HydrophobicContact CE2-CG 4.08Å; Y185-E187 WeakPolarHBondContact CE2-OE2 3.29Å; Y185-E187 WeakPolarHBondContact OH-CB 3.42Å; Y185-E187 PolarHBondContact OH-OE2 3.44Å; E187-G189 PolarHBondContact O-N 2.8Å; E187-F190 PolarHBondContact O-N 2.95Å
188	D	80.4	Confident	83	Confident	117 Å²	117	53.7 Å²	53.7	63%	0.626	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	27.5	174.2	-60.7	-23.2	0	0	0	116.3	F190 K229	D188-F190 HydrophobicContact CB-CD2 4.25Å; D188-F190 HydrophobicContact CB-CE2 4.46Å; D188-K229 IonicContact OD2-NZ 3.43Å; D188-K229 PolarHBondContact OD2-NZ 3.4Å
189	G	82.8	Confident	85	Confident	71 Å²	71	56.1 Å²	56.1	73%	0.732	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	17.8	-178.8	0	0	0	0	0	114.7	E187	E187-G189 PolarHBondContact O-N 2.8Å
190	F	86.7	Confident	87.1	Confident	18 Å²	18	58.4 Å²	58.4	8%	0.079	29%	0.294	C	S	.	.			trans	-101.8	144.9	167.7	-62.3	-85.6	0	0	0	110.7	Y185 Q186 E187 D188 L192 R224 F225	Y185-F190 HydrophobicContact CD1-CB 4.09Å; Y185-F190 HydrophobicContact CE1-CB 4.31Å; Q186-F190 WeakPolarHBondContact CA-O 3.26Å; E187-F190 PolarHBondContact O-N 2.95Å; D188-F190 HydrophobicContact CB-CD2 4.25Å; D188-F190 HydrophobicContact CB-CE2 4.46Å; F190-L192 HydrophobicContact CB-CD1 4.48Å; F190-L192 HydrophobicContact CB-CG 4.49Å; F190-L192 HydrophobicContact CD1-CD1 4.27Å; F190-R224 HydrophobicContact CE1-CB 4.22Å; F190-R224 HydrophobicContact CE1-CG 3.95Å; F190-R224 HydrophobicContact CZ-CG 4.07Å; F190-F225 HydrophobicContact CD1-CB 3.86Å; F190-F225 HydrophobicContact CD1-CD2 4.28Å; F190-F225 HydrophobicContact CD2-CD2 4.12Å; F190-F225 HydrophobicContact CE1-CB 3.61Å; F190-F225 HydrophobicContact CE1-CD2 4.44Å; F190-F225 HydrophobicContact CE2-CD2 4.29Å; F190-F225 HydrophobicContact CG-CD2 4.11Å; F190-F225 HydrophobicContact CZ-CB 4.09Å; F190-F225 HydrophobicContact CZ-CD2 4.44Å
191	D	88.4	Confident	88.7	Confident	50 Å²	50	51.5 Å²	51.5	27%	0.267	27%	0.268	S	S	.	.			trans	-132.7	96.6	164.6	171.2	56.7	0	0	0	108.4	R184 Y185 Q186	R184-D191 IonicContact CZ-OD1 2.66Å; R184-D191 IonicContact CZ-OD2 3.48Å; R184-D191 IonicContact NE-OD1 3.13Å; R184-D191 PolarHBondContact NE-OD1 2.85Å; R184-D191 IonicContact NE-OD2 2.78Å; R184-D191 PolarHBondContact NE-OD2 3.26Å; R184-D191 VanDerWaalsContact NH2-CG 3.29Å; R184-D191 PolarHBondContact NH2-O 3.08Å; R184-D191 IonicContact NH2-OD1 2.62Å; R184-D191 PolarHBondContact NH2-OD1 2.7Å; R184-D191 IonicContact NH2-OD2 3.69Å; R184-D191 PolarHBondContact NH2-OD2 2.78Å; Y185-D191 WeakPolarHBondContact O-CA 3.4Å; Q186-D191 WeakPolarHBondContact CG-OD1 3.3Å; Q186-D191 PolarHBondContact NE2-OD1 3.43Å
192	L	90.6	Very high	90.1	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-126.7	140.6	-172.8	-66.2	175.1	0	0	0	111.4	R184 Y185 F190 L194 N217 D221 V222 F225	R184-L192 CarbonylContact C-O 3.59Å; R184-L192 VanDerWaalsContact CA-O 3.27Å; R184-L192 WeakPolarHBondContact CA-O 3.3Å; R184-L192 WeakPolarHBondContact CB-O 3.25Å; Y185-L192 PolarHBondContact N-O 3.37Å; Y185-L192 PolarHBondContact O-N 2.99Å; F190-L192 HydrophobicContact CB-CD1 4.48Å; F190-L192 HydrophobicContact CB-CG 4.49Å; F190-L192 HydrophobicContact CD1-CD1 4.27Å; L192-L194 HydrophobicContact CB-CB 3.82Å; L192-L194 HydrophobicContact CD1-CD1 4.29Å; L192-L194 PolarHBondContact O-N 2.92Å; L192-N217 HydrophobicContact CD2-CB 4.19Å; L192-D221 HydrophobicContact CD2-CB 4.13Å; L192-V222 HydrophobicContact CD1-CG2 4.44Å; L192-V222 HydrophobicContact CD2-CG2 4.06Å; L192-F225 HydrophobicContact CD1-CB 3.82Å; L192-F225 HydrophobicContact CD1-CD1 4.35Å; L192-F225 HydrophobicContact CD1-CD2 4.38Å; L192-F225 HydrophobicContact CD1-CG 3.94Å
193	D	92.6	Very high	91.1	Very high	13 Å²	13	47.2 Å²	47.2	7%	0.07	25%	0.246	C	C	.	.	S	Bend	trans	-71.4	78.7	162.1	176.3	28.6	0	0	0	109	K182 M204 G205 N217 R328	K182-D193 IonicContact NZ-OD1 3.43Å; K182-D193 IonicContact NZ-OD2 2.71Å; K182-D193 PolarHBondContact NZ-OD2 3.5Å; D193-M204 CarbonylContact O-C 3.57Å; D193-M204 WeakPolarHBondContact O-CA 3.39Å; D193-M204 WeakPolarHBondContact O-CB 3.41Å; D193-G205 PolarHBondContact O-N 2.86Å; D193-G205 WeakPolarHBondContact OD2-CA 3.34Å; D193-N217 WeakPolarHBondContact CB-OD1 3.45Å; D193-N217 PolarHBondContact N-OD1 3.47Å; D193-N217 PolarHBondContact O-ND2 3.3Å; D193-R328 IonicContact OD1-CZ 3.39Å; D193-R328 VanDerWaalsContact OD1-CZ 3.29Å; D193-R328 IonicContact OD1-NH1 2.76Å; D193-R328 PolarHBondContact OD1-NH1 3.49Å; D193-R328 IonicContact OD1-NH2 2.75Å; D193-R328 PolarHBondContact OD1-NH2 2.81Å; D193-R328 IonicContact OD2-NH2 3.34Å
194	L	94.3	Very high	92	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	140.5	-170.8	-173.2	147.5	0	0	0	108.7	Y185 L192 Y196 I202 M204 F225	Y185-L194 HydrophobicContact CG-CD2 4.42Å; Y185-L194 PolarHBondContact N-O 3.3Å; L192-L194 HydrophobicContact CB-CB 3.82Å; L192-L194 HydrophobicContact CD1-CD1 4.29Å; L192-L194 PolarHBondContact O-N 2.92Å; L194-Y196 HydrophobicContact CD2-CE2 4.27Å; L194-I202 HydrophobicContact CD1-CG2 3.93Å; L194-I202 HydrophobicContact CD2-CG2 3.83Å; L194-I202 HydrophobicContact CG-CG2 3.56Å; L194-M204 HydrophobicContact CB-CB 4.17Å; L194-M204 HydrophobicContact CD1-CB 4.24Å; L194-M204 HydrophobicContact CD1-SD 4.28Å; L194-M204 HydrophobicContact CG-CB 4.09Å; L194-F225 HydrophobicContact CD1-CD1 3.71Å; L194-F225 HydrophobicContact CD1-CE1 3.45Å; L194-F225 VanDerWaalsContact CD1-CE1 3.45Å; L194-F225 HydrophobicContact CD1-CZ 4.23Å; L194-F225 HydrophobicContact CD2-CE1 3.72Å; L194-F225 HydrophobicContact CD2-CZ 3.74Å; L194-F225 HydrophobicContact CG-CE1 4.26Å
195	T	96.7	Very high	92.3	Very high	15 Å²	15	40 Å²	40	9%	0.092	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	131.6	177.6	-43.1	0	0	0	0	110.4	R183 I197 I202 A203 V327 R328	R183-T195 HydrophobicContact CB-CG2 4.27Å; R183-T195 PolarHBondContact O-OG1 3.11Å; T195-I197 PolarHBondContact O-N 3.02Å; T195-I202 WeakPolarHBondContact O-CA 3.22Å; T195-A203 PolarHBondContact N-O 2.86Å; T195-A203 PolarHBondContact O-N 3.16Å; T195-V327 HydrophobicContact CG2-CG1 4.19Å; T195-R328 WeakPolarHBondContact OG1-CD 3.3Å; T195-R328 PolarHBondContact OG1-NH1 3.04Å
196	Y	97.9	Very high	92.8	Very high	62 Å²	62	39.4 Å²	39.4	24%	0.243	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	116.2	164.2	-67.1	-90	0	0	0	108.9	Y185 L194 P199 I202 F225 H230 V327	Y185-Y196 HydrophobicContact CD2-CE2 4.38Å; Y185-Y196 HydrophobicContact CE2-CE2 4.24Å; L194-Y196 HydrophobicContact CD2-CE2 4.27Å; Y196-P199 WeakPolarHBondContact CD1-O 3.27Å; Y196-I202 HydrophobicContact CD1-CD1 4.2Å; Y196-I202 HydrophobicContact CD1-CG1 3.58Å; Y196-I202 HydrophobicContact CE1-CD1 3.6Å; Y196-I202 HydrophobicContact CE1-CG1 3.53Å; Y196-I202 HydrophobicContact CG-CG1 4.24Å; Y196-F225 HydrophobicContact CE2-CZ 4.01Å; Y196-F225 AromaticContact CZ-CZ 4Å; Y196-F225 VanDerWaalsContact OH-CZ 3.31Å; Y196-F225 WeakPolarHBondContact OH-CZ 3.39Å; Y196-H230 AromaticContact CE1-NE2 3.63Å; Y196-H230 AromaticContact CZ-NE2 3.67Å; Y196-H230 PolarHBondContact OH-NE2 3.08Å; Y196-V327 WeakPolarHBondContact O-CG1 3.4Å
197	I	98.4	Very high	93.3	Very high	8 Å²	8	33.9 Å²	33.9	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-39.3	170	-53.2	-55.3	0	0	0	109.4	T195 I201 A203 I304 L308 F323 Y324 V327 R328	T195-I197 PolarHBondContact O-N 3.02Å; I197-I201 HydrophobicContact CB-CG2 4.45Å; I197-I201 PolarHBondContact N-O 3.24Å; I197-A203 HydrophobicContact CD1-CB 3.91Å; I197-A203 HydrophobicContact CG1-CB 3.7Å; I197-I304 HydrophobicContact CG1-CD1 4.17Å; I197-I304 HydrophobicContact CG2-CG2 4.05Å; I197-L308 HydrophobicContact CG2-CD1 4.33Å; I197-F323 HydrophobicContact CG2-CD1 4.43Å; I197-F323 HydrophobicContact CG2-CE1 3.72Å; I197-Y324 HydrophobicContact CD1-CD2 3.84Å; I197-Y324 HydrophobicContact CD1-CE2 3.78Å; I197-Y324 HydrophobicContact CG1-CD2 4.11Å; I197-Y324 HydrophobicContact CG1-CE2 4.04Å; I197-Y324 HydrophobicContact CG2-CD2 4.32Å; I197-V327 HydrophobicContact CD1-CB 4.4Å; I197-V327 HydrophobicContact CD1-CG1 4.04Å; I197-R328 HydrophobicContact CD1-CB 4Å
198	Y	98.4	Very high	93.7	Very high	67 Å²	67	28.6 Å²	28.6	26%	0.263	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	166.1	161.7	-82.7	-92.1	0	0	0	108.2	N200 I201 L308 F323	Y198-N200 PolarHBondContact O-N 3.11Å; Y198-I201 HydrophobicContact CD2-CD1 4.12Å; Y198-I201 HydrophobicContact CG-CD1 4.38Å; Y198-I201 PolarHBondContact N-O 3.04Å; Y198-I201 CarbonylContact O-C 3.58Å; Y198-I201 PolarHBondContact O-N 3.06Å; Y198-I201 VanDerWaalsContact O-O 3.1Å; Y198-L308 HydrophobicContact CD2-CD1 4.39Å; Y198-L308 HydrophobicContact CD2-CD2 3.67Å; Y198-L308 HydrophobicContact CE2-CD1 3.95Å; Y198-L308 HydrophobicContact CE2-CD2 3.36Å; Y198-L308 HydrophobicContact CE2-CG 4.31Å; Y198-F323 HydrophobicContact CD2-CE1 4.1Å; Y198-F323 HydrophobicContact CD2-CZ 4.34Å; Y198-F323 HydrophobicContact CE2-CD1 4.46Å; Y198-F323 AromaticContact CE2-CE1 3.44Å; Y198-F323 HydrophobicContact CE2-CE1 3.44Å; Y198-F323 VanDerWaalsContact CE2-CE1 3.44Å; Y198-F323 AromaticContact CE2-CZ 3.71Å; Y198-F323 HydrophobicContact CE2-CZ 3.71Å; Y198-F323 AromaticContact CZ-CZ 3.94Å
199	P	98.3	Very high	93.8	Very high	107 Å²	107	26.2 Å²	26.2	70%	0.695	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-33	179.9	-29	36.8	0	0	0	114.3	Y196	Y196-P199 WeakPolarHBondContact CD1-O 3.27Å
200	N	98.5	Very high	93.2	Very high	53 Å²	53	33.2 Å²	33.2	28%	0.283	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	6.2	177.3	61.2	-17.3	0	0	0	115.1	Y198 L281 H287 V288 A289	Y198-N200 PolarHBondContact O-N 3.11Å; N200-L281 HydrophobicContact CB-CD2 4.15Å; N200-H287 WeakPolarHBondContact CB-O 3.28Å; N200-V288 HydrophobicContact CB-CG2 4.46Å; N200-V288 WeakPolarHBondContact O-CA 3.4Å; N200-A289 PolarHBondContact O-N 3.36Å
201	I	98.8	Very high	91.8	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	105.8	-178.5	-51.6	174.9	0	0	0	109.6	I197 Y198 L281 I291 I304 Y307 L308	I197-I201 HydrophobicContact CB-CG2 4.45Å; I197-I201 PolarHBondContact N-O 3.24Å; Y198-I201 HydrophobicContact CD2-CD1 4.12Å; Y198-I201 HydrophobicContact CG-CD1 4.38Å; Y198-I201 PolarHBondContact N-O 3.04Å; Y198-I201 CarbonylContact O-C 3.58Å; Y198-I201 PolarHBondContact O-N 3.06Å; Y198-I201 VanDerWaalsContact O-O 3.1Å; I201-L281 HydrophobicContact CG1-CD1 4.11Å; I201-I291 HydrophobicContact CG2-CD1 3.79Å; I201-I304 HydrophobicContact CG2-CD1 4.11Å; I201-I304 HydrophobicContact CG2-CG1 4.25Å; I201-I304 HydrophobicContact CG2-CG2 4.31Å; I201-Y307 HydrophobicContact CD1-CD1 3.94Å; I201-Y307 HydrophobicContact CD1-CE1 3.7Å; I201-L308 HydrophobicContact CD1-CD2 3.93Å
202	I	98.8	Very high	90.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.8	177.9	-64.9	169.9	0	0	0	110.1	L194 T195 Y196 M204 F225 L226 V288 A289 A290 I291	L194-I202 HydrophobicContact CD1-CG2 3.93Å; L194-I202 HydrophobicContact CD2-CG2 3.83Å; L194-I202 HydrophobicContact CG-CG2 3.56Å; T195-I202 WeakPolarHBondContact O-CA 3.22Å; Y196-I202 HydrophobicContact CD1-CD1 4.2Å; Y196-I202 HydrophobicContact CD1-CG1 3.58Å; Y196-I202 HydrophobicContact CE1-CD1 3.6Å; Y196-I202 HydrophobicContact CE1-CG1 3.53Å; Y196-I202 HydrophobicContact CG-CG1 4.24Å; I202-M204 HydrophobicContact CG2-CB 4.29Å; I202-F225 HydrophobicContact CD1-CE1 4.26Å; I202-L226 HydrophobicContact CD1-CD2 4.07Å; I202-V288 HydrophobicContact CD1-CG1 3.67Å; I202-V288 HydrophobicContact CG1-CG1 4Å; I202-A289 PolarHBondContact N-O 3.27Å; I202-A290 HydrophobicContact CB-CB 4.29Å; I202-A290 HydrophobicContact CG2-CB 4.43Å; I202-I291 WeakPolarHBondContact O-CD1 3.39Å; I202-I291 PolarHBondContact O-N 3.38Å
203	A	98.3	Very high	89	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124	164	0	0	0	0	0	109.6	T195 I197 I291 T300 I304 Y324	T195-A203 PolarHBondContact N-O 2.86Å; T195-A203 PolarHBondContact O-N 3.16Å; I197-A203 HydrophobicContact CD1-CB 3.91Å; I197-A203 HydrophobicContact CG1-CB 3.7Å; A203-I291 WeakPolarHBondContact CA-O 3.28Å; A203-T300 HydrophobicContact CB-CG2 3.8Å; A203-I304 HydrophobicContact CB-CD1 3.78Å; A203-Y324 HydrophobicContact CB-CE2 4.08Å
204	M	96.9	Very high	87.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	159	-178.3	68.5	-178.6	-177.6	0	0	113.8	D193 L194 I202 V222 I236 A290 I291 H292 G296	D193-M204 CarbonylContact O-C 3.57Å; D193-M204 WeakPolarHBondContact O-CA 3.39Å; D193-M204 WeakPolarHBondContact O-CB 3.41Å; L194-M204 HydrophobicContact CB-CB 4.17Å; L194-M204 HydrophobicContact CD1-CB 4.24Å; L194-M204 HydrophobicContact CD1-SD 4.28Å; L194-M204 HydrophobicContact CG-CB 4.09Å; I202-M204 HydrophobicContact CG2-CB 4.29Å; M204-V222 HydrophobicContact CE-CG1 4.26Å; M204-V222 HydrophobicContact SD-CG1 3.84Å; M204-I236 HydrophobicContact CE-CG2 4.06Å; M204-A290 HydrophobicContact CE-CB 3.91Å; M204-A290 HydrophobicContact SD-CB 4.2Å; M204-I291 PolarHBondContact N-O 3.47Å; M204-I291 VanDerWaalsContact N-O 3.09Å; M204-H292 HydrophobicContact CE-CB 4Å; M204-H292 HydrophobicContact CG-CB 3.6Å; M204-H292 WeakPolarHBondContact O-CA 3.43Å; M204-H292 VanDerWaalsContact O-CB 3.23Å; M204-H292 WeakPolarHBondContact O-CB 3.37Å; M204-G296 WeakPolarHBondContact O-CA 3.22Å
205	G	93.4	Very high	85.9	Confident	2 Å²	2	45.3 Å²	45.3	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	158.9	166.1	0	0	0	0	0	112.2	D193 N217	D193-G205 PolarHBondContact O-N 2.86Å; D193-G205 WeakPolarHBondContact OD2-CA 3.34Å; G205-N217 PolarHBondContact O-ND2 2.67Å; G205-N217 VanDerWaalsContact O-ND2 3.07Å
206	F	94.6	Very high	85.1	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.035	22%	0.22	C	C	.	.			trans	-53.9	126.3	-175.2	-177	-100.1	0	0	0	112.7	A208 R243 Y245 H292 C293	F206-A208 HydrophobicContact CD1-CB 4.05Å; F206-A208 HydrophobicContact CE1-CB 4.36Å; F206-A208 PolarHBondContact O-N 2.84Å; F206-R243 HydrophobicContact CD2-CB 4.36Å; F206-R243 HydrophobicContact CE2-CB 3.64Å; F206-R243 HydrophobicContact CE2-CG 4.45Å; F206-R243 HydrophobicContact CZ-CB 3.78Å; F206-R243 HydrophobicContact CZ-CG 4.23Å; F206-Y245 AromaticContact CE2-CD1 3.7Å; F206-Y245 HydrophobicContact CE2-CD1 3.7Å; F206-Y245 AromaticContact CE2-CE1 3.93Å; F206-Y245 HydrophobicContact CE2-CE1 3.93Å; F206-Y245 AromaticContact CZ-CD1 3.74Å; F206-Y245 HydrophobicContact CZ-CD1 3.74Å; F206-Y245 HydrophobicContact CZ-CE1 4.42Å; F206-H292 AromaticContact CD2-CE1 3Å; F206-H292 WeakPolarHBondContact CD2-CE1 3.25Å; F206-H292 AromaticContact CD2-ND1 3.75Å; F206-H292 AromaticContact CE2-CE1 3.18Å; F206-H292 WeakPolarHBondContact CE2-CE1 3.25Å; F206-C293 PolarHBondContact N-O 2.92Å
207	P	93.8	Very high	84.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	105.5	173.4	30.3	-32	0	0	0	108.8	I219 V222 Y245 F250	P207-I219 HydrophobicContact CB-CB 4.1Å; P207-I219 HydrophobicContact CB-CD1 4.36Å; P207-I219 HydrophobicContact CB-CG1 4.04Å; P207-V222 HydrophobicContact CB-CB 4.42Å; P207-V222 HydrophobicContact CB-CG2 4.26Å; P207-Y245 HydrophobicContact CG-CD1 3.96Å; P207-Y245 HydrophobicContact CG-CE1 3.59Å; P207-F250 HydrophobicContact CB-CE2 4.46Å; P207-F250 HydrophobicContact CB-CZ 4.06Å; P207-F250 HydrophobicContact CG-CE2 4.21Å; P207-F250 HydrophobicContact CG-CZ 4.15Å
208	A	89.1	Confident	84.2	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	140.8	-170.2	0	0	0	0	0	112.4	F206 E212 R216 N217 I219	F206-A208 HydrophobicContact CD1-CB 4.05Å; F206-A208 HydrophobicContact CE1-CB 4.36Å; F206-A208 PolarHBondContact O-N 2.84Å; A208-E212 HydrophobicContact CB-CB 3.72Å; A208-R216 HydrophobicContact CB-CB 3.9Å; A208-N217 WeakPolarHBondContact CB-O 3.47Å; A208-N217 PolarHBondContact N-O 3.47Å; A208-I219 PolarHBondContact O-N 3.09Å
209	E	83	Confident	84	Confident	67 Å²	67	41.8 Å²	41.8	31%	0.313	21%	0.205	S	C	.	.			trans	-85.3	149.4	171.3	-73.2	-175.9	-146.7	0	0	112.1	E212 I219 D246	E209-E212 PolarHBondContact O-N 3.38Å; E209-I219 HydrophobicContact CG-CG2 3.95Å; E209-D246 PolarHBondContact OE1-N 2.81Å
210	R	68.9	Low	83.8	Confident	217 Å²	217	40.7 Å²	40.7	82%	0.819	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	54	-136	168.7	-52.7	177.2	-166.4	-159.3	1	112.4	E212 G213	R210-E212 PolarHBondContact O-N 3.44Å; R210-E212 VanDerWaalsContact O-N 3.13Å; R210-G213 PolarHBondContact O-N 3.31Å
211	L	58.8	Low	83.5	Confident	149 Å²	149	40 Å²	40	78%	0.78	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-61.6	-20.9	-171	-69.9	170.4	0	0	0	114.5	G213 V214	L211-G213 VanDerWaalsContact C-N 3.31Å; L211-V214 WeakPolarHBondContact O-CB 3.42Å; L211-V214 WeakPolarHBondContact O-CG2 3.45Å; L211-V214 PolarHBondContact O-N 3.35Å
212	E	61.9	Low	83.4	Confident	50 Å²	50	39.8 Å²	39.8	23%	0.234	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-72.4	-24.6	172.8	-73.1	-150.2	146.2	0	0	113.2	A208 E209 R210 V214 Y215 R216 R243	A208-E212 HydrophobicContact CB-CB 3.72Å; E209-E212 PolarHBondContact O-N 3.38Å; R210-E212 PolarHBondContact O-N 3.44Å; R210-E212 VanDerWaalsContact O-N 3.13Å; E212-V214 PolarHBondContact O-N 3.42Å; E212-V214 VanDerWaalsContact O-N 3.16Å; E212-Y215 HydrophobicContact CB-CE1 4.03Å; E212-Y215 HydrophobicContact CG-CE1 3.89Å; E212-Y215 WeakPolarHBondContact O-CD1 3.15Å; E212-Y215 PolarHBondContact O-N 2.83Å; E212-Y215 PolarHBondContact OE1-OH 3.04Å; E212-R216 PolarHBondContact O-N 3.25Å; E212-R216 IonicContact OE1-NH1 3.85Å; E212-R216 PolarHBondContact OE1-NH1 3.34Å; E212-R216 VanDerWaalsContact OE1-NH1 3.08Å; E212-R216 IonicContact OE2-NH1 3.42Å; E212-R216 PolarHBondContact OE2-NH1 3.46Å; E212-R243 IonicContact OE1-CZ 3.84Å; E212-R243 IonicContact OE1-NH1 3.75Å; E212-R243 IonicContact OE1-NH2 3.64Å; E212-R243 PolarHBondContact OE1-NH2 3.4Å; E212-R243 IonicContact OE2-CZ 2.68Å; E212-R243 IonicContact OE2-NH1 2.64Å; E212-R243 PolarHBondContact OE2-NH1 2.88Å; E212-R243 IonicContact OE2-NH2 3.5Å; E212-R243 PolarHBondContact OE2-NH2 3.02Å
213	G	58.6	Low	83.3	Confident	7 Å²	7	40.9 Å²	40.9	7%	0.072	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-66.6	-8	173	0	0	0	0	0	114.2	K175 R210 L211 Y215	K175-G213 VanDerWaalsContact CE-O 3.22Å; K175-G213 WeakPolarHBondContact CE-O 3.13Å; K175-G213 PolarHBondContact NZ-O 2.89Å; R210-G213 PolarHBondContact O-N 3.31Å; L211-G213 VanDerWaalsContact C-N 3.31Å; G213-Y215 VanDerWaalsContact C-N 3.31Å
214	V	57.6	Low	83.2	Confident	61 Å²	61	46.5 Å²	46.5	37%	0.37	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-68.6	-32	169.3	-179.6	0	0	0	0	111	T171 K175 L211 E212	T171-V214 HydrophobicContact CG2-CG1 4.21Å; K175-V214 WeakPolarHBondContact CE-O 2.99Å; K175-V214 WeakPolarHBondContact CG-O 3.4Å; L211-V214 WeakPolarHBondContact O-CB 3.42Å; L211-V214 WeakPolarHBondContact O-CG2 3.45Å; L211-V214 PolarHBondContact O-N 3.35Å; E212-V214 PolarHBondContact O-N 3.42Å; E212-V214 VanDerWaalsContact O-N 3.16Å
215	Y	63	Low	83.2	Confident	74 Å²	74	46.5 Å²	46.5	29%	0.29	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-12	-174.2	76	-97	0	0	0	114.8	V178 E212 G213	V178-Y215 WeakPolarHBondContact CB-O 3.21Å; V178-Y215 HydrophobicContact CG1-CD2 4.23Å; V178-Y215 WeakPolarHBondContact CG1-O 3.38Å; V178-Y215 HydrophobicContact CG2-CD2 4.02Å; E212-Y215 HydrophobicContact CB-CE1 4.03Å; E212-Y215 HydrophobicContact CG-CE1 3.89Å; E212-Y215 WeakPolarHBondContact O-CD1 3.15Å; E212-Y215 PolarHBondContact O-N 2.83Å; E212-Y215 PolarHBondContact OE1-OH 3.04Å; G213-Y215 VanDerWaalsContact C-N 3.31Å
216	R	80	Confident	83.4	Confident	34 Å²	34	46.4 Å²	46.4	13%	0.128	22%	0.215	C	C	.	.	S	Bend	trans	-108.9	-170.5	166.4	-67.6	-161.1	177.2	78.7	19.1	111.2	K175 A208 E212 N218 K294	K175-R216 WeakPolarHBondContact CE-O 3.4Å; A208-R216 HydrophobicContact CB-CB 3.9Å; E212-R216 PolarHBondContact O-N 3.25Å; E212-R216 IonicContact OE1-NH1 3.85Å; E212-R216 PolarHBondContact OE1-NH1 3.34Å; E212-R216 VanDerWaalsContact OE1-NH1 3.08Å; E212-R216 IonicContact OE2-NH1 3.42Å; E212-R216 PolarHBondContact OE2-NH1 3.46Å; R216-N218 PolarHBondContact O-N 2.88Å; R216-K294 PolarHBondContact NE-O 2.99Å
217	N	86.5	Confident	83.5	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	127.1	162.9	-66.6	-19.5	0	0	0	108.8	L192 D193 G205 A208 V222	L192-N217 HydrophobicContact CD2-CB 4.19Å; D193-N217 WeakPolarHBondContact CB-OD1 3.45Å; D193-N217 PolarHBondContact N-OD1 3.47Å; D193-N217 PolarHBondContact O-ND2 3.3Å; G205-N217 PolarHBondContact O-ND2 2.67Å; G205-N217 VanDerWaalsContact O-ND2 3.07Å; A208-N217 WeakPolarHBondContact CB-O 3.47Å; A208-N217 PolarHBondContact N-O 3.47Å; N217-V222 HydrophobicContact CB-CG2 3.73Å
218	N	91.1	Very high	83.6	Confident	40 Å²	40	52.3 Å²	52.3	21%	0.214	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	128.3	165.3	172.9	20.3	0	0	0	108.4	R216 D220 D221 V222	R216-N218 PolarHBondContact O-N 2.88Å; N218-D220 PolarHBondContact O-N 2.97Å; N218-D220 PolarHBondContact OD1-N 3.3Å; N218-D221 HydrophobicContact CB-CB 4.3Å; N218-D221 WeakPolarHBondContact CB-OD2 3.31Å; N218-D221 PolarHBondContact ND2-OD2 2.9Å; N218-D221 PolarHBondContact O-N 3.04Å; N218-D221 VanDerWaalsContact O-N 3.13Å; N218-V222 PolarHBondContact O-N 3.27Å
219	I	94.3	Very high	84	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-54.4	-39.2	-179.6	-174.2	156.6	0	0	0	112.4	P207 A208 E209 D221 V222 V223 Y245 K249 F250	P207-I219 HydrophobicContact CB-CB 4.1Å; P207-I219 HydrophobicContact CB-CD1 4.36Å; P207-I219 HydrophobicContact CB-CG1 4.04Å; A208-I219 PolarHBondContact O-N 3.09Å; E209-I219 HydrophobicContact CG-CG2 3.95Å; I219-D221 VanDerWaalsContact C-N 3.31Å; I219-D221 PolarHBondContact O-N 3.02Å; I219-V222 PolarHBondContact O-N 2.89Å; I219-V222 VanDerWaalsContact O-N 3.13Å; I219-V223 HydrophobicContact CG1-CG2 4.47Å; I219-V223 WeakPolarHBondContact O-CG2 3.46Å; I219-V223 PolarHBondContact O-N 3.34Å; I219-Y245 HydrophobicContact CD1-CD2 3.95Å; I219-Y245 HydrophobicContact CD1-CG 3.92Å; I219-K249 HydrophobicContact CD1-CB 4.5Å; I219-K249 HydrophobicContact CD1-CD 3.82Å; I219-K249 HydrophobicContact CG1-CD 3.95Å; I219-K249 HydrophobicContact CG2-CD 4.19Å; I219-F250 HydrophobicContact CD1-CE2 3.7Å; I219-F250 HydrophobicContact CD1-CZ 4.21Å; I219-F250 HydrophobicContact CG1-CE2 3.88Å; I219-F250 HydrophobicContact CG1-CZ 3.86Å
220	D	93.2	Very high	84.7	Confident	84 Å²	84	54.3 Å²	54.3	45%	0.449	26%	0.261	S	S	.	.	H	α-helix	trans	-71.3	-27.7	-176.4	-57.7	-39.4	0	0	0	112.1	N218 R224 K249	N218-D220 PolarHBondContact O-N 2.97Å; N218-D220 PolarHBondContact OD1-N 3.3Å; D220-R224 WeakPolarHBondContact O-CB 3.28Å; D220-R224 PolarHBondContact O-N 3.11Å; D220-K249 IonicContact OD1-NZ 2.64Å; D220-K249 PolarHBondContact OD1-NZ 2.63Å; D220-K249 IonicContact OD2-NZ 2.99Å
221	D	93.4	Very high	86	Confident	40 Å²	40	50.6 Å²	50.6	21%	0.214	25%	0.251	C	S	.	.	H	α-helix	trans	-75	-32	171.3	-72.6	-59.2	0	0	0	112.5	L192 N218 I219 R224 F225	L192-D221 HydrophobicContact CD2-CB 4.13Å; N218-D221 HydrophobicContact CB-CB 4.3Å; N218-D221 WeakPolarHBondContact CB-OD2 3.31Å; N218-D221 PolarHBondContact ND2-OD2 2.9Å; N218-D221 PolarHBondContact O-N 3.04Å; N218-D221 VanDerWaalsContact O-N 3.13Å; I219-D221 VanDerWaalsContact C-N 3.31Å; I219-D221 PolarHBondContact O-N 3.02Å; D221-R224 IonicContact OD1-CZ 2.71Å; D221-R224 IonicContact OD1-NE 3.63Å; D221-R224 PolarHBondContact OD1-NE 3.07Å; D221-R224 IonicContact OD1-NH2 2.7Å; D221-R224 PolarHBondContact OD1-NH2 3.41Å; D221-F225 VanDerWaalsContact O-CB 3.28Å; D221-F225 WeakPolarHBondContact O-CB 3.34Å; D221-F225 PolarHBondContact O-N 3.09Å
222	V	96.1	Very high	87.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-70.9	-41.5	174	-179.4	0	0	0	0	110.8	L192 M204 P207 N217 N218 I219 F225 L226 F250	L192-V222 HydrophobicContact CD1-CG2 4.44Å; L192-V222 HydrophobicContact CD2-CG2 4.06Å; M204-V222 HydrophobicContact CE-CG1 4.26Å; M204-V222 HydrophobicContact SD-CG1 3.84Å; P207-V222 HydrophobicContact CB-CB 4.42Å; P207-V222 HydrophobicContact CB-CG2 4.26Å; N217-V222 HydrophobicContact CB-CG2 3.73Å; N218-V222 PolarHBondContact O-N 3.27Å; I219-V222 PolarHBondContact O-N 2.89Å; I219-V222 VanDerWaalsContact O-N 3.13Å; V222-F225 PolarHBondContact O-N 2.96Å; V222-L226 HydrophobicContact CG1-CD1 4.03Å; V222-L226 HydrophobicContact CG1-CG 4.41Å; V222-L226 WeakPolarHBondContact O-CB 3.37Å; V222-L226 WeakPolarHBondContact O-CG 3.42Å; V222-L226 PolarHBondContact O-N 3.23Å; V222-F250 HydrophobicContact CG1-CE1 4.03Å; V222-F250 HydrophobicContact CG1-CZ 4.19Å
223	V	96.3	Very high	89.5	Confident	23 Å²	23	48.8 Å²	48.8	14%	0.139	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-51.9	172.1	174.9	0	0	0	0	109.9	I219 F225 L226 D227 K249 F250	I219-V223 HydrophobicContact CG1-CG2 4.47Å; I219-V223 WeakPolarHBondContact O-CG2 3.46Å; I219-V223 PolarHBondContact O-N 3.34Å; V223-F225 PolarHBondContact O-N 2.94Å; V223-L226 PolarHBondContact O-N 2.99Å; V223-L226 VanDerWaalsContact O-N 3.15Å; V223-D227 WeakPolarHBondContact CG1-OD2 3.35Å; V223-D227 WeakPolarHBondContact O-CB 3.39Å; V223-D227 PolarHBondContact O-N 3.48Å; V223-K249 HydrophobicContact CG2-CB 4.2Å; V223-K249 VanDerWaalsContact CG2-O 3.25Å; V223-K249 WeakPolarHBondContact CG2-O 3.4Å; V223-F250 HydrophobicContact CG2-CD1 3.86Å; V223-F250 HydrophobicContact CG2-CE1 3.53Å; V223-F250 HydrophobicContact CG2-CZ 3.96Å
224	R	96.1	Very high	91.4	Very high	118 Å²	118	48.5 Å²	48.5	45%	0.445	24%	0.238	S	C	.	.	H	α-helix	trans	-55.5	-37.3	176.5	-177.6	172.7	66.7	97.2	-6.5	112.9	F190 D220 D221 S228	F190-R224 HydrophobicContact CE1-CB 4.22Å; F190-R224 HydrophobicContact CE1-CG 3.95Å; F190-R224 HydrophobicContact CZ-CG 4.07Å; D220-R224 WeakPolarHBondContact O-CB 3.28Å; D220-R224 PolarHBondContact O-N 3.11Å; D221-R224 IonicContact OD1-CZ 2.71Å; D221-R224 IonicContact OD1-NE 3.63Å; D221-R224 PolarHBondContact OD1-NE 3.07Å; D221-R224 IonicContact OD1-NH2 2.7Å; D221-R224 PolarHBondContact OD1-NH2 3.41Å; R224-S228 VanDerWaalsContact O-CB 3.26Å; R224-S228 WeakPolarHBondContact O-CB 3.4Å; R224-S228 PolarHBondContact O-N 3.2Å; R224-S228 PolarHBondContact O-OG 3.43Å
225	F	97.4	Very high	93.4	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-52	175	173.1	-102.5	0	0	0	112	Y185 F190 L192 L194 Y196 I202 D221 V222 V223 S228 K229	Y185-F225 HydrophobicContact CD1-CD2 4.24Å; Y185-F225 AromaticContact CD1-CE2 3.64Å; Y185-F225 HydrophobicContact CD1-CE2 3.64Å; Y185-F225 HydrophobicContact CD1-CZ 4.3Å; Y185-F225 HydrophobicContact CE1-CD2 4.04Å; Y185-F225 AromaticContact CE1-CE2 3.36Å; Y185-F225 HydrophobicContact CE1-CE2 3.36Å; Y185-F225 HydrophobicContact CE1-CZ 4.26Å; Y185-F225 HydrophobicContact CE2-CE2 4.45Å; Y185-F225 HydrophobicContact CG-CE2 4.29Å; Y185-F225 AromaticContact CZ-CE2 3.8Å; F190-F225 HydrophobicContact CD1-CB 3.86Å; F190-F225 HydrophobicContact CD1-CD2 4.28Å; F190-F225 HydrophobicContact CD2-CD2 4.12Å; F190-F225 HydrophobicContact CE1-CB 3.61Å; F190-F225 HydrophobicContact CE1-CD2 4.44Å; F190-F225 HydrophobicContact CE2-CD2 4.29Å; F190-F225 HydrophobicContact CG-CD2 4.11Å; F190-F225 HydrophobicContact CZ-CB 4.09Å; F190-F225 HydrophobicContact CZ-CD2 4.44Å; L192-F225 HydrophobicContact CD1-CB 3.82Å; L192-F225 HydrophobicContact CD1-CD1 4.35Å; L192-F225 HydrophobicContact CD1-CD2 4.38Å; L192-F225 HydrophobicContact CD1-CG 3.94Å; L194-F225 HydrophobicContact CD1-CD1 3.71Å; L194-F225 HydrophobicContact CD1-CE1 3.45Å; L194-F225 VanDerWaalsContact CD1-CE1 3.45Å; L194-F225 HydrophobicContact CD1-CZ 4.23Å; L194-F225 HydrophobicContact CD2-CE1 3.72Å; L194-F225 HydrophobicContact CD2-CZ 3.74Å; L194-F225 HydrophobicContact CG-CE1 4.26Å; Y196-F225 HydrophobicContact CE2-CZ 4.01Å; Y196-F225 AromaticContact CZ-CZ 4Å; Y196-F225 VanDerWaalsContact OH-CZ 3.31Å; Y196-F225 WeakPolarHBondContact OH-CZ 3.39Å; I202-F225 HydrophobicContact CD1-CE1 4.26Å; D221-F225 VanDerWaalsContact O-CB 3.28Å; D221-F225 WeakPolarHBondContact O-CB 3.34Å; D221-F225 PolarHBondContact O-N 3.09Å; V222-F225 PolarHBondContact O-N 2.96Å; V223-F225 PolarHBondContact O-N 2.94Å; F225-S228 PolarHBondContact O-N 2.73Å; F225-S228 PolarHBondContact O-OG 3.09Å; F225-S228 VanDerWaalsContact O-OG 3.09Å; F225-K229 HydrophobicContact CD2-CG 4.06Å; F225-K229 HydrophobicContact CE2-CG 3.84Å; F225-K229 HydrophobicContact CZ-CG 4.32Å; F225-K229 WeakPolarHBondContact O-CB 3.43Å; F225-K229 WeakPolarHBondContact O-CG 3.36Å; F225-K229 PolarHBondContact O-N 2.95Å
226	L	97.8	Very high	95.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-38.1	-176.7	-67.4	177.1	0	0	0	112.5	I202 V222 V223 S228 H230 K231 Y234 I236 F250 A290	I202-L226 HydrophobicContact CD1-CD2 4.07Å; V222-L226 HydrophobicContact CG1-CD1 4.03Å; V222-L226 HydrophobicContact CG1-CG 4.41Å; V222-L226 WeakPolarHBondContact O-CB 3.37Å; V222-L226 WeakPolarHBondContact O-CG 3.42Å; V222-L226 PolarHBondContact O-N 3.23Å; V223-L226 PolarHBondContact O-N 2.99Å; V223-L226 VanDerWaalsContact O-N 3.15Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 2.86Å; L226-H230 CarbonylContact O-C 3.59Å; L226-H230 VanDerWaalsContact O-CA 3.31Å; L226-H230 WeakPolarHBondContact O-CA 3.47Å; L226-H230 PolarHBondContact O-N 3.27Å; L226-K231 PolarHBondContact O-N 3.17Å; L226-Y234 HydrophobicContact CB-CD1 3.63Å; L226-Y234 HydrophobicContact CB-CD2 4.37Å; L226-Y234 HydrophobicContact CB-CE1 3.65Å; L226-Y234 HydrophobicContact CB-CE2 4.41Å; L226-Y234 HydrophobicContact CB-CG 4Å; L226-Y234 HydrophobicContact CD1-CD2 4.02Å; L226-Y234 HydrophobicContact CD1-CE2 4.29Å; L226-Y234 HydrophobicContact CD1-CG 4.23Å; L226-I236 HydrophobicContact CD1-CD1 3.47Å; L226-I236 VanDerWaalsContact CD1-CD1 3.47Å; L226-F250 HydrophobicContact CD1-CD1 4.35Å; L226-F250 HydrophobicContact CD1-CE1 4.13Å; L226-A290 HydrophobicContact CD1-CB 4.44Å
227	D	96.5	Very high	96	Very high	56 Å²	56	41.9 Å²	41.9	30%	0.299	21%	0.207	S	C	.	.	H	α-helix	trans	-73	-20.3	176.2	-74.1	-17.9	0	0	0	113.5	V223 K231 Y234	V223-D227 WeakPolarHBondContact CG1-OD2 3.35Å; V223-D227 WeakPolarHBondContact O-CB 3.39Å; V223-D227 PolarHBondContact O-N 3.48Å; D227-K231 VanDerWaalsContact O-CB 3.29Å; D227-K231 WeakPolarHBondContact O-CB 3.49Å; D227-Y234 WeakPolarHBondContact OD1-CE1 3.26Å; D227-Y234 VanDerWaalsContact OD1-CZ 3.32Å; D227-Y234 PolarHBondContact OD1-OH 3.22Å
228	S	96.6	Very high	96.6	Very high	76 Å²	76	41.8 Å²	41.8	53%	0.531	21%	0.207	S	C	.	.	H	α-helix	trans	-93.3	-27.8	176.4	59.9	0	0	0	0	113.9	R224 F225 L226	R224-S228 VanDerWaalsContact O-CB 3.26Å; R224-S228 WeakPolarHBondContact O-CB 3.4Å; R224-S228 PolarHBondContact O-N 3.2Å; R224-S228 PolarHBondContact O-OG 3.43Å; F225-S228 PolarHBondContact O-N 2.73Å; F225-S228 PolarHBondContact O-OG 3.09Å; F225-S228 VanDerWaalsContact O-OG 3.09Å; L226-S228 VanDerWaalsContact C-N 3.32Å; L226-S228 PolarHBondContact O-N 2.86Å
229	K	96.8	Very high	96.9	Very high	77 Å²	77	39.9 Å²	39.9	34%	0.335	20%	0.196	S	C	.	.	H	α-helix	trans	-95.6	-41.9	178.2	-63.9	-73.6	179.5	164.6	0	113.1	Y185 D188 F225	Y185-K229 PolarHBondContact OH-NZ 2.78Å; D188-K229 IonicContact OD2-NZ 3.43Å; D188-K229 PolarHBondContact OD2-NZ 3.4Å; F225-K229 HydrophobicContact CD2-CG 4.06Å; F225-K229 HydrophobicContact CE2-CG 3.84Å; F225-K229 HydrophobicContact CZ-CG 4.32Å; F225-K229 WeakPolarHBondContact O-CB 3.43Å; F225-K229 WeakPolarHBondContact O-CG 3.36Å; F225-K229 PolarHBondContact O-N 2.95Å
230	H	97.5	Very high	97	Very high	32 Å²	32	39.9 Å²	39.9	15%	0.148	20%	0.196	C	C	.	.	S	Bend	trans	-130.4	38.5	-167.9	-55.5	-51.1	0	0	0	111.7	Y196 L226 N232 H233 Y234 V288	Y196-H230 AromaticContact CE1-NE2 3.63Å; Y196-H230 AromaticContact CZ-NE2 3.67Å; Y196-H230 PolarHBondContact OH-NE2 3.08Å; L226-H230 CarbonylContact O-C 3.59Å; L226-H230 VanDerWaalsContact O-CA 3.31Å; L226-H230 WeakPolarHBondContact O-CA 3.47Å; L226-H230 PolarHBondContact O-N 3.27Å; H230-N232 PolarHBondContact O-N 3.28Å; H230-H233 WeakPolarHBondContact O-CA 3.12Å; H230-H233 PolarHBondContact O-N 1.95Å; H230-Y234 HydrophobicContact CB-CD1 4.33Å; H230-Y234 WeakPolarHBondContact O-CD1 3.49Å; H230-V288 HydrophobicContact CB-CG2 4.42Å
231	K	97.1	Very high	97	Very high	138 Å²	138	37.5 Å²	37.5	60%	0.6	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.1	124.4	-174.1	-169	176.5	178.7	178.3	0	111.3	L226 D227 H233	L226-K231 PolarHBondContact O-N 3.17Å; D227-K231 VanDerWaalsContact O-CB 3.29Å; D227-K231 WeakPolarHBondContact O-CB 3.49Å; K231-H233 PolarHBondContact O-CD2 3Å; K231-H233 PolarHBondContact O-N 2.93Å; K231-H233 VanDerWaalsContact O-N 3.08Å
232	N	96.3	Very high	97	Very high	101 Å²	101	39 Å²	39	54%	0.54	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	6.7	-177.1	-59.5	-0.1	0	0	0	116	H230 R253	H230-N232 PolarHBondContact O-N 3.28Å; N232-R253 PolarHBondContact O-NH1 3.32Å
233	H	98	Very high	96.7	Very high	61 Å²	61	41.6 Å²	41.6	28%	0.282	20%	0.204	S	C	.	.			trans	-122.2	24.5	-179	-61.5	-78.4	0	0	0	114.1	H230 K231 D284 N286 H287 V288	H230-H233 WeakPolarHBondContact O-CA 3.12Å; H230-H233 PolarHBondContact O-N 1.95Å; K231-H233 PolarHBondContact O-CD2 3Å; K231-H233 PolarHBondContact O-N 2.93Å; K231-H233 VanDerWaalsContact O-N 3.08Å; H233-D284 IonicContact CE1-OD2 3.79Å; H233-D284 PolarHBondContact CE1-OD2 2.92Å; H233-D284 IonicContact ND1-OD2 3.79Å; H233-D284 PolarHBondContact ND1-OD2 3.46Å; H233-D284 VanDerWaalsContact ND1-OD2 3.09Å; H233-N286 HydrophobicContact CB-CB 4.35Å; H233-N286 WeakPolarHBondContact CB-O 3.44Å; H233-H287 AromaticContact ND1-CD2 3.65Å; H233-H287 AromaticContact ND1-NE2 3.97Å; H233-H287 CarbonylContact O-C 3.55Å; H233-H287 WeakPolarHBondContact O-CA 3.35Å; H233-V288 PolarHBondContact O-N 2.92Å
234	Y	98.6	Very high	96.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	149.3	174.6	65.5	-97.8	0	0	0	114.5	L226 D227 H230 I236 F250 N251 R253 W280 V288	L226-Y234 HydrophobicContact CB-CD1 3.63Å; L226-Y234 HydrophobicContact CB-CD2 4.37Å; L226-Y234 HydrophobicContact CB-CE1 3.65Å; L226-Y234 HydrophobicContact CB-CE2 4.41Å; L226-Y234 HydrophobicContact CB-CG 4Å; L226-Y234 HydrophobicContact CD1-CD2 4.02Å; L226-Y234 HydrophobicContact CD1-CE2 4.29Å; L226-Y234 HydrophobicContact CD1-CG 4.23Å; D227-Y234 WeakPolarHBondContact OD1-CE1 3.26Å; D227-Y234 VanDerWaalsContact OD1-CZ 3.32Å; D227-Y234 PolarHBondContact OD1-OH 3.22Å; H230-Y234 HydrophobicContact CB-CD1 4.33Å; H230-Y234 WeakPolarHBondContact O-CD1 3.49Å; Y234-I236 HydrophobicContact CD2-CD1 3.8Å; Y234-I236 HydrophobicContact CD2-CG1 4.43Å; Y234-I236 HydrophobicContact CE2-CD1 4.22Å; Y234-F250 HydrophobicContact CE2-CB 4.24Å; Y234-F250 HydrophobicContact CE2-CD1 4.09Å; Y234-N251 PolarHBondContact OH-ND2 3.08Å; Y234-N251 VanDerWaalsContact OH-ND2 3.16Å; Y234-R253 PolarHBondContact O-NE 3.26Å; Y234-R253 PolarHBondContact O-NH1 3.06Å; Y234-R253 PolarHBondContact O-NH2 3.28Å; Y234-R253 VanDerWaalsContact O-NH2 3.16Å; Y234-W280 VanDerWaalsContact C-CZ2 3.44Å; Y234-V288 CarbonylContact C-O 3.59Å; Y234-V288 VanDerWaalsContact CA-O 3.28Å; Y234-V288 WeakPolarHBondContact CA-O 3.39Å
235	K	98.8	Very high	96.3	Very high	30 Å²	30	41.2 Å²	41.2	13%	0.13	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	136.7	167.6	-178.9	176	166.8	-164.6	0	110	Y237 D276 W280 V288 A289 A290	K235-Y237 HydrophobicContact CB-CE2 4.12Å; K235-Y237 HydrophobicContact CD-CE2 4.04Å; K235-Y237 WeakPolarHBondContact CD-OH 3.44Å; K235-Y237 VanDerWaalsContact CE-OH 3.22Å; K235-Y237 WeakPolarHBondContact CE-OH 3.23Å; K235-Y237 HydrophobicContact CG-CE2 3.81Å; K235-Y237 PolarHBondContact NZ-OH 2.93Å; K235-D276 WeakPolarHBondContact CE-OD2 3.47Å; K235-D276 PolarHBondContact NZ-O 3.24Å; K235-D276 IonicContact NZ-OD1 2.98Å; K235-D276 PolarHBondContact NZ-OD1 3.44Å; K235-D276 IonicContact NZ-OD2 3.38Å; K235-D276 PolarHBondContact NZ-OD2 3.15Å; K235-W280 HydrophobicContact CB-CD2 3.69Å; K235-W280 HydrophobicContact CB-CE3 4.37Å; K235-W280 HydrophobicContact CB-CG 3.95Å; K235-W280 HydrophobicContact CB-CZ2 3.88Å; K235-W280 HydrophobicContact CD-CB 3.99Å; K235-W280 HydrophobicContact CD-CD2 3.73Å; K235-W280 HydrophobicContact CD-CE3 4.04Å; K235-W280 HydrophobicContact CD-CG 3.68Å; K235-W280 HydrophobicContact CG-CD2 4.39Å; K235-W280 HydrophobicContact CG-CG 4.48Å; K235-V288 PolarHBondContact N-O 3.37Å; K235-A289 WeakPolarHBondContact O-CA 3.14Å; K235-A290 PolarHBondContact O-N 3.34Å
236	I	98.7	Very high	96.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	140.4	-178.9	-42.8	-58.7	0	0	0	109.7	M204 L226 Y234 Y245 F250 R253 V254 A255 A290	M204-I236 HydrophobicContact CE-CG2 4.06Å; L226-I236 HydrophobicContact CD1-CD1 3.47Å; L226-I236 VanDerWaalsContact CD1-CD1 3.47Å; Y234-I236 HydrophobicContact CD2-CD1 3.8Å; Y234-I236 HydrophobicContact CD2-CG1 4.43Å; Y234-I236 HydrophobicContact CE2-CD1 4.22Å; I236-Y245 WeakPolarHBondContact CG2-OH 3.43Å; I236-F250 HydrophobicContact CD1-CD1 3.81Å; I236-F250 HydrophobicContact CD1-CE1 4.14Å; I236-F250 HydrophobicContact CD1-CG 4.23Å; I236-F250 HydrophobicContact CG1-CB 3.87Å; I236-F250 HydrophobicContact CG1-CD1 3.84Å; I236-F250 HydrophobicContact CG1-CD2 4.24Å; I236-F250 HydrophobicContact CG1-CE1 4.43Å; I236-F250 HydrophobicContact CG1-CG 3.72Å; I236-R253 PolarHBondContact N-O 3.45Å; I236-V254 HydrophobicContact CB-CB 4.44Å; I236-V254 HydrophobicContact CB-CG1 4.26Å; I236-V254 HydrophobicContact CB-CG2 4.11Å; I236-V254 HydrophobicContact CG1-CG2 4.19Å; I236-V254 HydrophobicContact CG2-CG1 4.47Å; I236-V254 CarbonylContact O-C 3.59Å; I236-V254 WeakPolarHBondContact O-CA 3.43Å; I236-A255 PolarHBondContact O-N 2.96Å; I236-A290 WeakPolarHBondContact CA-O 3.39Å; I236-A290 HydrophobicContact CD1-CB 3.9Å
237	Y	98.8	Very high	96	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	107.8	174.3	-64.7	-103.7	0	0	0	109.3	K235 A255 Y257 F273 D276 L277 A289 A290 I291 H292	K235-Y237 HydrophobicContact CB-CE2 4.12Å; K235-Y237 HydrophobicContact CD-CE2 4.04Å; K235-Y237 WeakPolarHBondContact CD-OH 3.44Å; K235-Y237 VanDerWaalsContact CE-OH 3.22Å; K235-Y237 WeakPolarHBondContact CE-OH 3.23Å; K235-Y237 HydrophobicContact CG-CE2 3.81Å; K235-Y237 PolarHBondContact NZ-OH 2.93Å; Y237-A255 HydrophobicContact CD1-CB 3.97Å; Y237-A255 HydrophobicContact CE1-CB 4.11Å; Y237-Y257 HydrophobicContact CD1-CD2 4.21Å; Y237-Y257 HydrophobicContact CD1-CE2 4.1Å; Y237-Y257 HydrophobicContact CE1-CE2 4.34Å; Y237-F273 HydrophobicContact CD1-CD2 4.09Å; Y237-F273 AromaticContact CD1-CE2 3.66Å; Y237-F273 HydrophobicContact CD1-CE2 3.66Å; Y237-F273 HydrophobicContact CE1-CE2 4.42Å; Y237-F273 HydrophobicContact CG-CE2 4.1Å; Y237-D276 WeakPolarHBondContact CE1-OD2 3.18Å; Y237-D276 PolarHBondContact OH-O 3.32Å; Y237-D276 VanDerWaalsContact OH-O 3.06Å; Y237-L277 HydrophobicContact CE1-CB 4.37Å; Y237-L277 HydrophobicContact CE1-CD1 4.49Å; Y237-L277 HydrophobicContact CE2-CD1 3.85Å; Y237-L277 WeakPolarHBondContact OH-CA 3.4Å; Y237-A289 HydrophobicContact CD2-CB 4.11Å; Y237-A289 HydrophobicContact CE2-CB 3.73Å; Y237-A290 PolarHBondContact N-O 2.94Å; Y237-I291 HydrophobicContact CD2-CG1 4.29Å; Y237-I291 HydrophobicContact CG-CG1 4.37Å; Y237-H292 PolarHBondContact O-CD2 3.29Å; Y237-H292 PolarHBondContact O-N 2.67Å
238	N	98.4	Very high	95.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.011	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119.1	177.8	-176	16.7	0	0	0	110.7	C240 R243 V254 A255 Q256 Y257 H292	N238-C240 VanDerWaalsContact OD1-CB 3.25Å; N238-C240 WeakPolarHBondContact OD1-CB 3.43Å; N238-C240 PolarHBondContact OD1-N 2.58Å; N238-R243 PolarHBondContact ND2-O 3.14Å; N238-V254 HydrophobicContact CB-CG1 4.45Å; N238-A255 PolarHBondContact N-O 3.48Å; N238-Q256 HydrophobicContact CB-CG 4.5Å; N238-Y257 PolarHBondContact O-N 3.31Å; N238-H292 WeakPolarHBondContact CA-NE2 3.01Å; N238-H292 WeakPolarHBondContact CB-NE2 3.47Å; N238-H292 PolarHBondContact OD1-CE1 2.97Å
239	L	98.4	Very high	95.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	3.7	176.4	-51.4	179.5	0	0	0	113.5	A241 Y257 F259 F273 I291 H292 C293 R299 M303	L239-A241 PolarHBondContact O-N 3.14Å; L239-Y257 WeakPolarHBondContact CA-O 3.45Å; L239-Y257 WeakPolarHBondContact CD2-O 3.38Å; L239-F259 HydrophobicContact CB-CD1 4.47Å; L239-F259 HydrophobicContact CB-CE1 4.12Å; L239-F259 HydrophobicContact CD1-CE1 4.22Å; L239-F259 HydrophobicContact CD2-CE1 4.33Å; L239-F259 HydrophobicContact CG-CE1 4.46Å; L239-F259 PolarHBondContact O-N 3.48Å; L239-F273 HydrophobicContact CD2-CD2 4.48Å; L239-F273 HydrophobicContact CD2-CE2 4.25Å; L239-I291 HydrophobicContact CD1-CG2 3.76Å; L239-I291 HydrophobicContact CD2-CG2 4.47Å; L239-I291 HydrophobicContact CG-CG2 4.1Å; L239-H292 WeakPolarHBondContact CB-O 3.43Å; L239-H292 WeakPolarHBondContact CG-O 3.49Å; L239-H292 PolarHBondContact N-O 3.09Å; L239-C293 HydrophobicContact CB-CB 4.24Å; L239-R299 HydrophobicContact CD1-CB 4.37Å; L239-R299 PolarHBondContact O-NH1 3.21Å; L239-M303 HydrophobicContact CD1-CB 4.16Å; L239-M303 HydrophobicContact CD1-CG 3.58Å; L239-M303 HydrophobicContact CD2-CG 3.95Å; L239-M303 HydrophobicContact CG-CG 4.42Å
240	C	96.4	Very high	95.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	117.7	178.7	-65.7	0	0	0	0	111.9	N238 E242 R243 K294	N238-C240 VanDerWaalsContact OD1-CB 3.25Å; N238-C240 WeakPolarHBondContact OD1-CB 3.43Å; N238-C240 PolarHBondContact OD1-N 2.58Å; C240-E242 VanDerWaalsContact C-N 3.29Å; C240-E242 WeakPolarHBondContact CA-OE2 3.26Å; C240-E242 WeakPolarHBondContact CB-OE2 3.44Å; C240-R243 HydrophobicContact CB-CB 3.81Å; C240-R243 VanDerWaalsContact CB-O 3.28Å; C240-R243 WeakPolarHBondContact CB-O 3.37Å; C240-K294 PolarHBondContact SG-N 3.27Å
241	A	94	Very high	95.5	Very high	33 Å²	33	45.8 Å²	45.8	27%	0.273	23%	0.234	S	C	.	.	S	Bend	trans	-75.7	-20.6	163.3	0	0	0	0	0	112.6	L239 P258	L239-A241 PolarHBondContact O-N 3.14Å; A241-P258 HydrophobicContact CB-CB 3.96Å
242	E	92.6	Very high	95.2	Very high	72 Å²	72	43.5 Å²	43.5	34%	0.336	23%	0.234	S	C	.	.	S	Bend	trans	-102	-5.6	-171.1	79.4	-77.5	-162.7	0	0	114.4	C240 R299	C240-E242 VanDerWaalsContact C-N 3.29Å; C240-E242 WeakPolarHBondContact CA-OE2 3.26Å; C240-E242 WeakPolarHBondContact CB-OE2 3.44Å; E242-R299 IonicContact OE1-CZ 3.79Å; E242-R299 IonicContact OE1-NH1 2.7Å; E242-R299 IonicContact OE1-NH2 2.85Å; E242-R299 PolarHBondContact OE1-NH2 3.23Å; E242-R299 IonicContact OE2-CZ 2.74Å; E242-R299 IonicContact OE2-NH1 3.52Å; E242-R299 PolarHBondContact OE2-NH1 3.08Å; E242-R299 IonicContact OE2-NH2 3.58Å; E242-R299 PolarHBondContact OE2-NH2 3.33Å
243	R	88.9	Confident	95.1	Very high	55 Å²	55	41.4 Å²	41.4	21%	0.208	22%	0.219	C	C	.	.			trans	-154.1	128.3	-163.1	-90.6	156.9	180	-91.1	-8.3	113.6	F206 E212 N238 C240	F206-R243 HydrophobicContact CD2-CB 4.36Å; F206-R243 HydrophobicContact CE2-CB 3.64Å; F206-R243 HydrophobicContact CE2-CG 4.45Å; F206-R243 HydrophobicContact CZ-CB 3.78Å; F206-R243 HydrophobicContact CZ-CG 4.23Å; E212-R243 IonicContact OE1-CZ 3.84Å; E212-R243 IonicContact OE1-NH1 3.75Å; E212-R243 IonicContact OE1-NH2 3.64Å; E212-R243 PolarHBondContact OE1-NH2 3.4Å; E212-R243 IonicContact OE2-CZ 2.68Å; E212-R243 IonicContact OE2-NH1 2.64Å; E212-R243 PolarHBondContact OE2-NH1 2.88Å; E212-R243 IonicContact OE2-NH2 3.5Å; E212-R243 PolarHBondContact OE2-NH2 3.02Å; N238-R243 PolarHBondContact ND2-O 3.14Å; C240-R243 HydrophobicContact CB-CB 3.81Å; C240-R243 VanDerWaalsContact CB-O 3.28Å; C240-R243 WeakPolarHBondContact CB-O 3.37Å
244	H	92	Very high	95.1	Very high	110 Å²	110	39.6 Å²	39.6	51%	0.509	21%	0.212	S	C	.	.			trans	-130.9	172.6	174.2	-49.5	-90.6	0	0	0	110	Q256	H244-Q256 PolarHBondContact CE1-OE1 3.09Å; H244-Q256 VanDerWaalsContact CE1-OE1 3.27Å; H244-Q256 PolarHBondContact ND1-OE1 2.87Å; H244-Q256 VanDerWaalsContact ND1-OE1 3.08Å
245	Y	92.9	Very high	95.1	Very high	22 Å²	22	40.4 Å²	40.4	9%	0.086	22%	0.219	C	C	.	.			trans	-151.2	168.7	177.4	46.1	-102	0	0	0	108.1	F206 P207 I219 I236 T247 F250 V254 H292	F206-Y245 AromaticContact CE2-CD1 3.7Å; F206-Y245 HydrophobicContact CE2-CD1 3.7Å; F206-Y245 AromaticContact CE2-CE1 3.93Å; F206-Y245 HydrophobicContact CE2-CE1 3.93Å; F206-Y245 AromaticContact CZ-CD1 3.74Å; F206-Y245 HydrophobicContact CZ-CD1 3.74Å; F206-Y245 HydrophobicContact CZ-CE1 4.42Å; P207-Y245 HydrophobicContact CG-CD1 3.96Å; P207-Y245 HydrophobicContact CG-CE1 3.59Å; I219-Y245 HydrophobicContact CD1-CD2 3.95Å; I219-Y245 HydrophobicContact CD1-CG 3.92Å; I236-Y245 WeakPolarHBondContact CG2-OH 3.43Å; Y245-T247 PolarHBondContact O-N 2.77Å; Y245-F250 HydrophobicContact CD2-CD2 4.15Å; Y245-F250 AromaticContact CD2-CE2 3.94Å; Y245-F250 HydrophobicContact CD2-CE2 3.94Å; Y245-F250 AromaticContact CE2-CD2 3.63Å; Y245-F250 HydrophobicContact CE2-CD2 3.63Å; Y245-F250 AromaticContact CE2-CE2 3.56Å; Y245-F250 HydrophobicContact CE2-CE2 3.56Å; Y245-V254 HydrophobicContact CE2-CG1 4.24Å; Y245-V254 HydrophobicContact CE2-CG2 4.29Å; Y245-H292 AromaticContact CE1-CE1 3.27Å; Y245-H292 WeakPolarHBondContact CE1-CE1 3.33Å; Y245-H292 AromaticContact CE1-NE2 2.98Å; Y245-H292 WeakPolarHBondContact CE1-NE2 3.26Å; Y245-H292 AromaticContact CZ-NE2 2.83Å; Y245-H292 PolarHBondContact OH-NE2 3.05Å
246	D	93.6	Very high	95.1	Very high	82 Å²	82	43.4 Å²	43.4	44%	0.439	23%	0.233	S	C	.	.			trans	-61.9	116.3	174.3	178.6	15.4	0	0	0	111.8	E209 A248 K249	E209-D246 PolarHBondContact OE1-N 2.81Å; D246-A248 VanDerWaalsContact C-N 3.31Å; D246-A248 VanDerWaalsContact OD1-CB 3.25Å; D246-A248 WeakPolarHBondContact OD1-CB 3.36Å; D246-A248 PolarHBondContact OD1-N 2.95Å; D246-K249 HydrophobicContact CB-CG 4.41Å
247	T	95.3	Very high	95.1	Very high	48 Å²	48	45.1 Å²	45.1	29%	0.294	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-76.3	-18.1	-179.5	60.2	0	0	0	0	112.9	Y245 K249 F250 C252 V254	Y245-T247 PolarHBondContact O-N 2.77Å; T247-K249 PolarHBondContact O-N 3.21Å; T247-F250 PolarHBondContact O-N 3.29Å; T247-C252 WeakPolarHBondContact O-CA 3.34Å; T247-C252 PolarHBondContact O-N 3.19Å; T247-V254 HydrophobicContact CG2-CB 3.77Å; T247-V254 HydrophobicContact CG2-CG1 4.09Å; T247-V254 HydrophobicContact CG2-CG2 3.85Å
248	A	95.3	Very high	95	Very high	53 Å²	53	48 Å²	48	44%	0.438	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-61.9	-31.2	175.3	0	0	0	0	0	111.5	D246 F250 N251	D246-A248 VanDerWaalsContact C-N 3.31Å; D246-A248 VanDerWaalsContact OD1-CB 3.25Å; D246-A248 WeakPolarHBondContact OD1-CB 3.36Å; D246-A248 PolarHBondContact OD1-N 2.95Å; A248-F250 PolarHBondContact O-N 2.83Å; A248-F250 VanDerWaalsContact O-N 3.11Å; A248-N251 PolarHBondContact O-N 2.64Å
249	K	93.6	Very high	95	Very high	65 Å²	65	48.5 Å²	48.5	28%	0.283	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-57	-23.2	172.7	-70.1	-163.3	169.9	-157.7	0	114.6	I219 D220 V223 D246 T247	I219-K249 HydrophobicContact CD1-CB 4.5Å; I219-K249 HydrophobicContact CD1-CD 3.82Å; I219-K249 HydrophobicContact CG1-CD 3.95Å; I219-K249 HydrophobicContact CG2-CD 4.19Å; D220-K249 IonicContact OD1-NZ 2.64Å; D220-K249 PolarHBondContact OD1-NZ 2.63Å; D220-K249 IonicContact OD2-NZ 2.99Å; V223-K249 HydrophobicContact CG2-CB 4.2Å; V223-K249 VanDerWaalsContact CG2-O 3.25Å; V223-K249 WeakPolarHBondContact CG2-O 3.4Å; D246-K249 HydrophobicContact CB-CG 4.41Å; T247-K249 PolarHBondContact O-N 3.21Å
250	F	95.6	Very high	94.9	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-109.6	29.4	177.8	-66.2	-70.5	0	0	0	112.2	P207 I219 V222 V223 L226 Y234 I236 Y245 T247 A248 C252 R253 V254	P207-F250 HydrophobicContact CB-CE2 4.46Å; P207-F250 HydrophobicContact CB-CZ 4.06Å; P207-F250 HydrophobicContact CG-CE2 4.21Å; P207-F250 HydrophobicContact CG-CZ 4.15Å; I219-F250 HydrophobicContact CD1-CE2 3.7Å; I219-F250 HydrophobicContact CD1-CZ 4.21Å; I219-F250 HydrophobicContact CG1-CE2 3.88Å; I219-F250 HydrophobicContact CG1-CZ 3.86Å; V222-F250 HydrophobicContact CG1-CE1 4.03Å; V222-F250 HydrophobicContact CG1-CZ 4.19Å; V223-F250 HydrophobicContact CG2-CD1 3.86Å; V223-F250 HydrophobicContact CG2-CE1 3.53Å; V223-F250 HydrophobicContact CG2-CZ 3.96Å; L226-F250 HydrophobicContact CD1-CD1 4.35Å; L226-F250 HydrophobicContact CD1-CE1 4.13Å; Y234-F250 HydrophobicContact CE2-CB 4.24Å; Y234-F250 HydrophobicContact CE2-CD1 4.09Å; I236-F250 HydrophobicContact CD1-CD1 3.81Å; I236-F250 HydrophobicContact CD1-CE1 4.14Å; I236-F250 HydrophobicContact CD1-CG 4.23Å; I236-F250 HydrophobicContact CG1-CB 3.87Å; I236-F250 HydrophobicContact CG1-CD1 3.84Å; I236-F250 HydrophobicContact CG1-CD2 4.24Å; I236-F250 HydrophobicContact CG1-CE1 4.43Å; I236-F250 HydrophobicContact CG1-CG 3.72Å; Y245-F250 HydrophobicContact CD2-CD2 4.15Å; Y245-F250 AromaticContact CD2-CE2 3.94Å; Y245-F250 HydrophobicContact CD2-CE2 3.94Å; Y245-F250 AromaticContact CE2-CD2 3.63Å; Y245-F250 HydrophobicContact CE2-CD2 3.63Å; Y245-F250 AromaticContact CE2-CE2 3.56Å; Y245-F250 HydrophobicContact CE2-CE2 3.56Å; T247-F250 PolarHBondContact O-N 3.29Å; A248-F250 PolarHBondContact O-N 2.83Å; A248-F250 VanDerWaalsContact O-N 3.11Å; F250-C252 PolarHBondContact O-N 2.91Å; F250-R253 PolarHBondContact O-N 3.41Å; F250-R253 VanDerWaalsContact O-N 3.11Å; F250-V254 HydrophobicContact CB-CG2 3.84Å; F250-V254 HydrophobicContact CD2-CG2 4.22Å; F250-V254 HydrophobicContact CG-CG2 4.41Å
251	N	91.8	Very high	94.6	Very high	89 Å²	89	54 Å²	54	48%	0.476	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	36.2	-176.5	-58.3	-58.7	0	0	0	112.3	Y234 A248 R253	Y234-N251 PolarHBondContact OH-ND2 3.08Å; Y234-N251 VanDerWaalsContact OH-ND2 3.16Å; A248-N251 PolarHBondContact O-N 2.64Å; N251-R253 PolarHBondContact O-N 3.32Å; N251-R253 VanDerWaalsContact O-N 3.1Å
252	C	91.3	Very high	94.5	Very high	91 Å²	91	58 Å²	58	62%	0.615	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	5.6	-175.8	-59.8	0	0	0	0	116.5	T247 F250 V254	T247-C252 WeakPolarHBondContact O-CA 3.34Å; T247-C252 PolarHBondContact O-N 3.19Å; F250-C252 PolarHBondContact O-N 2.91Å; C252-V254 VanDerWaalsContact C-N 3.29Å; C252-V254 PolarHBondContact O-N 3.38Å
253	R	94.4	Very high	94.7	Very high	56 Å²	56	55.9 Å²	55.9	21%	0.211	29%	0.292	C	S	.	.			trans	-86.6	64.2	-177.3	-63.9	-178.3	-60.8	172.9	4.9	112.3	N232 Y234 I236 F250 N251	N232-R253 PolarHBondContact O-NH1 3.32Å; Y234-R253 PolarHBondContact O-NE 3.26Å; Y234-R253 PolarHBondContact O-NH1 3.06Å; Y234-R253 PolarHBondContact O-NH2 3.28Å; Y234-R253 VanDerWaalsContact O-NH2 3.16Å; I236-R253 PolarHBondContact N-O 3.45Å; F250-R253 PolarHBondContact O-N 3.41Å; F250-R253 VanDerWaalsContact O-N 3.11Å; N251-R253 PolarHBondContact O-N 3.32Å; N251-R253 VanDerWaalsContact O-N 3.1Å
254	V	98	Very high	95.1	Very high	24 Å²	24	53.6 Å²	53.6	15%	0.145	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	106	-178.4	-171.9	0	0	0	0	110.3	I236 N238 Y245 T247 F250 C252	I236-V254 HydrophobicContact CB-CB 4.44Å; I236-V254 HydrophobicContact CB-CG1 4.26Å; I236-V254 HydrophobicContact CB-CG2 4.11Å; I236-V254 HydrophobicContact CG1-CG2 4.19Å; I236-V254 HydrophobicContact CG2-CG1 4.47Å; I236-V254 CarbonylContact O-C 3.59Å; I236-V254 WeakPolarHBondContact O-CA 3.43Å; N238-V254 HydrophobicContact CB-CG1 4.45Å; Y245-V254 HydrophobicContact CE2-CG1 4.24Å; Y245-V254 HydrophobicContact CE2-CG2 4.29Å; T247-V254 HydrophobicContact CG2-CB 3.77Å; T247-V254 HydrophobicContact CG2-CG1 4.09Å; T247-V254 HydrophobicContact CG2-CG2 3.85Å; F250-V254 HydrophobicContact CB-CG2 3.84Å; F250-V254 HydrophobicContact CD2-CG2 4.22Å; F250-V254 HydrophobicContact CG-CG2 4.41Å; C252-V254 VanDerWaalsContact C-N 3.29Å; C252-V254 PolarHBondContact O-N 3.38Å
255	A	98.4	Very high	95.4	Very high	17 Å²	17	48.6 Å²	48.6	14%	0.14	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	151.6	168.1	0	0	0	0	0	110.5	I236 Y237 N238 Y257	I236-A255 PolarHBondContact O-N 2.96Å; Y237-A255 HydrophobicContact CD1-CB 3.97Å; Y237-A255 HydrophobicContact CE1-CB 4.11Å; N238-A255 PolarHBondContact N-O 3.48Å; A255-Y257 HydrophobicContact CB-CD2 4.4Å; A255-Y257 HydrophobicContact CB-CE2 3.93Å
256	Q	98.4	Very high	95.7	Very high	93 Å²	93	52.2 Å²	52.2	44%	0.435	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.4	-177.1	-56.4	-168	38.1	0	0	110.5	N238 H244 P258	N238-Q256 HydrophobicContact CB-CG 4.5Å; H244-Q256 PolarHBondContact CE1-OE1 3.09Å; H244-Q256 VanDerWaalsContact CE1-OE1 3.27Å; H244-Q256 PolarHBondContact ND1-OE1 2.87Å; H244-Q256 VanDerWaalsContact ND1-OE1 3.08Å; Q256-P258 VanDerWaalsContact C-CD 3.44Å
257	Y	98.6	Very high	95.9	Very high	35 Å²	35	48.5 Å²	48.5	14%	0.137	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	67.4	175.2	-68.6	-93.7	0	0	0	108.6	Y237 N238 L239 A255 L269 P272 F273 D276	Y237-Y257 HydrophobicContact CD1-CD2 4.21Å; Y237-Y257 HydrophobicContact CD1-CE2 4.1Å; Y237-Y257 HydrophobicContact CE1-CE2 4.34Å; N238-Y257 PolarHBondContact O-N 3.31Å; L239-Y257 WeakPolarHBondContact CA-O 3.45Å; L239-Y257 WeakPolarHBondContact CD2-O 3.38Å; A255-Y257 HydrophobicContact CB-CD2 4.4Å; A255-Y257 HydrophobicContact CB-CE2 3.93Å; Y257-L269 HydrophobicContact CD1-CD1 3.79Å; Y257-L269 HydrophobicContact CD1-CG 4.18Å; Y257-P272 HydrophobicContact CE1-CB 4.41Å; Y257-P272 PolarHBondContact OH-O 2.64Å; Y257-F273 HydrophobicContact CD1-CB 3.75Å; Y257-F273 HydrophobicContact CD1-CD2 4.3Å; Y257-F273 AromaticContact CD2-CD2 3.73Å; Y257-F273 HydrophobicContact CD2-CD2 3.73Å; Y257-F273 HydrophobicContact CE1-CB 3.84Å; Y257-F273 HydrophobicContact CE2-CD2 4.16Å; Y257-F273 HydrophobicContact CG-CB 4.15Å; Y257-F273 AromaticContact CG-CD2 3.82Å; Y257-F273 HydrophobicContact CG-CD2 3.82Å; Y257-F273 HydrophobicContact CG-CG 4.48Å; Y257-D276 WeakPolarHBondContact OH-CB 3.25Å; Y257-D276 PolarHBondContact OH-OD2 2.91Å
258	P	97.9	Very high	96	Very high	62 Å²	62	51.6 Å²	51.6	40%	0.403	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	132	-167	28.6	-34.9	0	0	0	112.8	A241 Q256	A241-P258 HydrophobicContact CB-CB 3.96Å; Q256-P258 VanDerWaalsContact C-CD 3.44Å
259	F	97.7	Very high	96.2	Very high	12 Å²	12	50.9 Å²	50.9	5%	0.053	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	159.1	165.1	62.5	-81	0	0	0	112.9	L239 P264 P265 L269 R299 M303	L239-F259 HydrophobicContact CB-CD1 4.47Å; L239-F259 HydrophobicContact CB-CE1 4.12Å; L239-F259 HydrophobicContact CD1-CE1 4.22Å; L239-F259 HydrophobicContact CD2-CE1 4.33Å; L239-F259 HydrophobicContact CG-CE1 4.46Å; L239-F259 PolarHBondContact O-N 3.48Å; F259-P264 VanDerWaalsContact CD2-C 3.4Å; F259-P264 WeakPolarHBondContact CD2-O 3.43Å; F259-P265 HydrophobicContact CB-CB 4.42Å; F259-P265 HydrophobicContact CD1-CB 3.88Å; F259-P265 HydrophobicContact CD2-CB 4Å; F259-P265 VanDerWaalsContact CD2-N 3.28Å; F259-P265 HydrophobicContact CE1-CB 3.95Å; F259-P265 HydrophobicContact CE2-CB 4.03Å; F259-P265 HydrophobicContact CE2-CG 4.32Å; F259-P265 VanDerWaalsContact CE2-N 3.33Å; F259-P265 HydrophobicContact CG-CB 3.89Å; F259-P265 HydrophobicContact CZ-CB 3.99Å; F259-P265 HydrophobicContact CZ-CG 4.27Å; F259-L269 HydrophobicContact CB-CD2 4.45Å; F259-L269 HydrophobicContact CD1-CD2 4.1Å; F259-R299 HydrophobicContact CD2-CG 3.93Å; F259-R299 HydrophobicContact CE1-CB 4.16Å; F259-R299 HydrophobicContact CE2-CB 3.69Å; F259-R299 HydrophobicContact CE2-CG 3.43Å; F259-R299 VanDerWaalsContact CE2-CG 3.43Å; F259-R299 HydrophobicContact CZ-CB 3.49Å; F259-R299 VanDerWaalsContact CZ-CB 3.49Å; F259-R299 HydrophobicContact CZ-CG 3.81Å; F259-R299 WeakPolarHBondContact O-CD 3.31Å; F259-R299 PolarHBondContact O-NH1 3.2Å; F259-M303 HydrophobicContact CE1-CG 3.81Å; F259-M303 HydrophobicContact CE1-SD 3.7Å; F259-M303 HydrophobicContact CZ-CG 4.06Å; F259-M303 HydrophobicContact CZ-SD 3.92Å
260	E	95.9	Very high	96.4	Very high	72 Å²	72	47.8 Å²	47.8	34%	0.336	25%	0.245	S	C	.	.			trans	-64.9	141.6	-167.7	-59.6	-56.8	156.5	0	0	113.3	H262 N263 K390	E260-H262 PolarHBondContact O-N 2.92Å; E260-N263 HydrophobicContact CB-CB 4.14Å; E260-N263 PolarHBondContact O-N 3.48Å; E260-N263 VanDerWaalsContact O-N 3.16Å; E260-K390 WeakPolarHBondContact OE1-CE 3.32Å; E260-K390 IonicContact OE1-NZ 2.63Å; E260-K390 PolarHBondContact OE1-NZ 2.81Å
261	D	90.9	Very high	96.6	Very high	42 Å²	42	52 Å²	52	23%	0.225	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	141.5	-179	-155.1	30.4	0	0	0	111.4	N263 K294 R299	D261-N263 PolarHBondContact O-N 2.93Å; D261-N263 VanDerWaalsContact O-N 3.12Å; D261-N263 PolarHBondContact O-ND2 2.83Å; D261-K294 WeakPolarHBondContact OD2-CD 3.49Å; D261-K294 IonicContact OD2-NZ 3.65Å; D261-R299 IonicContact OD1-CZ 3.41Å; D261-R299 IonicContact OD1-NE 3.5Å; D261-R299 PolarHBondContact OD1-NE 3.07Å; D261-R299 IonicContact OD1-NH2 2.71Å; D261-R299 PolarHBondContact OD1-NH2 3.49Å; D261-R299 IonicContact OD2-NH2 3.26Å
262	H	92.1	Very high	96.9	Very high	117 Å²	117	50.6 Å²	50.6	54%	0.542	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	3	-173.9	-54.7	82.3	0	0	0	117.1	E260 I337	E260-H262 PolarHBondContact O-N 2.92Å; H262-I337 HydrophobicContact CB-CD1 3.83Å; H262-I337 WeakPolarHBondContact O-CD1 3.37Å
263	N	96.3	Very high	97.3	Very high	28 Å²	28	46.3 Å²	46.3	15%	0.15	23%	0.23	C	C	.	.	S	Bend	trans	-102.2	163	174.7	-64.2	-88.1	0	0	0	110.9	E260 D261 Q340 W443	E260-N263 HydrophobicContact CB-CB 4.14Å; E260-N263 PolarHBondContact O-N 3.48Å; E260-N263 VanDerWaalsContact O-N 3.16Å; D261-N263 PolarHBondContact O-N 2.93Å; D261-N263 VanDerWaalsContact O-N 3.12Å; D261-N263 PolarHBondContact O-ND2 2.83Å; N263-Q340 WeakPolarHBondContact O-CG 3.4Å; N263-Q340 PolarHBondContact O-NE2 3.47Å; N263-W443 HydrophobicContact CB-CZ2 4.43Å; N263-W443 PolarHBondContact OD1-NE1 2.71Å
264	P	97.9	Very high	97.5	Very high	8 Å²	8	43.6 Å²	43.6	5%	0.052	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-67.3	165.6	162	31.6	-35.3	0	0	0	111.4	F259 Y343 W443	F259-P264 VanDerWaalsContact CD2-C 3.4Å; F259-P264 WeakPolarHBondContact CD2-O 3.43Å; P264-Y343 HydrophobicContact CB-CD1 3.73Å; P264-Y343 HydrophobicContact CB-CD2 3.64Å; P264-Y343 HydrophobicContact CB-CE1 4.01Å; P264-Y343 HydrophobicContact CB-CE2 3.95Å; P264-Y343 HydrophobicContact CB-CG 3.53Å; P264-Y343 HydrophobicContact CG-CD1 4.35Å; P264-Y343 HydrophobicContact CG-CD2 3.95Å; P264-Y343 HydrophobicContact CG-CE1 4.14Å; P264-Y343 HydrophobicContact CG-CE2 3.74Å; P264-Y343 HydrophobicContact CG-CG 4.26Å; P264-W443 HydrophobicContact CG-CB 3.75Å; P264-W443 HydrophobicContact CG-CD2 4.05Å; P264-W443 HydrophobicContact CG-CG 3.62Å
265	P	98.3	Very high	97.5	Very high	4 Å²	4	46.2 Å²	46.2	3%	0.026	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-68.3	169.4	163.7	34	-37.2	0	0	0	110.1	F259 L269 I270 V302 M303 Y343	F259-P265 HydrophobicContact CB-CB 4.42Å; F259-P265 HydrophobicContact CD1-CB 3.88Å; F259-P265 HydrophobicContact CD2-CB 4Å; F259-P265 VanDerWaalsContact CD2-N 3.28Å; F259-P265 HydrophobicContact CE1-CB 3.95Å; F259-P265 HydrophobicContact CE2-CB 4.03Å; F259-P265 HydrophobicContact CE2-CG 4.32Å; F259-P265 VanDerWaalsContact CE2-N 3.33Å; F259-P265 HydrophobicContact CG-CB 3.89Å; F259-P265 HydrophobicContact CZ-CB 3.99Å; F259-P265 HydrophobicContact CZ-CG 4.27Å; P265-L269 HydrophobicContact CB-CB 4.39Å; P265-L269 HydrophobicContact CB-CD2 4.02Å; P265-I270 HydrophobicContact CG-CD1 3.95Å; P265-I270 HydrophobicContact CG-CG1 3.81Å; P265-V302 HydrophobicContact CG-CG1 4Å; P265-M303 HydrophobicContact CB-SD 4.11Å; P265-M303 HydrophobicContact CG-SD 3.93Å; P265-Y343 VanDerWaalsContact O-CD1 3.28Å; P265-Y343 WeakPolarHBondContact O-CD1 3.48Å; P265-Y343 WeakPolarHBondContact O-CE1 3.15Å
266	Q	98.2	Very high	97.5	Very high	98 Å²	98	47.5 Å²	47.5	46%	0.458	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-63.5	143.5	157.4	-70.5	172.4	-0.2	0	0	108.8	E268 L269 L389 D421	Q266-E268 VanDerWaalsContact C-N 3.28Å; Q266-E268 PolarHBondContact O-N 3.11Å; Q266-L269 HydrophobicContact CB-CB 4.38Å; Q266-L269 VanDerWaalsContact O-CB 3.26Å; Q266-L269 WeakPolarHBondContact O-CB 3.31Å; Q266-L269 PolarHBondContact O-N 3.46Å; Q266-L269 VanDerWaalsContact O-N 3.08Å; Q266-L389 HydrophobicContact CG-CD2 4.29Å; Q266-D421 WeakPolarHBondContact CA-OD2 3.41Å
267	L	97.9	Very high	97.5	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-60.2	-41.3	-176.3	-171.2	79.9	0	0	0	111.8	L269 I270 Y343 Y346 L350 Y357 D421 F448	L267-L269 PolarHBondContact O-N 2.79Å; L267-I270 HydrophobicContact CD1-CD1 4.23Å; L267-I270 WeakPolarHBondContact O-CB 3.26Å; L267-I270 WeakPolarHBondContact O-CG1 3.28Å; L267-I270 PolarHBondContact O-N 3.06Å; L267-I270 VanDerWaalsContact O-N 3.14Å; L267-Y343 HydrophobicContact CB-CE1 4.37Å; L267-Y343 HydrophobicContact CD1-CD1 4.25Å; L267-Y346 HydrophobicContact CD1-CD2 4.23Å; L267-Y346 HydrophobicContact CD1-CG 4.49Å; L267-L350 HydrophobicContact CD2-CD1 4.25Å; L267-Y357 HydrophobicContact CD2-CD1 4.42Å; L267-Y357 HydrophobicContact CD2-CD2 3.32Å; L267-Y357 HydrophobicContact CD2-CE2 3.5Å; L267-Y357 VanDerWaalsContact CD2-CE2 3.5Å; L267-Y357 HydrophobicContact CD2-CG 3.79Å; L267-D421 PolarHBondContact N-OD2 2.7Å; L267-F448 HydrophobicContact CD1-CE2 4.25Å; L267-F448 HydrophobicContact CD1-CZ 4.36Å; L267-F448 HydrophobicContact CD2-CE2 3.66Å; L267-F448 HydrophobicContact CD2-CZ 3.97Å
268	E	97.6	Very high	97.6	Very high	113 Å²	113	42.7 Å²	42.7	53%	0.528	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-63.8	-21.6	178.7	-67.3	172.3	-115.2	0	0	113.3	Q266 I270 P272 Y357	Q266-E268 VanDerWaalsContact C-N 3.28Å; Q266-E268 PolarHBondContact O-N 3.11Å; E268-I270 PolarHBondContact O-N 3.1Å; E268-P272 WeakPolarHBondContact O-CD 3.26Å; E268-Y357 HydrophobicContact CG-CD1 3.63Å; E268-Y357 HydrophobicContact CG-CE1 3.43Å; E268-Y357 VanDerWaalsContact CG-CE1 3.43Å; E268-Y357 WeakPolarHBondContact OE1-CE1 3.32Å
269	L	98.6	Very high	97.6	Very high	38 Å²	38	44.9 Å²	44.9	20%	0.199	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-71.3	-20	177	-166.8	68.1	0	0	0	112.5	Y257 F259 P265 Q266 L267 F273	Y257-L269 HydrophobicContact CD1-CD1 3.79Å; Y257-L269 HydrophobicContact CD1-CG 4.18Å; F259-L269 HydrophobicContact CB-CD2 4.45Å; F259-L269 HydrophobicContact CD1-CD2 4.1Å; P265-L269 HydrophobicContact CB-CB 4.39Å; P265-L269 HydrophobicContact CB-CD2 4.02Å; Q266-L269 HydrophobicContact CB-CB 4.38Å; Q266-L269 VanDerWaalsContact O-CB 3.26Å; Q266-L269 WeakPolarHBondContact O-CB 3.31Å; Q266-L269 PolarHBondContact O-N 3.46Å; Q266-L269 VanDerWaalsContact O-N 3.08Å; L267-L269 PolarHBondContact O-N 2.79Å; L269-F273 WeakPolarHBondContact O-CB 3.37Å; L269-F273 PolarHBondContact O-N 3.47Å
270	I	98.8	Very high	97.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-75	-47.1	-170.9	-55	177.5	0	0	0	111.6	P265 L267 E268 F273 C274 A306 Y347	P265-I270 HydrophobicContact CG-CD1 3.95Å; P265-I270 HydrophobicContact CG-CG1 3.81Å; L267-I270 HydrophobicContact CD1-CD1 4.23Å; L267-I270 WeakPolarHBondContact O-CB 3.26Å; L267-I270 WeakPolarHBondContact O-CG1 3.28Å; L267-I270 PolarHBondContact O-N 3.06Å; L267-I270 VanDerWaalsContact O-N 3.14Å; E268-I270 PolarHBondContact O-N 3.1Å; I270-F273 PolarHBondContact O-N 3.07Å; I270-C274 PolarHBondContact O-N 2.68Å; I270-C274 PolarHBondContact O-SG 3.39Å; I270-A306 HydrophobicContact CG2-CB 3.43Å; I270-A306 VanDerWaalsContact CG2-CB 3.43Å; I270-Y347 HydrophobicContact CB-CD2 4.06Å; I270-Y347 HydrophobicContact CB-CE2 4.23Å; I270-Y347 HydrophobicContact CB-CG 4.44Å; I270-Y347 HydrophobicContact CG2-CD1 3.74Å; I270-Y347 HydrophobicContact CG2-CD2 3.63Å; I270-Y347 HydrophobicContact CG2-CE1 3.88Å; I270-Y347 HydrophobicContact CG2-CE2 3.82Å; I270-Y347 HydrophobicContact CG2-CG 3.61Å
271	K	98.6	Very high	97.8	Very high	90 Å²	90	42.9 Å²	42.9	39%	0.391	21%	0.21	S	C	.	.	H	α-helix	trans	-63.4	-50.1	-177	174.6	171.1	163.1	65.9	0	112.7	F273 C274 E275 Y347	K271-F273 VanDerWaalsContact C-N 3.29Å; K271-F273 PolarHBondContact O-N 3.13Å; K271-C274 PolarHBondContact O-N 2.93Å; K271-C274 VanDerWaalsContact O-N 3.09Å; K271-E275 WeakPolarHBondContact CE-OE1 3.22Å; K271-E275 VanDerWaalsContact CG-OE1 3.26Å; K271-E275 WeakPolarHBondContact CG-OE1 3.28Å; K271-E275 IonicContact NZ-OE1 3.02Å; K271-E275 PolarHBondContact NZ-OE1 3.18Å; K271-E275 WeakPolarHBondContact O-CG 3.37Å; K271-E275 PolarHBondContact O-N 2.97Å; K271-Y347 HydrophobicContact CB-CE2 4.08Å
272	P	98.8	Very high	98.1	Very high	59 Å²	59	44.3 Å²	44.3	38%	0.383	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-28.4	176.7	-22.1	35	0	0	0	113.8	Y257 E268 D276	Y257-P272 HydrophobicContact CE1-CB 4.41Å; Y257-P272 PolarHBondContact OH-O 2.64Å; E268-P272 WeakPolarHBondContact O-CD 3.26Å; P272-D276 VanDerWaalsContact O-CB 3.31Å; P272-D276 WeakPolarHBondContact O-CB 3.44Å; P272-D276 PolarHBondContact O-N 2.99Å
273	F	98.9	Very high	98.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.6	-45.5	170.9	169.1	-86.9	0	0	0	111.4	Y237 L239 Y257 L269 I270 K271 E275 L277 I291 M303	Y237-F273 HydrophobicContact CD1-CD2 4.09Å; Y237-F273 AromaticContact CD1-CE2 3.66Å; Y237-F273 HydrophobicContact CD1-CE2 3.66Å; Y237-F273 HydrophobicContact CE1-CE2 4.42Å; Y237-F273 HydrophobicContact CG-CE2 4.1Å; L239-F273 HydrophobicContact CD2-CD2 4.48Å; L239-F273 HydrophobicContact CD2-CE2 4.25Å; Y257-F273 HydrophobicContact CD1-CB 3.75Å; Y257-F273 HydrophobicContact CD1-CD2 4.3Å; Y257-F273 AromaticContact CD2-CD2 3.73Å; Y257-F273 HydrophobicContact CD2-CD2 3.73Å; Y257-F273 HydrophobicContact CE1-CB 3.84Å; Y257-F273 HydrophobicContact CE2-CD2 4.16Å; Y257-F273 HydrophobicContact CG-CB 4.15Å; Y257-F273 AromaticContact CG-CD2 3.82Å; Y257-F273 HydrophobicContact CG-CD2 3.82Å; Y257-F273 HydrophobicContact CG-CG 4.48Å; L269-F273 WeakPolarHBondContact O-CB 3.37Å; L269-F273 PolarHBondContact O-N 3.47Å; I270-F273 PolarHBondContact O-N 3.07Å; K271-F273 VanDerWaalsContact C-N 3.29Å; K271-F273 PolarHBondContact O-N 3.13Å; F273-E275 VanDerWaalsContact C-N 3.3Å; F273-E275 PolarHBondContact O-N 2.92Å; F273-L277 HydrophobicContact CE1-CD2 3.57Å; F273-L277 HydrophobicContact CZ-CD2 3.64Å; F273-L277 WeakPolarHBondContact O-CB 3.12Å; F273-L277 PolarHBondContact O-N 3.37Å; F273-I291 HydrophobicContact CE2-CG2 4.38Å; F273-I291 HydrophobicContact CZ-CG1 4.14Å; F273-I291 HydrophobicContact CZ-CG2 4.24Å; F273-M303 HydrophobicContact CB-CE 3.53Å; F273-M303 HydrophobicContact CD1-CB 3.93Å; F273-M303 HydrophobicContact CD1-CE 3.71Å; F273-M303 HydrophobicContact CD2-CE 4.02Å; F273-M303 HydrophobicContact CE1-CB 3.53Å; F273-M303 HydrophobicContact CE1-CE 4.49Å; F273-M303 WeakPolarHBondContact CE1-O 3.47Å; F273-M303 HydrophobicContact CE2-CB 4.16Å; F273-M303 HydrophobicContact CG-CB 4.43Å; F273-M303 HydrophobicContact CG-CE 3.45Å; F273-M303 VanDerWaalsContact CG-CE 3.45Å; F273-M303 HydrophobicContact CZ-CB 3.65Å
274	C	98.9	Very high	98.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-36.7	179.7	-67.8	0	0	0	0	111.9	I270 K271 D278 Y307 H310	I270-C274 PolarHBondContact O-N 2.68Å; I270-C274 PolarHBondContact O-SG 3.39Å; K271-C274 PolarHBondContact O-N 2.93Å; K271-C274 VanDerWaalsContact O-N 3.09Å; C274-D278 PolarHBondContact O-N 3.24Å; C274-Y307 HydrophobicContact CB-CD2 4.25Å; C274-H310 HydrophobicContact CB-CB 4.04Å
275	E	98.8	Very high	98.5	Very high	78 Å²	78	52.7 Å²	52.7	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-73	-44.6	179.7	-70.6	162.7	169.6	0	0	112.1	K271 F273 L277 D278 Q279	K271-E275 WeakPolarHBondContact CE-OE1 3.22Å; K271-E275 VanDerWaalsContact CG-OE1 3.26Å; K271-E275 WeakPolarHBondContact CG-OE1 3.28Å; K271-E275 IonicContact NZ-OE1 3.02Å; K271-E275 PolarHBondContact NZ-OE1 3.18Å; K271-E275 WeakPolarHBondContact O-CG 3.37Å; K271-E275 PolarHBondContact O-N 2.97Å; F273-E275 VanDerWaalsContact C-N 3.3Å; F273-E275 PolarHBondContact O-N 2.92Å; E275-L277 PolarHBondContact O-N 3.21Å; E275-D278 PolarHBondContact O-N 2.77Å; E275-Q279 VanDerWaalsContact O-CB 3.29Å; E275-Q279 WeakPolarHBondContact O-CB 2.98Å; E275-Q279 PolarHBondContact O-N 3.13Å
276	D	98.9	Very high	98.5	Very high	45 Å²	45	57.3 Å²	57.3	24%	0.241	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-29.4	173.3	-176	52.2	0	0	0	112.9	K235 Y237 Y257 P272 W280	K235-D276 WeakPolarHBondContact CE-OD2 3.47Å; K235-D276 PolarHBondContact NZ-O 3.24Å; K235-D276 IonicContact NZ-OD1 2.98Å; K235-D276 PolarHBondContact NZ-OD1 3.44Å; K235-D276 IonicContact NZ-OD2 3.38Å; K235-D276 PolarHBondContact NZ-OD2 3.15Å; Y237-D276 WeakPolarHBondContact CE1-OD2 3.18Å; Y237-D276 PolarHBondContact OH-O 3.32Å; Y237-D276 VanDerWaalsContact OH-O 3.06Å; Y257-D276 WeakPolarHBondContact OH-CB 3.25Å; Y257-D276 PolarHBondContact OH-OD2 2.91Å; P272-D276 VanDerWaalsContact O-CB 3.31Å; P272-D276 WeakPolarHBondContact O-CB 3.44Å; P272-D276 PolarHBondContact O-N 2.99Å; D276-W280 WeakPolarHBondContact O-CB 3.22Å; D276-W280 PolarHBondContact O-N 3.18Å
277	L	98.8	Very high	98.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-77.5	-39.5	175.3	-177.2	55.6	0	0	0	112.7	Y237 F273 E275 L281 A289 Y307	Y237-L277 HydrophobicContact CE1-CB 4.37Å; Y237-L277 HydrophobicContact CE1-CD1 4.49Å; Y237-L277 HydrophobicContact CE2-CD1 3.85Å; Y237-L277 WeakPolarHBondContact OH-CA 3.4Å; F273-L277 HydrophobicContact CE1-CD2 3.57Å; F273-L277 HydrophobicContact CZ-CD2 3.64Å; F273-L277 WeakPolarHBondContact O-CB 3.12Å; F273-L277 PolarHBondContact O-N 3.37Å; E275-L277 PolarHBondContact O-N 3.21Å; L277-L281 HydrophobicContact CD1-CD1 3.6Å; L277-L281 HydrophobicContact CD1-CG 4.02Å; L277-L281 HydrophobicContact CG-CD1 4.04Å; L277-L281 VanDerWaalsContact O-CB 3.3Å; L277-L281 WeakPolarHBondContact O-CB 3.39Å; L277-L281 VanDerWaalsContact O-CG 3.25Å; L277-L281 WeakPolarHBondContact O-CG 3Å; L277-L281 PolarHBondContact O-N 3.05Å; L277-L281 VanDerWaalsContact O-N 3.08Å; L277-A289 HydrophobicContact CD1-CB 3.25Å; L277-Y307 HydrophobicContact CB-CD2 4.09Å; L277-Y307 HydrophobicContact CB-CE2 4.12Å; L277-Y307 HydrophobicContact CD2-CD1 3.53Å; L277-Y307 HydrophobicContact CD2-CD2 3.8Å; L277-Y307 HydrophobicContact CD2-CE1 3.99Å; L277-Y307 HydrophobicContact CD2-CE2 4.24Å; L277-Y307 HydrophobicContact CD2-CG 3.42Å; L277-Y307 VanDerWaalsContact CD2-CG 3.42Å; L277-Y307 HydrophobicContact CG-CD1 4.04Å; L277-Y307 HydrophobicContact CG-CD2 3.88Å; L277-Y307 HydrophobicContact CG-CE1 3.98Å; L277-Y307 HydrophobicContact CG-CE2 3.85Å; L277-Y307 HydrophobicContact CG-CG 3.98Å
278	D	98.8	Very high	98.5	Very high	26 Å²	26	53.6 Å²	53.6	14%	0.139	28%	0.275	C	S	.	.	H	α-helix	trans	-69.4	-43.8	174.8	-162.7	23.1	0	0	0	111.8	C274 E275 W280 L281 S282 Y307 R311	C274-D278 PolarHBondContact O-N 3.24Å; E275-D278 PolarHBondContact O-N 2.77Å; D278-W280 PolarHBondContact O-N 3.35Å; D278-L281 CarbonylContact O-C 3.52Å; D278-L281 PolarHBondContact O-N 3.32Å; D278-L281 VanDerWaalsContact O-N 3.16Å; D278-S282 VanDerWaalsContact O-CB 3.3Å; D278-S282 WeakPolarHBondContact O-CB 3.27Å; D278-S282 PolarHBondContact O-N 3.07Å; D278-S282 PolarHBondContact O-OG 3.26Å; D278-Y307 HydrophobicContact CB-CE2 3.91Å; D278-R311 VanDerWaalsContact CG-NE 3.28Å; D278-R311 WeakPolarHBondContact OD1-CD 3.33Å; D278-R311 IonicContact OD1-CZ 2.78Å; D278-R311 IonicContact OD1-NE 2.83Å; D278-R311 PolarHBondContact OD1-NE 2.95Å; D278-R311 IonicContact OD1-NH1 2.67Å; D278-R311 PolarHBondContact OD1-NH1 3.04Å; D278-R311 IonicContact OD1-NH2 2.7Å; D278-R311 PolarHBondContact OD1-NH2 3.16Å; D278-R311 VanDerWaalsContact OD2-CD 3.22Å; D278-R311 WeakPolarHBondContact OD2-CD 3.48Å; D278-R311 IonicContact OD2-CZ 2.66Å; D278-R311 IonicContact OD2-NE 3.01Å; D278-R311 PolarHBondContact OD2-NE 3Å; D278-R311 IonicContact OD2-NH1 3.09Å; D278-R311 PolarHBondContact OD2-NH1 2.96Å; D278-R311 IonicContact OD2-NH2 3.08Å
279	Q	98.7	Very high	98.6	Very high	108 Å²	108	48.2 Å²	48.2	51%	0.505	25%	0.25	S	S	.	.	H	α-helix	trans	-55.6	-52.3	177.4	179.9	55.5	49.5	0	0	110.4	E275 L281 S282 E283	E275-Q279 VanDerWaalsContact O-CB 3.29Å; E275-Q279 WeakPolarHBondContact O-CB 2.98Å; E275-Q279 PolarHBondContact O-N 3.13Å; Q279-L281 PolarHBondContact O-N 3.2Å; Q279-S282 PolarHBondContact O-N 2.97Å; Q279-S282 PolarHBondContact O-OG 2.91Å; Q279-E283 PolarHBondContact NE2-OE1 2.91Å; Q279-E283 WeakPolarHBondContact O-CG 3.36Å; Q279-E283 PolarHBondContact O-N 3.3Å
280	W	98.7	Very high	98.6	Very high	25 Å²	25	46.4 Å²	46.4	10%	0.095	24%	0.241	C	C	.	.	H	α-helix	trans	-59	-44.6	175.5	174.8	-106.9	0	0	0	113	Y234 K235 D276 D278 S282 H287 V288	Y234-W280 VanDerWaalsContact C-CZ2 3.44Å; K235-W280 HydrophobicContact CB-CD2 3.69Å; K235-W280 HydrophobicContact CB-CE3 4.37Å; K235-W280 HydrophobicContact CB-CG 3.95Å; K235-W280 HydrophobicContact CB-CZ2 3.88Å; K235-W280 HydrophobicContact CD-CB 3.99Å; K235-W280 HydrophobicContact CD-CD2 3.73Å; K235-W280 HydrophobicContact CD-CE3 4.04Å; K235-W280 HydrophobicContact CD-CG 3.68Å; K235-W280 HydrophobicContact CG-CD2 4.39Å; K235-W280 HydrophobicContact CG-CG 4.48Å; D276-W280 WeakPolarHBondContact O-CB 3.22Å; D276-W280 PolarHBondContact O-N 3.18Å; D278-W280 PolarHBondContact O-N 3.35Å; W280-S282 VanDerWaalsContact C-N 3.27Å; W280-S282 PolarHBondContact O-N 2.71Å; W280-H287 AromaticContact CD2-ND1 3.75Å; W280-H287 AromaticContact CE2-CG 3.74Å; W280-H287 AromaticContact CE2-ND1 3.76Å; W280-H287 AromaticContact CE3-CE1 3.76Å; W280-H287 AromaticContact CE3-ND1 3.71Å; W280-H287 AromaticContact CH2-CD2 3.72Å; W280-H287 AromaticContact CH2-CE1 3.4Å; W280-H287 VanDerWaalsContact CH2-CE1 3.4Å; W280-H287 WeakPolarHBondContact CH2-CE1 3.41Å; W280-H287 AromaticContact CH2-CG 3.95Å; W280-H287 AromaticContact CH2-ND1 3.76Å; W280-H287 AromaticContact CH2-NE2 3.35Å; W280-H287 WeakPolarHBondContact CH2-NE2 3.16Å; W280-H287 HydrophobicContact CZ2-CB 4.18Å; W280-H287 AromaticContact CZ2-CD2 3.62Å; W280-H287 AromaticContact CZ2-CE1 3.89Å; W280-H287 AromaticContact CZ2-CG 3.62Å; W280-H287 AromaticContact CZ2-ND1 3.78Å; W280-H287 AromaticContact CZ2-NE2 3.79Å; W280-H287 AromaticContact CZ3-CE1 3.34Å; W280-H287 WeakPolarHBondContact CZ3-CE1 3.38Å; W280-H287 AromaticContact CZ3-ND1 3.73Å; W280-H287 AromaticContact CZ3-NE2 3.78Å; W280-H287 WeakPolarHBondContact O-CB 3.35Å; W280-H287 PolarHBondContact O-ND1 3.04Å; W280-V288 PolarHBondContact NE1-O 2.52Å
281	L	98.6	Very high	98.6	Very high	17 Å²	17	46.4 Å²	46.4	9%	0.089	24%	0.241	C	C	.	.	H	α-helix	trans	-81.3	1.3	-175.9	-67.5	179.7	0	0	0	114.6	N200 I201 L277 D278 Q279 H287 A289 Y307	N200-L281 HydrophobicContact CB-CD2 4.15Å; I201-L281 HydrophobicContact CG1-CD1 4.11Å; L277-L281 HydrophobicContact CD1-CD1 3.6Å; L277-L281 HydrophobicContact CD1-CG 4.02Å; L277-L281 HydrophobicContact CG-CD1 4.04Å; L277-L281 VanDerWaalsContact O-CB 3.3Å; L277-L281 WeakPolarHBondContact O-CB 3.39Å; L277-L281 VanDerWaalsContact O-CG 3.25Å; L277-L281 WeakPolarHBondContact O-CG 3Å; L277-L281 PolarHBondContact O-N 3.05Å; L277-L281 VanDerWaalsContact O-N 3.08Å; D278-L281 CarbonylContact O-C 3.52Å; D278-L281 PolarHBondContact O-N 3.32Å; D278-L281 VanDerWaalsContact O-N 3.16Å; Q279-L281 PolarHBondContact O-N 3.2Å; L281-H287 HydrophobicContact CD2-CB 4.38Å; L281-H287 VanDerWaalsContact CD2-O 3.27Å; L281-H287 WeakPolarHBondContact CD2-O 3.44Å; L281-A289 HydrophobicContact CD1-CB 4.26Å; L281-A289 HydrophobicContact CD2-CB 4.15Å; L281-A289 HydrophobicContact CG-CB 4.4Å; L281-Y307 HydrophobicContact CD1-CE1 3.91Å
282	S	98.1	Very high	98.5	Very high	72 Å²	72	42.1 Å²	42.1	50%	0.503	22%	0.222	S	C	.	.	H	α-helix	trans	-114.1	-6.8	175.9	56.8	0	0	0	0	114.1	D278 Q279 W280	D278-S282 VanDerWaalsContact O-CB 3.3Å; D278-S282 WeakPolarHBondContact O-CB 3.27Å; D278-S282 PolarHBondContact O-N 3.07Å; D278-S282 PolarHBondContact O-OG 3.26Å; Q279-S282 PolarHBondContact O-N 2.97Å; Q279-S282 PolarHBondContact O-OG 2.91Å; W280-S282 VanDerWaalsContact C-N 3.27Å; W280-S282 PolarHBondContact O-N 2.71Å
283	E	98.3	Very high	98.3	Very high	108 Å²	108	39.5 Å²	39.5	51%	0.505	21%	0.205	S	C	.	.	S	Bend	trans	-72.3	-30.3	175.2	-79.7	162.5	-169.5	0	0	113.9	Q279 H287	Q279-E283 PolarHBondContact NE2-OE1 2.91Å; Q279-E283 WeakPolarHBondContact O-CG 3.36Å; Q279-E283 PolarHBondContact O-N 3.3Å; E283-H287 IonicContact OE2-CE1 3.36Å
284	D	98.2	Very high	97.9	Very high	50 Å²	50	42.9 Å²	42.9	27%	0.267	22%	0.22	S	C	.	.			trans	-154.8	134.5	-179.8	-173.1	-25.3	0	0	0	109.6	H233 N286 H287	H233-D284 IonicContact CE1-OD2 3.79Å; H233-D284 PolarHBondContact CE1-OD2 2.92Å; H233-D284 IonicContact ND1-OD2 3.79Å; H233-D284 PolarHBondContact ND1-OD2 3.46Å; H233-D284 VanDerWaalsContact ND1-OD2 3.09Å; D284-N286 PolarHBondContact O-N 2.9Å; D284-N286 VanDerWaalsContact O-N 3.08Å; D284-N286 WeakPolarHBondContact OD1-CB 3.33Å; D284-N286 PolarHBondContact OD1-N 3.32Å; D284-N286 PolarHBondContact OD1-ND2 2.73Å; D284-H287 HydrophobicContact CB-CB 4.41Å; D284-H287 WeakPolarHBondContact O-CB 3.23Å; D284-H287 PolarHBondContact O-N 3.13Å
285	D	97.6	Very high	97.4	Very high	171 Å²	171	45 Å²	45	91%	0.914	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-22	175	-77.1	-37.7	0	0	0	113
286	N	97.9	Very high	96.9	Very high	102 Å²	102	41.2 Å²	41.2	55%	0.545	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-8.2	177.9	-56.3	-86.2	0	0	0	113.2	H233 D284	H233-N286 HydrophobicContact CB-CB 4.35Å; H233-N286 WeakPolarHBondContact CB-O 3.44Å; D284-N286 PolarHBondContact O-N 2.9Å; D284-N286 VanDerWaalsContact O-N 3.08Å; D284-N286 WeakPolarHBondContact OD1-CB 3.33Å; D284-N286 PolarHBondContact OD1-N 3.32Å; D284-N286 PolarHBondContact OD1-ND2 2.73Å
287	H	98.6	Very high	96.5	Very high	18 Å²	18	41.9 Å²	41.9	8%	0.083	22%	0.22	C	C	.	.			trans	-67.4	137.1	-177.8	-82	178.9	0	0	0	112.7	N200 H233 W280 L281 E283 D284	N200-H287 WeakPolarHBondContact CB-O 3.28Å; H233-H287 AromaticContact ND1-CD2 3.65Å; H233-H287 AromaticContact ND1-NE2 3.97Å; H233-H287 CarbonylContact O-C 3.55Å; H233-H287 WeakPolarHBondContact O-CA 3.35Å; W280-H287 AromaticContact CD2-ND1 3.75Å; W280-H287 AromaticContact CE2-CG 3.74Å; W280-H287 AromaticContact CE2-ND1 3.76Å; W280-H287 AromaticContact CE3-CE1 3.76Å; W280-H287 AromaticContact CE3-ND1 3.71Å; W280-H287 AromaticContact CH2-CD2 3.72Å; W280-H287 AromaticContact CH2-CE1 3.4Å; W280-H287 VanDerWaalsContact CH2-CE1 3.4Å; W280-H287 WeakPolarHBondContact CH2-CE1 3.41Å; W280-H287 AromaticContact CH2-CG 3.95Å; W280-H287 AromaticContact CH2-ND1 3.76Å; W280-H287 AromaticContact CH2-NE2 3.35Å; W280-H287 WeakPolarHBondContact CH2-NE2 3.16Å; W280-H287 HydrophobicContact CZ2-CB 4.18Å; W280-H287 AromaticContact CZ2-CD2 3.62Å; W280-H287 AromaticContact CZ2-CE1 3.89Å; W280-H287 AromaticContact CZ2-CG 3.62Å; W280-H287 AromaticContact CZ2-ND1 3.78Å; W280-H287 AromaticContact CZ2-NE2 3.79Å; W280-H287 AromaticContact CZ3-CE1 3.34Å; W280-H287 WeakPolarHBondContact CZ3-CE1 3.38Å; W280-H287 AromaticContact CZ3-ND1 3.73Å; W280-H287 AromaticContact CZ3-NE2 3.78Å; W280-H287 WeakPolarHBondContact O-CB 3.35Å; W280-H287 PolarHBondContact O-ND1 3.04Å; L281-H287 HydrophobicContact CD2-CB 4.38Å; L281-H287 VanDerWaalsContact CD2-O 3.27Å; L281-H287 WeakPolarHBondContact CD2-O 3.44Å; E283-H287 IonicContact OE2-CE1 3.36Å; D284-H287 HydrophobicContact CB-CB 4.41Å; D284-H287 WeakPolarHBondContact O-CB 3.23Å; D284-H287 PolarHBondContact O-N 3.13Å
288	V	98.8	Very high	96.4	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.03	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.8	-178.6	-178	0	0	0	0	110.1	N200 I202 H230 H233 Y234 K235 W280	N200-V288 HydrophobicContact CB-CG2 4.46Å; N200-V288 WeakPolarHBondContact O-CA 3.4Å; I202-V288 HydrophobicContact CD1-CG1 3.67Å; I202-V288 HydrophobicContact CG1-CG1 4Å; H230-V288 HydrophobicContact CB-CG2 4.42Å; H233-V288 PolarHBondContact O-N 2.92Å; Y234-V288 CarbonylContact C-O 3.59Å; Y234-V288 VanDerWaalsContact CA-O 3.28Å; Y234-V288 WeakPolarHBondContact CA-O 3.39Å; K235-V288 PolarHBondContact N-O 3.37Å; W280-V288 PolarHBondContact NE1-O 2.52Å
289	A	98.8	Very high	96.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134	173	0	0	0	0	0	110.7	N200 I202 K235 Y237 L277 L281 I291	N200-A289 PolarHBondContact O-N 3.36Å; I202-A289 PolarHBondContact N-O 3.27Å; K235-A289 WeakPolarHBondContact O-CA 3.14Å; Y237-A289 HydrophobicContact CD2-CB 4.11Å; Y237-A289 HydrophobicContact CE2-CB 3.73Å; L277-A289 HydrophobicContact CD1-CB 3.25Å; L281-A289 HydrophobicContact CD1-CB 4.26Å; L281-A289 HydrophobicContact CD2-CB 4.15Å; L281-A289 HydrophobicContact CG-CB 4.4Å; A289-I291 HydrophobicContact CB-CD1 3.8Å
290	A	98.7	Very high	96.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	97.3	174.4	0	0	0	0	0	110.6	I202 M204 L226 K235 I236 Y237	I202-A290 HydrophobicContact CB-CB 4.29Å; I202-A290 HydrophobicContact CG2-CB 4.43Å; M204-A290 HydrophobicContact CE-CB 3.91Å; M204-A290 HydrophobicContact SD-CB 4.2Å; L226-A290 HydrophobicContact CD1-CB 4.44Å; K235-A290 PolarHBondContact O-N 3.34Å; I236-A290 WeakPolarHBondContact CA-O 3.39Å; I236-A290 HydrophobicContact CD1-CB 3.9Å; Y237-A290 PolarHBondContact N-O 2.94Å
291	I	98.8	Very high	96.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.1	-176.3	-48.6	81.3	0	0	0	109.1	I201 I202 A203 M204 Y237 L239 F273 A289 T300 I304	I201-I291 HydrophobicContact CG2-CD1 3.79Å; I202-I291 WeakPolarHBondContact O-CD1 3.39Å; I202-I291 PolarHBondContact O-N 3.38Å; A203-I291 WeakPolarHBondContact CA-O 3.28Å; M204-I291 PolarHBondContact N-O 3.47Å; M204-I291 VanDerWaalsContact N-O 3.09Å; Y237-I291 HydrophobicContact CD2-CG1 4.29Å; Y237-I291 HydrophobicContact CG-CG1 4.37Å; L239-I291 HydrophobicContact CD1-CG2 3.76Å; L239-I291 HydrophobicContact CD2-CG2 4.47Å; L239-I291 HydrophobicContact CG-CG2 4.1Å; F273-I291 HydrophobicContact CE2-CG2 4.38Å; F273-I291 HydrophobicContact CZ-CG1 4.14Å; F273-I291 HydrophobicContact CZ-CG2 4.24Å; A289-I291 HydrophobicContact CB-CD1 3.8Å; I291-T300 HydrophobicContact CB-CG2 4.23Å; I291-T300 HydrophobicContact CG2-CG2 4.09Å; I291-T300 WeakPolarHBondContact O-CG2 3.27Å; I291-I304 HydrophobicContact CB-CD1 4.21Å; I291-I304 HydrophobicContact CB-CG1 4.35Å; I291-I304 HydrophobicContact CD1-CD1 4.19Å; I291-I304 HydrophobicContact CD1-CG1 4.22Å; I291-I304 HydrophobicContact CG1-CD1 4.45Å; I291-I304 HydrophobicContact CG1-CG1 4.27Å
292	H	97.8	Very high	96.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.7	-177.4	82.2	85.1	0	0	0	114	M204 F206 Y237 N238 L239 Y245	M204-H292 HydrophobicContact CE-CB 4Å; M204-H292 HydrophobicContact CG-CB 3.6Å; M204-H292 WeakPolarHBondContact O-CA 3.43Å; M204-H292 VanDerWaalsContact O-CB 3.23Å; M204-H292 WeakPolarHBondContact O-CB 3.37Å; F206-H292 AromaticContact CD2-CE1 3Å; F206-H292 WeakPolarHBondContact CD2-CE1 3.25Å; F206-H292 AromaticContact CD2-ND1 3.75Å; F206-H292 AromaticContact CE2-CE1 3.18Å; F206-H292 WeakPolarHBondContact CE2-CE1 3.25Å; Y237-H292 PolarHBondContact O-CD2 3.29Å; Y237-H292 PolarHBondContact O-N 2.67Å; N238-H292 WeakPolarHBondContact CA-NE2 3.01Å; N238-H292 WeakPolarHBondContact CB-NE2 3.47Å; N238-H292 PolarHBondContact OD1-CE1 2.97Å; L239-H292 WeakPolarHBondContact CB-O 3.43Å; L239-H292 WeakPolarHBondContact CG-O 3.49Å; L239-H292 PolarHBondContact N-O 3.09Å; Y245-H292 AromaticContact CE1-CE1 3.27Å; Y245-H292 WeakPolarHBondContact CE1-CE1 3.33Å; Y245-H292 AromaticContact CE1-NE2 2.98Å; Y245-H292 WeakPolarHBondContact CE1-NE2 3.26Å; Y245-H292 AromaticContact CZ-NE2 2.83Å; Y245-H292 PolarHBondContact OH-NE2 3.05Å
293	C	94.1	Very high	96.4	Very high	4 Å²	4	30.9 Å²	30.9	3%	0.027	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	-172.7	161.7	75.1	0	0	0	0	107.9	F206 L239 A295 G296 R299 T300	F206-C293 PolarHBondContact N-O 2.92Å; L239-C293 HydrophobicContact CB-CB 4.24Å; C293-A295 PolarHBondContact O-N 3.34Å; C293-G296 PolarHBondContact O-N 3.22Å; C293-G296 PolarHBondContact SG-N 3.31Å; C293-G296 VanDerWaalsContact SG-N 3.39Å; C293-R299 HydrophobicContact CB-CB 4.03Å; C293-T300 PolarHBondContact N-OG1 2.9Å; C293-T300 PolarHBondContact SG-OG1 2.95Å
294	K	90.1	Very high	96.4	Very high	72 Å²	72	25.8 Å²	25.8	31%	0.313	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-41.8	-35	177.1	-169	177.4	-177.6	178.5	0	115.7	R216 C240 D261	R216-K294 PolarHBondContact NE-O 2.99Å; C240-K294 PolarHBondContact SG-N 3.27Å; D261-K294 WeakPolarHBondContact OD2-CD 3.49Å; D261-K294 IonicContact OD2-NZ 3.65Å
295	A	87.4	Confident	96.4	Very high	43 Å²	43	23.4 Å²	23.4	36%	0.355	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.7	5	-177.6	0	0	0	0	0	115.1	K182 C293 K297	K182-A295 WeakPolarHBondContact CD-O 3.34Å; K182-A295 PolarHBondContact NZ-O 3.32Å; C293-A295 PolarHBondContact O-N 3.34Å; A295-K297 PolarHBondContact O-N 3.08Å
296	G	89.4	Confident	96.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	56.3	42.3	177.5	0	0	0	0	0	115	M204 C293 Y324 R328	M204-G296 WeakPolarHBondContact O-CA 3.22Å; C293-G296 PolarHBondContact O-N 3.22Å; C293-G296 PolarHBondContact SG-N 3.31Å; C293-G296 VanDerWaalsContact SG-N 3.39Å; G296-Y324 PolarHBondContact O-OH 3.16Å; G296-R328 PolarHBondContact O-NE 3.16Å; G296-R328 PolarHBondContact O-NH2 3.36Å
297	K	91.2	Very high	96.5	Very high	59 Å²	59	11 Å²	11	26%	0.257	6%	0.061	S	C	.	.	S	Bend	trans	-134.4	-89.2	-170.5	-177.1	170.5	173	145.9	0	113.2	A295 G301 Y324 K333 G334	A295-K297 PolarHBondContact O-N 3.08Å; K297-G301 WeakPolarHBondContact O-CA 3.47Å; K297-G301 PolarHBondContact O-N 3.06Å; K297-Y324 PolarHBondContact O-OH 2.76Å; K297-K333 WeakPolarHBondContact CE-O 3.17Å; K297-K333 PolarHBondContact NZ-O 3.32Å; K297-G334 VanDerWaalsContact CE-O 3.29Å; K297-G334 WeakPolarHBondContact CE-O 3.37Å
298	G	95.8	Very high	96.6	Very high	16 Å²	16	10.2 Å²	10.2	17%	0.165	6%	0.058	C	C	.	.	H	α-helix	trans	-63.8	-67.9	-173	0	0	0	0	0	112.8	T300 G301 V302 Q340	G298-T300 PolarHBondContact O-N 3.38Å; G298-G301 PolarHBondContact O-N 3.03Å; G298-G301 VanDerWaalsContact O-N 3.08Å; G298-V302 PolarHBondContact O-N 2.88Å; G298-Q340 VanDerWaalsContact CA-OE1 3.3Å
299	R	97.7	Very high	96.6	Very high	1 Å²	1	10.6 Å²	10.6	0%	0.004	6%	0.059	C	C	.	.	H	α-helix	trans	-53.3	-49.7	179	-63.4	-172.5	-90.6	171.2	0.8	112.5	L239 E242 F259 D261 C293 G301 V302 M303	L239-R299 HydrophobicContact CD1-CB 4.37Å; L239-R299 PolarHBondContact O-NH1 3.21Å; E242-R299 IonicContact OE1-CZ 3.79Å; E242-R299 IonicContact OE1-NH1 2.7Å; E242-R299 IonicContact OE1-NH2 2.85Å; E242-R299 PolarHBondContact OE1-NH2 3.23Å; E242-R299 IonicContact OE2-CZ 2.74Å; E242-R299 IonicContact OE2-NH1 3.52Å; E242-R299 PolarHBondContact OE2-NH1 3.08Å; E242-R299 IonicContact OE2-NH2 3.58Å; E242-R299 PolarHBondContact OE2-NH2 3.33Å; F259-R299 HydrophobicContact CD2-CG 3.93Å; F259-R299 HydrophobicContact CE1-CB 4.16Å; F259-R299 HydrophobicContact CE2-CB 3.69Å; F259-R299 HydrophobicContact CE2-CG 3.43Å; F259-R299 VanDerWaalsContact CE2-CG 3.43Å; F259-R299 HydrophobicContact CZ-CB 3.49Å; F259-R299 VanDerWaalsContact CZ-CB 3.49Å; F259-R299 HydrophobicContact CZ-CG 3.81Å; F259-R299 WeakPolarHBondContact O-CD 3.31Å; F259-R299 PolarHBondContact O-NH1 3.2Å; D261-R299 IonicContact OD1-CZ 3.41Å; D261-R299 IonicContact OD1-NE 3.5Å; D261-R299 PolarHBondContact OD1-NE 3.07Å; D261-R299 IonicContact OD1-NH2 2.71Å; D261-R299 PolarHBondContact OD1-NH2 3.49Å; D261-R299 IonicContact OD2-NH2 3.26Å; C293-R299 HydrophobicContact CB-CB 4.03Å; R299-G301 VanDerWaalsContact C-N 3.33Å; R299-G301 PolarHBondContact O-N 3.21Å; R299-V302 PolarHBondContact O-N 3.49Å; R299-M303 PolarHBondContact O-N 3.49Å
300	T	98.4	Very high	96.6	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-56.9	-42.1	175.8	-52.1	0	0	0	0	113	A203 I291 C293 G298 I304	A203-T300 HydrophobicContact CB-CG2 3.8Å; I291-T300 HydrophobicContact CB-CG2 4.23Å; I291-T300 HydrophobicContact CG2-CG2 4.09Å; I291-T300 WeakPolarHBondContact O-CG2 3.27Å; C293-T300 PolarHBondContact N-OG1 2.9Å; C293-T300 PolarHBondContact SG-OG1 2.95Å; G298-T300 PolarHBondContact O-N 3.38Å; T300-I304 HydrophobicContact CG2-CD1 3.77Å; T300-I304 WeakPolarHBondContact O-CB 3.48Å; T300-I304 WeakPolarHBondContact O-CG1 3.36Å; T300-I304 PolarHBondContact O-N 3.36Å
301	G	98.5	Very high	96.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-67	-39.2	178.3	0	0	0	0	0	113.4	K297 G298 R299 M303 I304 C305 Y324	K297-G301 WeakPolarHBondContact O-CA 3.47Å; K297-G301 PolarHBondContact O-N 3.06Å; G298-G301 PolarHBondContact O-N 3.03Å; G298-G301 VanDerWaalsContact O-N 3.08Å; R299-G301 VanDerWaalsContact C-N 3.33Å; R299-G301 PolarHBondContact O-N 3.21Å; G301-M303 PolarHBondContact O-N 3.38Å; G301-I304 PolarHBondContact O-N 3.22Å; G301-C305 VanDerWaalsContact O-CB 3.27Å; G301-C305 WeakPolarHBondContact O-CB 3.43Å; G301-C305 PolarHBondContact O-N 3.08Å; G301-C305 PolarHBondContact O-SG 3.45Å; G301-Y324 PolarHBondContact N-OH 2.85Å
302	V	98.8	Very high	96.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-56.7	-53.4	175.7	176.7	0	0	0	0	110.6	P265 G298 R299 I304 C305 A306 V335 Q340 V344	P265-V302 HydrophobicContact CG-CG1 4Å; G298-V302 PolarHBondContact O-N 2.88Å; R299-V302 PolarHBondContact O-N 3.49Å; V302-I304 PolarHBondContact O-N 2.82Å; V302-C305 PolarHBondContact O-N 2.86Å; V302-A306 WeakPolarHBondContact O-CB 3.38Å; V302-A306 PolarHBondContact O-N 2.85Å; V302-V335 HydrophobicContact CG2-CG1 4Å; V302-Q340 HydrophobicContact CG2-CB 3.6Å; V302-Q340 HydrophobicContact CG2-CG 4.07Å; V302-Q340 WeakPolarHBondContact CG2-O 3.42Å; V302-V344 HydrophobicContact CB-CG2 4.28Å; V302-V344 HydrophobicContact CG1-CG2 3.91Å; V302-V344 HydrophobicContact CG2-CG2 4.44Å
303	M	98.9	Very high	96.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.2	-38.4	-175.1	-51.4	-51.5	-69.2	0	0	112.1	L239 F259 P265 F273 R299 G301 Y307	L239-M303 HydrophobicContact CD1-CB 4.16Å; L239-M303 HydrophobicContact CD1-CG 3.58Å; L239-M303 HydrophobicContact CD2-CG 3.95Å; L239-M303 HydrophobicContact CG-CG 4.42Å; F259-M303 HydrophobicContact CE1-CG 3.81Å; F259-M303 HydrophobicContact CE1-SD 3.7Å; F259-M303 HydrophobicContact CZ-CG 4.06Å; F259-M303 HydrophobicContact CZ-SD 3.92Å; P265-M303 HydrophobicContact CB-SD 4.11Å; P265-M303 HydrophobicContact CG-SD 3.93Å; F273-M303 HydrophobicContact CB-CE 3.53Å; F273-M303 HydrophobicContact CD1-CB 3.93Å; F273-M303 HydrophobicContact CD1-CE 3.71Å; F273-M303 HydrophobicContact CD2-CE 4.02Å; F273-M303 HydrophobicContact CE1-CB 3.53Å; F273-M303 HydrophobicContact CE1-CE 4.49Å; F273-M303 WeakPolarHBondContact CE1-O 3.47Å; F273-M303 HydrophobicContact CE2-CB 4.16Å; F273-M303 HydrophobicContact CG-CB 4.43Å; F273-M303 HydrophobicContact CG-CE 3.45Å; F273-M303 VanDerWaalsContact CG-CE 3.45Å; F273-M303 HydrophobicContact CZ-CB 3.65Å; R299-M303 PolarHBondContact O-N 3.49Å; G301-M303 PolarHBondContact O-N 3.38Å; M303-Y307 PolarHBondContact O-N 2.61Å
304	I	98.9	Very high	96.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68	-43.6	175.3	-69.7	176.3	0	0	0	111.5	I197 I201 A203 I291 T300 G301 V302 A306 Y307 L308 Y324	I197-I304 HydrophobicContact CG1-CD1 4.17Å; I197-I304 HydrophobicContact CG2-CG2 4.05Å; I201-I304 HydrophobicContact CG2-CD1 4.11Å; I201-I304 HydrophobicContact CG2-CG1 4.25Å; I201-I304 HydrophobicContact CG2-CG2 4.31Å; A203-I304 HydrophobicContact CB-CD1 3.78Å; I291-I304 HydrophobicContact CB-CD1 4.21Å; I291-I304 HydrophobicContact CB-CG1 4.35Å; I291-I304 HydrophobicContact CD1-CD1 4.19Å; I291-I304 HydrophobicContact CD1-CG1 4.22Å; I291-I304 HydrophobicContact CG1-CD1 4.45Å; I291-I304 HydrophobicContact CG1-CG1 4.27Å; T300-I304 HydrophobicContact CG2-CD1 3.77Å; T300-I304 WeakPolarHBondContact O-CB 3.48Å; T300-I304 WeakPolarHBondContact O-CG1 3.36Å; T300-I304 PolarHBondContact O-N 3.36Å; G301-I304 PolarHBondContact O-N 3.22Å; V302-I304 PolarHBondContact O-N 2.82Å; I304-A306 VanDerWaalsContact C-N 3.34Å; I304-A306 PolarHBondContact O-N 3.2Å; I304-Y307 PolarHBondContact O-N 3.5Å; I304-L308 HydrophobicContact CG2-CD1 3.79Å; I304-L308 HydrophobicContact CG2-CG 4.29Å; I304-L308 VanDerWaalsContact O-CG 3.26Å; I304-L308 WeakPolarHBondContact O-CG 3.12Å; I304-L308 PolarHBondContact O-N 3.18Å; I304-Y324 HydrophobicContact CB-CD2 4.47Å; I304-Y324 HydrophobicContact CD1-CE2 4.12Å; I304-Y324 HydrophobicContact CG2-CD2 4.14Å
305	C	98.9	Very high	96.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-42.4	177.7	-64.8	0	0	0	0	111.2	G301 V302 Y307 L308 L309 A320 V344	G301-C305 VanDerWaalsContact O-CB 3.27Å; G301-C305 WeakPolarHBondContact O-CB 3.43Å; G301-C305 PolarHBondContact O-N 3.08Å; G301-C305 PolarHBondContact O-SG 3.45Å; V302-C305 PolarHBondContact O-N 2.86Å; C305-Y307 PolarHBondContact O-N 2.99Å; C305-L308 PolarHBondContact O-N 2.95Å; C305-L309 VanDerWaalsContact O-CG 3.31Å; C305-L309 WeakPolarHBondContact O-CG 3.38Å; C305-L309 PolarHBondContact O-N 3.39Å; C305-A320 HydrophobicContact CB-CB 4.06Å; C305-A320 PolarHBondContact SG-O 2.88Å; C305-A320 VanDerWaalsContact SG-O 3.4Å; C305-V344 HydrophobicContact CB-CG1 3.73Å; C305-V344 HydrophobicContact CB-CG2 4.11Å
306	A	98.9	Very high	97.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.4	-45.5	174.6	0	0	0	0	0	112.4	I270 V302 I304 L309 H310 Y347	I270-A306 HydrophobicContact CG2-CB 3.43Å; I270-A306 VanDerWaalsContact CG2-CB 3.43Å; V302-A306 WeakPolarHBondContact O-CB 3.38Å; V302-A306 PolarHBondContact O-N 2.85Å; I304-A306 VanDerWaalsContact C-N 3.34Å; I304-A306 PolarHBondContact O-N 3.2Å; A306-L309 PolarHBondContact O-N 3.13Å; A306-H310 WeakPolarHBondContact O-CB 3.36Å; A306-H310 PolarHBondContact O-N 3.39Å; A306-Y347 HydrophobicContact CB-CD1 3.65Å; A306-Y347 HydrophobicContact CB-CE1 4.09Å; A306-Y347 HydrophobicContact CB-CG 4.38Å
307	Y	98.9	Very high	97.7	Very high	13 Å²	13	33.6 Å²	33.6	5%	0.051	17%	0.169	C	C	.	.	H	α-helix	trans	-65	-38.2	176.2	176	-111.3	0	0	0	113.4	I201 C274 L277 D278 L281 M303 I304 C305 L309 H310 R311	I201-Y307 HydrophobicContact CD1-CD1 3.94Å; I201-Y307 HydrophobicContact CD1-CE1 3.7Å; C274-Y307 HydrophobicContact CB-CD2 4.25Å; L277-Y307 HydrophobicContact CB-CD2 4.09Å; L277-Y307 HydrophobicContact CB-CE2 4.12Å; L277-Y307 HydrophobicContact CD2-CD1 3.53Å; L277-Y307 HydrophobicContact CD2-CD2 3.8Å; L277-Y307 HydrophobicContact CD2-CE1 3.99Å; L277-Y307 HydrophobicContact CD2-CE2 4.24Å; L277-Y307 HydrophobicContact CD2-CG 3.42Å; L277-Y307 VanDerWaalsContact CD2-CG 3.42Å; L277-Y307 HydrophobicContact CG-CD1 4.04Å; L277-Y307 HydrophobicContact CG-CD2 3.88Å; L277-Y307 HydrophobicContact CG-CE1 3.98Å; L277-Y307 HydrophobicContact CG-CE2 3.85Å; L277-Y307 HydrophobicContact CG-CG 3.98Å; D278-Y307 HydrophobicContact CB-CE2 3.91Å; L281-Y307 HydrophobicContact CD1-CE1 3.91Å; M303-Y307 PolarHBondContact O-N 2.61Å; I304-Y307 PolarHBondContact O-N 3.5Å; C305-Y307 PolarHBondContact O-N 2.99Å; Y307-L309 VanDerWaalsContact C-N 3.29Å; Y307-L309 PolarHBondContact O-N 3.4Å; Y307-H310 WeakPolarHBondContact O-CB 3.39Å; Y307-H310 PolarHBondContact O-N 3.09Å; Y307-R311 HydrophobicContact CD2-CG 4.14Å; Y307-R311 HydrophobicContact CE1-CG 4.4Å; Y307-R311 HydrophobicContact CE2-CG 3.53Å; Y307-R311 PolarHBondContact O-N 3.38Å
308	L	98.9	Very high	98	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-67.5	-30.5	177.4	-68.4	172	0	0	0	112.5	I197 Y198 I201 I304 C305 G312 K313 F314 F323	I197-L308 HydrophobicContact CG2-CD1 4.33Å; Y198-L308 HydrophobicContact CD2-CD1 4.39Å; Y198-L308 HydrophobicContact CD2-CD2 3.67Å; Y198-L308 HydrophobicContact CE2-CD1 3.95Å; Y198-L308 HydrophobicContact CE2-CD2 3.36Å; Y198-L308 HydrophobicContact CE2-CG 4.31Å; I201-L308 HydrophobicContact CD1-CD2 3.93Å; I304-L308 HydrophobicContact CG2-CD1 3.79Å; I304-L308 HydrophobicContact CG2-CG 4.29Å; I304-L308 VanDerWaalsContact O-CG 3.26Å; I304-L308 WeakPolarHBondContact O-CG 3.12Å; I304-L308 PolarHBondContact O-N 3.18Å; C305-L308 PolarHBondContact O-N 2.95Å; L308-G312 PolarHBondContact O-N 3.13Å; L308-K313 HydrophobicContact CB-CB 4.33Å; L308-K313 HydrophobicContact CD2-CB 4.14Å; L308-K313 HydrophobicContact CD2-CG 3.98Å; L308-K313 WeakPolarHBondContact O-CB 3.41Å; L308-K313 PolarHBondContact O-N 2.95Å; L308-F314 HydrophobicContact CB-CD2 4.06Å; L308-F314 HydrophobicContact CB-CE2 4.45Å; L308-F314 HydrophobicContact CD1-CE2 4.25Å; L308-F323 HydrophobicContact CD1-CD1 4.32Å; L308-F323 HydrophobicContact CD1-CE1 4.3Å
309	L	98.8	Very high	98.1	Very high	12 Å²	12	36.1 Å²	36.1	6%	0.063	18%	0.178	C	C	.	.	H	α-helix	trans	-71.7	-45.4	168.8	-63.7	161.7	0	0	0	111.3	C305 A306 Y307 R311 G312 F314 A317 A320 V344 L351	C305-L309 VanDerWaalsContact O-CG 3.31Å; C305-L309 WeakPolarHBondContact O-CG 3.38Å; C305-L309 PolarHBondContact O-N 3.39Å; A306-L309 PolarHBondContact O-N 3.13Å; Y307-L309 VanDerWaalsContact C-N 3.29Å; Y307-L309 PolarHBondContact O-N 3.4Å; L309-R311 PolarHBondContact O-N 2.96Å; L309-G312 PolarHBondContact O-N 3.44Å; L309-F314 HydrophobicContact CD2-CB 4.15Å; L309-A317 HydrophobicContact CD1-CB 4.44Å; L309-A320 HydrophobicContact CD2-CB 4.29Å; L309-A320 HydrophobicContact CG-CB 4.22Å; L309-V344 HydrophobicContact CD1-CG1 3.6Å; L309-L351 HydrophobicContact CB-CD1 3.76Å
310	H	98.7	Very high	98.2	Very high	50 Å²	50	36.1 Å²	36.1	23%	0.231	18%	0.178	C	C	.	.	H	α-helix	trans	-53.7	-38.5	177.3	-171.5	101.5	0	0	0	112.3	C274 A306 Y307 Y347 L351	C274-H310 HydrophobicContact CB-CB 4.04Å; A306-H310 WeakPolarHBondContact O-CB 3.36Å; A306-H310 PolarHBondContact O-N 3.39Å; Y307-H310 WeakPolarHBondContact O-CB 3.39Å; Y307-H310 PolarHBondContact O-N 3.09Å; H310-Y347 HydrophobicContact CB-CE1 4.19Å; H310-Y347 AromaticContact ND1-CZ 3.96Å; H310-Y347 PolarHBondContact ND1-OH 2.88Å; H310-L351 HydrophobicContact CB-CD1 4.44Å
311	R	98.2	Very high	98.2	Very high	113 Å²	113	36.3 Å²	36.3	43%	0.426	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	16.5	178	-63.5	-66.5	-78.4	172.9	-7.2	114.6	D278 Y307 L309 K313	D278-R311 VanDerWaalsContact CG-NE 3.28Å; D278-R311 WeakPolarHBondContact OD1-CD 3.33Å; D278-R311 IonicContact OD1-CZ 2.78Å; D278-R311 IonicContact OD1-NE 2.83Å; D278-R311 PolarHBondContact OD1-NE 2.95Å; D278-R311 IonicContact OD1-NH1 2.67Å; D278-R311 PolarHBondContact OD1-NH1 3.04Å; D278-R311 IonicContact OD1-NH2 2.7Å; D278-R311 PolarHBondContact OD1-NH2 3.16Å; D278-R311 VanDerWaalsContact OD2-CD 3.22Å; D278-R311 WeakPolarHBondContact OD2-CD 3.48Å; D278-R311 IonicContact OD2-CZ 2.66Å; D278-R311 IonicContact OD2-NE 3.01Å; D278-R311 PolarHBondContact OD2-NE 3Å; D278-R311 IonicContact OD2-NH1 3.09Å; D278-R311 PolarHBondContact OD2-NH1 2.96Å; D278-R311 IonicContact OD2-NH2 3.08Å; Y307-R311 HydrophobicContact CD2-CG 4.14Å; Y307-R311 HydrophobicContact CE1-CG 4.4Å; Y307-R311 HydrophobicContact CE2-CG 3.53Å; Y307-R311 PolarHBondContact O-N 3.38Å; L309-R311 PolarHBondContact O-N 2.96Å; R311-K313 HydrophobicContact CB-CG 4.39Å; R311-K313 PolarHBondContact O-N 3.49Å; R311-K313 VanDerWaalsContact O-N 3.09Å
312	G	97.9	Very high	98.2	Very high	50 Å²	50	39.8 Å²	39.8	52%	0.515	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	26.4	175.5	0	0	0	0	0	114.6	L308 L309 F314	L308-G312 PolarHBondContact O-N 3.13Å; L309-G312 PolarHBondContact O-N 3.44Å; G312-F314 VanDerWaalsContact C-N 3.3Å
313	K	98.3	Very high	98.1	Very high	122 Å²	122	42.4 Å²	42.4	53%	0.53	21%	0.209	S	C	.	.	S	Bend	trans	-75.3	-25.6	176	-58	-51.1	-172.4	-167.7	0	111.9	L308 R311	L308-K313 HydrophobicContact CB-CB 4.33Å; L308-K313 HydrophobicContact CD2-CB 4.14Å; L308-K313 HydrophobicContact CD2-CG 3.98Å; L308-K313 WeakPolarHBondContact O-CB 3.41Å; L308-K313 PolarHBondContact O-N 2.95Å; R311-K313 HydrophobicContact CB-CG 4.39Å; R311-K313 PolarHBondContact O-N 3.49Å; R311-K313 VanDerWaalsContact O-N 3.09Å
314	F	98.2	Very high	98.1	Very high	38 Å²	38	42.4 Å²	42.4	17%	0.167	21%	0.209	C	C	.	.			trans	-134.2	154.5	168.7	-63.5	-75.8	0	0	0	108.5	L308 L309 G312 E319 A320 F323	L308-F314 HydrophobicContact CB-CD2 4.06Å; L308-F314 HydrophobicContact CB-CE2 4.45Å; L308-F314 HydrophobicContact CD1-CE2 4.25Å; L309-F314 HydrophobicContact CD2-CB 4.15Å; G312-F314 VanDerWaalsContact C-N 3.3Å; F314-E319 HydrophobicContact CB-CB 4.15Å; F314-E319 HydrophobicContact CD1-CB 3.6Å; F314-E319 HydrophobicContact CE1-CB 4.41Å; F314-E319 HydrophobicContact CG-CB 4.14Å; F314-A320 HydrophobicContact CB-CB 4.07Å; F314-A320 HydrophobicContact CD2-CB 3.79Å; F314-A320 HydrophobicContact CG-CB 4.04Å; F314-F323 HydrophobicContact CE1-CB 4.11Å; F314-F323 HydrophobicContact CE1-CG 4.31Å; F314-F323 HydrophobicContact CE2-CB 4.14Å; F314-F323 AromaticContact CE2-CD1 3.63Å; F314-F323 HydrophobicContact CE2-CD1 3.63Å; F314-F323 HydrophobicContact CE2-CE1 4.2Å; F314-F323 AromaticContact CE2-CG 3.9Å; F314-F323 HydrophobicContact CE2-CG 3.9Å; F314-F323 HydrophobicContact CZ-CB 3.59Å; F314-F323 AromaticContact CZ-CD1 3.62Å; F314-F323 HydrophobicContact CZ-CD1 3.62Å; F314-F323 AromaticContact CZ-CD2 3.85Å; F314-F323 HydrophobicContact CZ-CD2 3.85Å; F314-F323 HydrophobicContact CZ-CE1 4.24Å; F314-F323 HydrophobicContact CZ-CE2 4.44Å; F314-F323 AromaticContact CZ-CG 3.39Å; F314-F323 HydrophobicContact CZ-CG 3.39Å
315	L	94.2	Very high	98	Very high	144 Å²	144	42.4 Å²	42.4	75%	0.754	21%	0.209	S	C	*	.	S	Bend	trans	-102	-19.2	178.1	-62.3	-179.3	0	0	0	112	E319	L315-E319 PolarHBondContact N-OE2 3.18Å; L315-E319 VanDerWaalsContact N-OE2 3.11Å
316	K	96.4	Very high	97.9	Very high	83 Å²	83	46.3 Å²	46.3	36%	0.361	23%	0.227	S	C	.	.	S	Bend	trans	-125	141.2	179.6	-57.6	176.2	-176	165.3	0	111.9	Q318 E319 A320 C465	K316-Q318 PolarHBondContact O-N 2.84Å; K316-E319 HydrophobicContact CB-CG 4.04Å; K316-E319 WeakPolarHBondContact CD-OE1 3.13Å; K316-E319 PolarHBondContact N-OE2 3.05Å; K316-E319 WeakPolarHBondContact O-CB 3.24Å; K316-E319 PolarHBondContact O-N 2.95Å; K316-E319 VanDerWaalsContact O-N 3.09Å; K316-A320 PolarHBondContact O-N 3.34Å; K316-C465 PolarHBondContact NZ-SG 2.85Å
317	A	97.4	Very high	97.8	Very high	2 Å²	2	48 Å²	48	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-50.5	-41.3	175.2	0	0	0	0	0	113.2	L309 E319 A320 L321 V344 Y345 S348	L309-A317 HydrophobicContact CD1-CB 4.44Å; A317-E319 PolarHBondContact O-N 2.75Å; A317-A320 PolarHBondContact O-N 2.74Å; A317-L321 HydrophobicContact CB-CD1 4.45Å; A317-L321 WeakPolarHBondContact O-CB 3.4Å; A317-L321 WeakPolarHBondContact O-CD1 3.49Å; A317-L321 WeakPolarHBondContact O-CG 3.38Å; A317-L321 PolarHBondContact O-N 2.66Å; A317-V344 HydrophobicContact CB-CG1 4.01Å; A317-Y345 HydrophobicContact CB-CD1 3.81Å; A317-Y345 HydrophobicContact CB-CD2 3.73Å; A317-Y345 HydrophobicContact CB-CE1 4.05Å; A317-Y345 HydrophobicContact CB-CE2 3.98Å; A317-Y345 HydrophobicContact CB-CG 3.67Å; A317-S348 PolarHBondContact N-OG 3.41Å
318	Q	97.6	Very high	97.7	Very high	53 Å²	53	47.4 Å²	47.4	25%	0.248	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-40	-179.6	-175.7	53.2	15.8	0	0	113.3	K316 L321 D322	K316-Q318 PolarHBondContact O-N 2.84Å; Q318-L321 PolarHBondContact O-N 2.92Å; Q318-D322 PolarHBondContact NE2-OD1 3.42Å; Q318-D322 PolarHBondContact NE2-OD2 3.45Å; Q318-D322 WeakPolarHBondContact O-CB 3.37Å; Q318-D322 PolarHBondContact O-N 3.26Å
319	E	98.2	Very high	97.3	Very high	76 Å²	76	47.3 Å²	47.3	36%	0.355	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-46.1	179.3	-60.2	161.4	174.6	0	0	110.7	F314 L315 K316 A317 F323	F314-E319 HydrophobicContact CB-CB 4.15Å; F314-E319 HydrophobicContact CD1-CB 3.6Å; F314-E319 HydrophobicContact CE1-CB 4.41Å; F314-E319 HydrophobicContact CG-CB 4.14Å; L315-E319 PolarHBondContact N-OE2 3.18Å; L315-E319 VanDerWaalsContact N-OE2 3.11Å; K316-E319 HydrophobicContact CB-CG 4.04Å; K316-E319 WeakPolarHBondContact CD-OE1 3.13Å; K316-E319 PolarHBondContact N-OE2 3.05Å; K316-E319 WeakPolarHBondContact O-CB 3.24Å; K316-E319 PolarHBondContact O-N 2.95Å; K316-E319 VanDerWaalsContact O-N 3.09Å; A317-E319 PolarHBondContact O-N 2.75Å; E319-F323 VanDerWaalsContact O-CB 3.24Å; E319-F323 WeakPolarHBondContact O-CB 3.48Å; E319-F323 PolarHBondContact O-N 2.82Å
320	A	98.6	Very high	96.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-42.1	177	0	0	0	0	0	112.3	C305 L309 F314 K316 A317 Y324	C305-A320 HydrophobicContact CB-CB 4.06Å; C305-A320 PolarHBondContact SG-O 2.88Å; C305-A320 VanDerWaalsContact SG-O 3.4Å; L309-A320 HydrophobicContact CD2-CB 4.29Å; L309-A320 HydrophobicContact CG-CB 4.22Å; F314-A320 HydrophobicContact CB-CB 4.07Å; F314-A320 HydrophobicContact CD2-CB 3.79Å; F314-A320 HydrophobicContact CG-CB 4.04Å; K316-A320 PolarHBondContact O-N 3.34Å; A317-A320 PolarHBondContact O-N 2.74Å; A320-Y324 WeakPolarHBondContact O-CB 3.38Å; A320-Y324 PolarHBondContact O-N 3.18Å
321	L	98.4	Very high	96.4	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-43.7	178.8	-75.4	165.9	0	0	0	112.2	A317 Q318 G325 V335 R341 V344 Y345	A317-L321 HydrophobicContact CB-CD1 4.45Å; A317-L321 WeakPolarHBondContact O-CB 3.4Å; A317-L321 WeakPolarHBondContact O-CD1 3.49Å; A317-L321 WeakPolarHBondContact O-CG 3.38Å; A317-L321 PolarHBondContact O-N 2.66Å; Q318-L321 PolarHBondContact O-N 2.92Å; L321-G325 PolarHBondContact O-N 2.83Å; L321-V335 HydrophobicContact CD2-CB 3.79Å; L321-V335 HydrophobicContact CD2-CG1 4.28Å; L321-V335 HydrophobicContact CD2-CG2 4.05Å; L321-R341 HydrophobicContact CD1-CB 4.25Å; L321-R341 HydrophobicContact CD1-CG 4.33Å; L321-R341 HydrophobicContact CD2-CG 4.31Å; L321-V344 HydrophobicContact CD1-CB 4.42Å; L321-V344 HydrophobicContact CD1-CG1 4.44Å; L321-V344 HydrophobicContact CD2-CB 4.32Å; L321-V344 HydrophobicContact CD2-CG1 4.41Å; L321-V344 HydrophobicContact CD2-CG2 4.06Å; L321-V344 HydrophobicContact CG-CB 4.48Å; L321-V344 HydrophobicContact CG-CG1 4.21Å; L321-Y345 HydrophobicContact CD1-CD2 4.18Å; L321-Y345 HydrophobicContact CD1-CE2 3.85Å
322	D	98.2	Very high	96.1	Very high	74 Å²	74	54.6 Å²	54.6	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-72.4	-44.4	179	-74.4	-7.9	0	0	0	111.2	Q318 Y324 G325 E326	Q318-D322 PolarHBondContact NE2-OD1 3.42Å; Q318-D322 PolarHBondContact NE2-OD2 3.45Å; Q318-D322 WeakPolarHBondContact O-CB 3.37Å; Q318-D322 PolarHBondContact O-N 3.26Å; D322-Y324 PolarHBondContact O-N 2.84Å; D322-G325 CarbonylContact O-C 3.56Å; D322-G325 WeakPolarHBondContact O-CA 3.4Å; D322-G325 PolarHBondContact O-N 2.96Å; D322-E326 WeakPolarHBondContact O-CG 3.47Å; D322-E326 PolarHBondContact O-N 3.03Å
323	F	98.6	Very high	95.8	Very high	54 Å²	54	57.8 Å²	57.8	24%	0.237	27%	0.266	C	S	.	.	H	α-helix	trans	-56.1	-48.1	173.8	171.2	-99.8	0	0	0	111.9	I197 Y198 L308 F314 E319 G325 E326 V327	I197-F323 HydrophobicContact CG2-CD1 4.43Å; I197-F323 HydrophobicContact CG2-CE1 3.72Å; Y198-F323 HydrophobicContact CD2-CE1 4.1Å; Y198-F323 HydrophobicContact CD2-CZ 4.34Å; Y198-F323 HydrophobicContact CE2-CD1 4.46Å; Y198-F323 AromaticContact CE2-CE1 3.44Å; Y198-F323 HydrophobicContact CE2-CE1 3.44Å; Y198-F323 VanDerWaalsContact CE2-CE1 3.44Å; Y198-F323 AromaticContact CE2-CZ 3.71Å; Y198-F323 HydrophobicContact CE2-CZ 3.71Å; Y198-F323 AromaticContact CZ-CZ 3.94Å; L308-F323 HydrophobicContact CD1-CD1 4.32Å; L308-F323 HydrophobicContact CD1-CE1 4.3Å; F314-F323 HydrophobicContact CE1-CB 4.11Å; F314-F323 HydrophobicContact CE1-CG 4.31Å; F314-F323 HydrophobicContact CE2-CB 4.14Å; F314-F323 AromaticContact CE2-CD1 3.63Å; F314-F323 HydrophobicContact CE2-CD1 3.63Å; F314-F323 HydrophobicContact CE2-CE1 4.2Å; F314-F323 AromaticContact CE2-CG 3.9Å; F314-F323 HydrophobicContact CE2-CG 3.9Å; F314-F323 HydrophobicContact CZ-CB 3.59Å; F314-F323 AromaticContact CZ-CD1 3.62Å; F314-F323 HydrophobicContact CZ-CD1 3.62Å; F314-F323 AromaticContact CZ-CD2 3.85Å; F314-F323 HydrophobicContact CZ-CD2 3.85Å; F314-F323 HydrophobicContact CZ-CE1 4.24Å; F314-F323 HydrophobicContact CZ-CE2 4.44Å; F314-F323 AromaticContact CZ-CG 3.39Å; F314-F323 HydrophobicContact CZ-CG 3.39Å; E319-F323 VanDerWaalsContact O-CB 3.24Å; E319-F323 WeakPolarHBondContact O-CB 3.48Å; E319-F323 PolarHBondContact O-N 2.82Å; F323-G325 VanDerWaalsContact C-N 3.3Å; F323-G325 PolarHBondContact O-N 2.88Å; F323-E326 PolarHBondContact O-N 2.77Å; F323-V327 HydrophobicContact CD2-CG2 4.03Å; F323-V327 HydrophobicContact CE1-CG2 4.33Å; F323-V327 HydrophobicContact CE2-CG2 3.66Å; F323-V327 HydrophobicContact CZ-CG2 3.83Å; F323-V327 WeakPolarHBondContact O-CG2 3.16Å; F323-V327 PolarHBondContact O-N 2.86Å
324	Y	98.4	Very high	95.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-40.4	175	177.4	-97.5	0	0	0	111.8	I197 A203 G296 K297 G301 I304 A320 D322 R328 V335	I197-Y324 HydrophobicContact CD1-CD2 3.84Å; I197-Y324 HydrophobicContact CD1-CE2 3.78Å; I197-Y324 HydrophobicContact CG1-CD2 4.11Å; I197-Y324 HydrophobicContact CG1-CE2 4.04Å; I197-Y324 HydrophobicContact CG2-CD2 4.32Å; A203-Y324 HydrophobicContact CB-CE2 4.08Å; G296-Y324 PolarHBondContact O-OH 3.16Å; K297-Y324 PolarHBondContact O-OH 2.76Å; G301-Y324 PolarHBondContact N-OH 2.85Å; I304-Y324 HydrophobicContact CB-CD2 4.47Å; I304-Y324 HydrophobicContact CD1-CE2 4.12Å; I304-Y324 HydrophobicContact CG2-CD2 4.14Å; A320-Y324 WeakPolarHBondContact O-CB 3.38Å; A320-Y324 PolarHBondContact O-N 3.18Å; D322-Y324 PolarHBondContact O-N 2.84Å; Y324-R328 HydrophobicContact CD2-CB 4.47Å; Y324-R328 HydrophobicContact CE1-CB 4.22Å; Y324-R328 HydrophobicContact CE1-CG 4.34Å; Y324-R328 HydrophobicContact CE2-CB 4.09Å; Y324-R328 HydrophobicContact CE2-CG 4.28Å; Y324-R328 WeakPolarHBondContact O-CB 3.42Å; Y324-R328 PolarHBondContact O-N 3.5Å; Y324-V335 HydrophobicContact CD1-CG2 4.16Å; Y324-V335 HydrophobicContact CE1-CG2 4.29Å
325	G	96.5	Very high	95.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-50	174.6	0	0	0	0	0	112.8	L321 D322 F323 T329 K332	L321-G325 PolarHBondContact O-N 2.83Å; D322-G325 CarbonylContact O-C 3.56Å; D322-G325 WeakPolarHBondContact O-CA 3.4Å; D322-G325 PolarHBondContact O-N 2.96Å; F323-G325 VanDerWaalsContact C-N 3.3Å; F323-G325 PolarHBondContact O-N 2.88Å; G325-T329 PolarHBondContact O-N 3.32Å; G325-T329 VanDerWaalsContact O-N 3.12Å; G325-T329 PolarHBondContact O-OG1 3.39Å; G325-K332 WeakPolarHBondContact CA-O 3.41Å
326	E	96.6	Very high	95.5	Very high	83 Å²	83	47 Å²	47	39%	0.388	22%	0.22	S	C	.	.	H	α-helix	trans	-63.1	-47	178.6	-71.7	-167	168.7	0	0	112.5	R183 D322 F323 K332	R183-E326 VanDerWaalsContact CZ-O 3.25Å; R183-E326 PolarHBondContact NE-O 2.92Å; R183-E326 PolarHBondContact NH2-O 2.99Å; D322-E326 WeakPolarHBondContact O-CG 3.47Å; D322-E326 PolarHBondContact O-N 3.03Å; F323-E326 PolarHBondContact O-N 2.77Å; E326-K332 HydrophobicContact CG-CD 3.76Å; E326-K332 HydrophobicContact CG-CG 3.97Å; E326-K332 WeakPolarHBondContact OE1-CE 3.42Å; E326-K332 IonicContact OE1-NZ 2.84Å; E326-K332 PolarHBondContact OE1-NZ 2.85Å
327	V	96.8	Very high	95.6	Very high	35 Å²	35	44.6 Å²	44.6	21%	0.212	21%	0.211	C	C	.	.	H	α-helix	trans	-73.3	-43.6	-176.9	179.9	0	0	0	0	111.6	R183 T195 Y196 I197 F323	R183-V327 WeakPolarHBondContact CD-O 3.45Å; R183-V327 PolarHBondContact NE-O 2.96Å; T195-V327 HydrophobicContact CG2-CG1 4.19Å; Y196-V327 WeakPolarHBondContact O-CG1 3.4Å; I197-V327 HydrophobicContact CD1-CB 4.4Å; I197-V327 HydrophobicContact CD1-CG1 4.04Å; F323-V327 HydrophobicContact CD2-CG2 4.03Å; F323-V327 HydrophobicContact CE1-CG2 4.33Å; F323-V327 HydrophobicContact CE2-CG2 3.66Å; F323-V327 HydrophobicContact CZ-CG2 3.83Å; F323-V327 WeakPolarHBondContact O-CG2 3.16Å; F323-V327 PolarHBondContact O-N 2.86Å
328	R	96	Very high	95.6	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-77.2	-22.2	-176.1	-172.5	53.1	173.5	129	7.6	113.9	R183 D193 T195 I197 G296 Y324	R183-R328 PolarHBondContact N-O 3.14Å; R183-R328 PolarHBondContact O-NH1 2.94Å; R183-R328 VanDerWaalsContact O-NH1 3.12Å; D193-R328 IonicContact OD1-CZ 3.39Å; D193-R328 VanDerWaalsContact OD1-CZ 3.29Å; D193-R328 IonicContact OD1-NH1 2.76Å; D193-R328 PolarHBondContact OD1-NH1 3.49Å; D193-R328 IonicContact OD1-NH2 2.75Å; D193-R328 PolarHBondContact OD1-NH2 2.81Å; D193-R328 IonicContact OD2-NH2 3.34Å; T195-R328 WeakPolarHBondContact OG1-CD 3.3Å; T195-R328 PolarHBondContact OG1-NH1 3.04Å; I197-R328 HydrophobicContact CD1-CB 4Å; G296-R328 PolarHBondContact O-NE 3.16Å; G296-R328 PolarHBondContact O-NH2 3.36Å; Y324-R328 HydrophobicContact CD2-CB 4.47Å; Y324-R328 HydrophobicContact CE1-CB 4.22Å; Y324-R328 HydrophobicContact CE1-CG 4.34Å; Y324-R328 HydrophobicContact CE2-CB 4.09Å; Y324-R328 HydrophobicContact CE2-CG 4.28Å; Y324-R328 WeakPolarHBondContact O-CB 3.42Å; Y324-R328 PolarHBondContact O-N 3.5Å
329	T	92.2	Very high	95.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-129.6	167.9	-173.6	72.7	0	0	0	0	114	N181 R183 G325 D331 K332 K333	N181-T329 CarbonylContact O-C 3.53Å; N181-T329 VanDerWaalsContact O-CA 3.27Å; N181-T329 WeakPolarHBondContact O-CA 3.43Å; N181-T329 WeakPolarHBondContact O-CB 3.37Å; R183-T329 PolarHBondContact NE-O 3.36Å; G325-T329 PolarHBondContact O-N 3.32Å; G325-T329 VanDerWaalsContact O-N 3.12Å; G325-T329 PolarHBondContact O-OG1 3.39Å; T329-D331 PolarHBondContact OG1-OD1 2.74Å; T329-K332 VanDerWaalsContact OG1-CA 3.28Å; T329-K332 WeakPolarHBondContact OG1-CA 3.38Å; T329-K332 PolarHBondContact OG1-N 2.83Å; T329-K332 VanDerWaalsContact OG1-N 3.09Å; T329-K333 PolarHBondContact OG1-N 2.66Å
330	R	89.6	Confident	95.7	Very high	148 Å²	148	39 Å²	39	56%	0.558	19%	0.185	S	C	*	.	S	Bend	trans	-91.5	-23.8	172.4	-65	177.8	173.3	162.9	-2.6	111.5	E176 N181 R183	E176-R330 IonicContact OE1-NH1 3.18Å; N181-R330 HydrophobicContact CB-CB 4.49Å; N181-R330 PolarHBondContact O-N 3.02Å; R183-R330 HydrophobicContact CG-CG 4.46Å
331	D	89.1	Confident	95.7	Very high	43 Å²	43	42.1 Å²	42.1	23%	0.23	20%	0.197	C	C	.	.	S	Bend	trans	-108.5	14.3	-175	69	-18.8	0	0	0	114	N181 T329 K333	N181-D331 HydrophobicContact CB-CB 4.11Å; N181-D331 VanDerWaalsContact ND2-CG 3.31Å; N181-D331 PolarHBondContact ND2-OD2 2.91Å; T329-D331 PolarHBondContact OG1-OD1 2.74Å; D331-K333 PolarHBondContact O-N 2.96Å; D331-K333 PolarHBondContact OD1-N 2.87Å; D331-K333 WeakPolarHBondContact OD2-CD 3.27Å; D331-K333 IonicContact OD2-NZ 2.92Å
332	K	91.6	Very high	95.7	Very high	136 Å²	136	43.1 Å²	43.1	59%	0.591	20%	0.201	S	C	*	.	S	Bend	trans	57.4	1.7	-173.1	-51.8	-164.4	178.7	-167.8	0	115.7	G325 E326 T329 G334	G325-K332 WeakPolarHBondContact CA-O 3.41Å; E326-K332 HydrophobicContact CG-CD 3.76Å; E326-K332 HydrophobicContact CG-CG 3.97Å; E326-K332 WeakPolarHBondContact OE1-CE 3.42Å; E326-K332 IonicContact OE1-NZ 2.84Å; E326-K332 PolarHBondContact OE1-NZ 2.85Å; T329-K332 VanDerWaalsContact OG1-CA 3.28Å; T329-K332 WeakPolarHBondContact OG1-CA 3.38Å; T329-K332 PolarHBondContact OG1-N 2.83Å; T329-K332 VanDerWaalsContact OG1-N 3.09Å; K332-G334 VanDerWaalsContact C-N 3.32Å; K332-G334 PolarHBondContact O-N 2.82Å
333	K	90.3	Very high	95.7	Very high	117 Å²	117	39.6 Å²	39.6	51%	0.509	18%	0.182	S	C	.	.			trans	-82.5	74.2	-175.3	-71.2	176.2	-155.1	154	0	110.6	K297 T329 D331 T336	K297-K333 WeakPolarHBondContact CE-O 3.17Å; K297-K333 PolarHBondContact NZ-O 3.32Å; T329-K333 PolarHBondContact OG1-N 2.66Å; D331-K333 PolarHBondContact O-N 2.96Å; D331-K333 PolarHBondContact OD1-N 2.87Å; D331-K333 WeakPolarHBondContact OD2-CD 3.27Å; D331-K333 IonicContact OD2-NZ 2.92Å; K333-T336 HydrophobicContact CB-CG2 3.64Å; K333-T336 HydrophobicContact CG-CG2 4.13Å
334	G	93.6	Very high	95.7	Very high	4 Å²	4	37 Å²	37	4%	0.041	17%	0.17	C	C	.	.	S	Bend	trans	-71.5	-103.6	173.6	0	0	0	0	0	112.8	K297 K332 T336	K297-G334 VanDerWaalsContact CE-O 3.29Å; K297-G334 WeakPolarHBondContact CE-O 3.37Å; K332-G334 VanDerWaalsContact C-N 3.32Å; K332-G334 PolarHBondContact O-N 2.82Å; G334-T336 PolarHBondContact O-N 2.99Å
335	V	97	Very high	95.7	Very high	6 Å²	6	39 Å²	39	4%	0.036	18%	0.178	C	C	.	.	S	Bend	trans	-84.7	102.3	173.6	-173.1	0	0	0	0	109	V302 L321 Y324 Q340 R341	V302-V335 HydrophobicContact CG2-CG1 4Å; L321-V335 HydrophobicContact CD2-CB 3.79Å; L321-V335 HydrophobicContact CD2-CG1 4.28Å; L321-V335 HydrophobicContact CD2-CG2 4.05Å; Y324-V335 HydrophobicContact CD1-CG2 4.16Å; Y324-V335 HydrophobicContact CE1-CG2 4.29Å; V335-Q340 HydrophobicContact CG1-CB 3.54Å; V335-R341 HydrophobicContact CB-CG 4.42Å; V335-R341 HydrophobicContact CG1-CG 3.97Å; V335-R341 WeakPolarHBondContact O-CD 3.47Å; V335-R341 WeakPolarHBondContact O-CG 3.41Å
336	T	94.9	Very high	95.8	Very high	68 Å²	68	39.7 Å²	39.7	42%	0.417	18%	0.181	S	C	.	.			trans	-107.6	-3.1	-173.7	59.8	0	0	0	0	115	K333 G334 P338	K333-T336 HydrophobicContact CB-CG2 3.64Å; K333-T336 HydrophobicContact CG-CG2 4.13Å; G334-T336 PolarHBondContact O-N 2.99Å; T336-P338 WeakPolarHBondContact O-CD 3.49Å
337	I	97.6	Very high	95.9	Very high	32 Å²	32	36.1 Å²	36.1	16%	0.164	16%	0.164	C	C	.	.			trans	-88.5	119.2	179.6	-60.3	-178.8	0	0	0	107.6	H262 S339 Q340 R341 D495	H262-I337 HydrophobicContact CB-CD1 3.83Å; H262-I337 WeakPolarHBondContact O-CD1 3.37Å; I337-S339 VanDerWaalsContact C-N 3.31Å; I337-S339 PolarHBondContact O-N 2.92Å; I337-Q340 HydrophobicContact CB-CB 4.02Å; I337-Q340 HydrophobicContact CB-CG 4Å; I337-Q340 HydrophobicContact CG2-CB 4.45Å; I337-Q340 HydrophobicContact CG2-CG 4.18Å; I337-Q340 WeakPolarHBondContact O-CA 3.49Å; I337-Q340 WeakPolarHBondContact O-CB 3.32Å; I337-Q340 PolarHBondContact O-N 2.87Å; I337-R341 PolarHBondContact O-N 2.96Å; I337-D495 HydrophobicContact CG2-CB 4.42Å; I337-D495 WeakPolarHBondContact CG2-OD1 3.22Å
338	P	98.2	Very high	95.9	Very high	11 Å²	11	35.3 Å²	35.3	7%	0.071	16%	0.16	C	C	.	.	H	α-helix	trans	-50.2	-44.6	-178.2	-32.4	36.4	0	0	0	114.6	T336 Q340 R341 R342 N492 D493 D495 N498	T336-P338 WeakPolarHBondContact O-CD 3.49Å; P338-Q340 VanDerWaalsContact C-N 3.34Å; P338-Q340 PolarHBondContact O-N 2.8Å; P338-R341 PolarHBondContact O-N 3.21Å; P338-R342 WeakPolarHBondContact O-CB 3.37Å; P338-R342 PolarHBondContact O-N 3.41Å; P338-N492 WeakPolarHBondContact CG-O 3.41Å; P338-D493 VanDerWaalsContact CB-C 3.47Å; P338-D493 VanDerWaalsContact CB-O 3.27Å; P338-D493 WeakPolarHBondContact CB-O 3.14Å; P338-D495 WeakPolarHBondContact CD-OD1 3.3Å; P338-N498 VanDerWaalsContact CD-ND2 3.27Å; P338-N498 WeakPolarHBondContact CD-ND2 3.43Å; P338-N498 HydrophobicContact CG-CB 4.02Å; P338-N498 VanDerWaalsContact CG-ND2 3.34Å; P338-N498 WeakPolarHBondContact CG-ND2 3.23Å
339	S	98.4	Very high	95.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-34.6	176.4	-63.4	0	0	0	0	113.6	I337 R342 Y343 W443 D495	I337-S339 VanDerWaalsContact C-N 3.31Å; I337-S339 PolarHBondContact O-N 2.92Å; S339-R342 PolarHBondContact O-N 2.86Å; S339-R342 PolarHBondContact OG-NH1 3.42Å; S339-Y343 VanDerWaalsContact O-CD2 3.23Å; S339-Y343 WeakPolarHBondContact O-CD2 3.38Å; S339-Y343 PolarHBondContact O-N 3.16Å; S339-W443 PolarHBondContact OG-N 3.07Å; S339-D495 WeakPolarHBondContact CB-OD2 3.29Å; S339-D495 PolarHBondContact N-OD1 3.28Å; S339-D495 VanDerWaalsContact OG-CG 3.31Å; S339-D495 PolarHBondContact OG-OD1 3.49Å; S339-D495 PolarHBondContact OG-OD2 3.19Å
340	Q	98.5	Very high	96.2	Very high	3 Å²	3	37.9 Å²	37.9	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-67.3	-39.4	173.3	-73.6	-175.1	-20.3	0	0	111.7	N263 G298 V302 V335 I337 P338	N263-Q340 WeakPolarHBondContact O-CG 3.4Å; N263-Q340 PolarHBondContact O-NE2 3.47Å; G298-Q340 VanDerWaalsContact CA-OE1 3.3Å; V302-Q340 HydrophobicContact CG2-CB 3.6Å; V302-Q340 HydrophobicContact CG2-CG 4.07Å; V302-Q340 WeakPolarHBondContact CG2-O 3.42Å; V335-Q340 HydrophobicContact CG1-CB 3.54Å; I337-Q340 HydrophobicContact CB-CB 4.02Å; I337-Q340 HydrophobicContact CB-CG 4Å; I337-Q340 HydrophobicContact CG2-CB 4.45Å; I337-Q340 HydrophobicContact CG2-CG 4.18Å; I337-Q340 WeakPolarHBondContact O-CA 3.49Å; I337-Q340 WeakPolarHBondContact O-CB 3.32Å; I337-Q340 PolarHBondContact O-N 2.87Å; P338-Q340 VanDerWaalsContact C-N 3.34Å; P338-Q340 PolarHBondContact O-N 2.8Å
341	R	98.6	Very high	96.5	Very high	65 Å²	65	33.3 Å²	33.3	25%	0.245	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-46.3	174	-67	172.4	55.2	79.4	4.2	111	L321 V335 I337 P338 Y343 V344 Y345	L321-R341 HydrophobicContact CD1-CB 4.25Å; L321-R341 HydrophobicContact CD1-CG 4.33Å; L321-R341 HydrophobicContact CD2-CG 4.31Å; V335-R341 HydrophobicContact CB-CG 4.42Å; V335-R341 HydrophobicContact CG1-CG 3.97Å; V335-R341 WeakPolarHBondContact O-CD 3.47Å; V335-R341 WeakPolarHBondContact O-CG 3.41Å; I337-R341 PolarHBondContact O-N 2.96Å; P338-R341 PolarHBondContact O-N 3.21Å; R341-Y343 PolarHBondContact O-N 3.38Å; R341-V344 WeakPolarHBondContact O-CB 3.42Å; R341-V344 PolarHBondContact O-N 2.89Å; R341-Y345 WeakPolarHBondContact O-CD2 3.45Å; R341-Y345 PolarHBondContact O-N 3.12Å; R341-Y345 VanDerWaalsContact O-N 3.13Å
342	R	98.4	Very high	96.8	Very high	25 Å²	25	36.4 Å²	36.4	9%	0.094	17%	0.169	C	C	.	.	H	α-helix	trans	-53.6	-38.2	179.6	-174.1	177.8	-61.5	107.3	15.2	112.9	P338 S339 V344 Y345 Y346 W443 D493	P338-R342 WeakPolarHBondContact O-CB 3.37Å; P338-R342 PolarHBondContact O-N 3.41Å; S339-R342 PolarHBondContact O-N 2.86Å; S339-R342 PolarHBondContact OG-NH1 3.42Å; R342-V344 VanDerWaalsContact C-N 3.35Å; R342-V344 PolarHBondContact O-N 2.97Å; R342-Y345 WeakPolarHBondContact O-CB 3.16Å; R342-Y345 PolarHBondContact O-N 2.94Å; R342-Y346 HydrophobicContact CG-CD1 4.24Å; R342-Y346 HydrophobicContact CG-CD2 4.22Å; R342-Y346 HydrophobicContact CG-CE1 3.85Å; R342-Y346 HydrophobicContact CG-CE2 3.82Å; R342-Y346 HydrophobicContact CG-CG 4.45Å; R342-Y346 VanDerWaalsContact O-CG 3.3Å; R342-Y346 PolarHBondContact O-N 2.87Å; R342-W443 PolarHBondContact NH1-O 3.44Å; R342-D493 PolarHBondContact NH2-O 2.93Å
343	Y	98.7	Very high	96.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-74.3	-24.7	180	-80.9	-125.1	0	0	0	113	P264 P265 L267 S339 R341 Y346 Y347 D421 W443	P264-Y343 HydrophobicContact CB-CD1 3.73Å; P264-Y343 HydrophobicContact CB-CD2 3.64Å; P264-Y343 HydrophobicContact CB-CE1 4.01Å; P264-Y343 HydrophobicContact CB-CE2 3.95Å; P264-Y343 HydrophobicContact CB-CG 3.53Å; P264-Y343 HydrophobicContact CG-CD1 4.35Å; P264-Y343 HydrophobicContact CG-CD2 3.95Å; P264-Y343 HydrophobicContact CG-CE1 4.14Å; P264-Y343 HydrophobicContact CG-CE2 3.74Å; P264-Y343 HydrophobicContact CG-CG 4.26Å; P265-Y343 VanDerWaalsContact O-CD1 3.28Å; P265-Y343 WeakPolarHBondContact O-CD1 3.48Å; P265-Y343 WeakPolarHBondContact O-CE1 3.15Å; L267-Y343 HydrophobicContact CB-CE1 4.37Å; L267-Y343 HydrophobicContact CD1-CD1 4.25Å; S339-Y343 VanDerWaalsContact O-CD2 3.23Å; S339-Y343 WeakPolarHBondContact O-CD2 3.38Å; S339-Y343 PolarHBondContact O-N 3.16Å; R341-Y343 PolarHBondContact O-N 3.38Å; Y343-Y346 AromaticContact CD2-CD2 3.85Å; Y343-Y346 HydrophobicContact CD2-CD2 3.85Å; Y343-Y346 HydrophobicContact CD2-CE2 4.02Å; Y343-Y346 HydrophobicContact CE2-CD2 4.09Å; Y343-Y346 AromaticContact CE2-CE2 3.86Å; Y343-Y346 HydrophobicContact CE2-CE2 3.86Å; Y343-Y346 HydrophobicContact CG-CD2 4.12Å; Y343-Y347 WeakPolarHBondContact O-CB 3.32Å; Y343-Y347 PolarHBondContact O-N 2.86Å; Y343-Y347 VanDerWaalsContact O-N 3.08Å; Y343-D421 WeakPolarHBondContact CE1-OD1 3.27Å; Y343-D421 PolarHBondContact OH-OD1 2.88Å; Y343-D421 VanDerWaalsContact OH-OD1 3.04Å; Y343-W443 HydrophobicContact CE2-CB 3.92Å
344	V	98.8	Very high	97.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-70.5	-39.4	167.5	-176.9	0	0	0	0	110.6	V302 C305 L309 A317 L321 R341 R342 Y347 S348	V302-V344 HydrophobicContact CB-CG2 4.28Å; V302-V344 HydrophobicContact CG1-CG2 3.91Å; V302-V344 HydrophobicContact CG2-CG2 4.44Å; C305-V344 HydrophobicContact CB-CG1 3.73Å; C305-V344 HydrophobicContact CB-CG2 4.11Å; L309-V344 HydrophobicContact CD1-CG1 3.6Å; A317-V344 HydrophobicContact CB-CG1 4.01Å; L321-V344 HydrophobicContact CD1-CB 4.42Å; L321-V344 HydrophobicContact CD1-CG1 4.44Å; L321-V344 HydrophobicContact CD2-CB 4.32Å; L321-V344 HydrophobicContact CD2-CG1 4.41Å; L321-V344 HydrophobicContact CD2-CG2 4.06Å; L321-V344 HydrophobicContact CG-CB 4.48Å; L321-V344 HydrophobicContact CG-CG1 4.21Å; R341-V344 WeakPolarHBondContact O-CB 3.42Å; R341-V344 PolarHBondContact O-N 2.89Å; R342-V344 VanDerWaalsContact C-N 3.35Å; R342-V344 PolarHBondContact O-N 2.97Å; V344-Y347 PolarHBondContact O-N 2.89Å; V344-S348 WeakPolarHBondContact O-CB 3.42Å; V344-S348 PolarHBondContact O-N 2.84Å
345	Y	98.4	Very high	97.1	Very high	43 Å²	43	38.9 Å²	38.9	17%	0.169	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-46.3	172.8	-86.5	-91.9	0	0	0	112.8	A317 L321 R341 R342 Y347 S348 Y349 E468	A317-Y345 HydrophobicContact CB-CD1 3.81Å; A317-Y345 HydrophobicContact CB-CD2 3.73Å; A317-Y345 HydrophobicContact CB-CE1 4.05Å; A317-Y345 HydrophobicContact CB-CE2 3.98Å; A317-Y345 HydrophobicContact CB-CG 3.67Å; L321-Y345 HydrophobicContact CD1-CD2 4.18Å; L321-Y345 HydrophobicContact CD1-CE2 3.85Å; R341-Y345 WeakPolarHBondContact O-CD2 3.45Å; R341-Y345 PolarHBondContact O-N 3.12Å; R341-Y345 VanDerWaalsContact O-N 3.13Å; R342-Y345 WeakPolarHBondContact O-CB 3.16Å; R342-Y345 PolarHBondContact O-N 2.94Å; Y345-Y347 VanDerWaalsContact C-N 3.32Å; Y345-Y347 PolarHBondContact O-N 2.97Å; Y345-S348 WeakPolarHBondContact O-CB 3.12Å; Y345-S348 PolarHBondContact O-N 3.01Å; Y345-Y349 PolarHBondContact O-N 2.87Å; Y345-E468 HydrophobicContact CE1-CB 4.36Å; Y345-E468 WeakPolarHBondContact CE1-OE2 3.14Å; Y345-E468 VanDerWaalsContact CZ-OE2 3.29Å; Y345-E468 PolarHBondContact OH-OE2 3.25Å
346	Y	98.4	Very high	97	Very high	13 Å²	13	44.8 Å²	44.8	5%	0.051	22%	0.218	C	C	.	.	H	α-helix	trans	-54.9	-46.5	173.4	-73.1	-18.4	0	0	0	111.7	L267 R342 Y343 Y349 L350 N445 F448	L267-Y346 HydrophobicContact CD1-CD2 4.23Å; L267-Y346 HydrophobicContact CD1-CG 4.49Å; R342-Y346 HydrophobicContact CG-CD1 4.24Å; R342-Y346 HydrophobicContact CG-CD2 4.22Å; R342-Y346 HydrophobicContact CG-CE1 3.85Å; R342-Y346 HydrophobicContact CG-CE2 3.82Å; R342-Y346 HydrophobicContact CG-CG 4.45Å; R342-Y346 VanDerWaalsContact O-CG 3.3Å; R342-Y346 PolarHBondContact O-N 2.87Å; Y343-Y346 AromaticContact CD2-CD2 3.85Å; Y343-Y346 HydrophobicContact CD2-CD2 3.85Å; Y343-Y346 HydrophobicContact CD2-CE2 4.02Å; Y343-Y346 HydrophobicContact CE2-CD2 4.09Å; Y343-Y346 AromaticContact CE2-CE2 3.86Å; Y343-Y346 HydrophobicContact CE2-CE2 3.86Å; Y343-Y346 HydrophobicContact CG-CD2 4.12Å; Y346-Y349 WeakPolarHBondContact O-CB 3.47Å; Y346-Y349 PolarHBondContact O-N 3.46Å; Y346-L350 WeakPolarHBondContact O-CG 3.11Å; Y346-L350 PolarHBondContact O-N 3.07Å; Y346-L350 VanDerWaalsContact O-N 3.08Å; Y346-N445 HydrophobicContact CD2-CB 4.28Å; Y346-N445 HydrophobicContact CE2-CB 3.78Å; Y346-N445 PolarHBondContact OH-N 3.3Å; Y346-N445 VanDerWaalsContact OH-N 3.16Å; Y346-F448 VanDerWaalsContact CB-CZ 3.47Å; Y346-F448 HydrophobicContact CD1-CB 3.95Å; Y346-F448 AromaticContact CD1-CD1 3.64Å; Y346-F448 HydrophobicContact CD1-CD1 3.64Å; Y346-F448 AromaticContact CD1-CD2 3.51Å; Y346-F448 HydrophobicContact CD1-CD2 3.51Å; Y346-F448 AromaticContact CD1-CE1 3.97Å; Y346-F448 HydrophobicContact CD1-CE1 3.97Å; Y346-F448 AromaticContact CD1-CE2 3.87Å; Y346-F448 HydrophobicContact CD1-CE2 3.87Å; Y346-F448 AromaticContact CD1-CG 3.4Å; Y346-F448 HydrophobicContact CD1-CG 3.4Å; Y346-F448 VanDerWaalsContact CD1-CG 3.4Å; Y346-F448 HydrophobicContact CD1-CZ 4.09Å; Y346-F448 AromaticContact CD2-CD2 3.92Å; Y346-F448 HydrophobicContact CD2-CD2 3.92Å; Y346-F448 AromaticContact CD2-CE2 3.85Å; Y346-F448 HydrophobicContact CD2-CE2 3.85Å; Y346-F448 HydrophobicContact CD2-CZ 4.49Å; Y346-F448 HydrophobicContact CE1-CB 3.48Å; Y346-F448 VanDerWaalsContact CE1-CB 3.48Å; Y346-F448 HydrophobicContact CE1-CD1 4.12Å; Y346-F448 AromaticContact CE1-CD2 3.58Å; Y346-F448 HydrophobicContact CE1-CD2 3.58Å; Y346-F448 HydrophobicContact CE1-CE2 4.35Å; Y346-F448 AromaticContact CE1-CG 3.45Å; Y346-F448 HydrophobicContact CE1-CG 3.45Å; Y346-F448 VanDerWaalsContact CE1-CG 3.45Å; Y346-F448 AromaticContact CE2-CD2 3.99Å; Y346-F448 HydrophobicContact CE2-CD2 3.99Å; Y346-F448 HydrophobicContact CE2-CE2 4.34Å; Y346-F448 HydrophobicContact CG-CD1 4.23Å; Y346-F448 AromaticContact CG-CD2 3.66Å; Y346-F448 HydrophobicContact CG-CD2 3.66Å; Y346-F448 HydrophobicContact CG-CE1 4.13Å; Y346-F448 AromaticContact CG-CE2 3.56Å; Y346-F448 HydrophobicContact CG-CE2 3.56Å; Y346-F448 HydrophobicContact CG-CG 4.02Å; Y346-F448 AromaticContact CG-CZ 3.82Å; Y346-F448 HydrophobicContact CG-CZ 3.82Å; Y346-F448 AromaticContact CZ-CD2 3.79Å; Y346-F448 WeakPolarHBondContact O-CE1 3.36Å
347	Y	98.6	Very high	97	Very high	9 Å²	9	43.7 Å²	43.7	4%	0.035	21%	0.207	C	C	.	.	H	α-helix	trans	-67.7	-38.5	177.3	-163.8	-115.7	0	0	0	112.7	I270 K271 A306 H310 Y343 V344 Y345 Y349 L350 L351	I270-Y347 HydrophobicContact CB-CD2 4.06Å; I270-Y347 HydrophobicContact CB-CE2 4.23Å; I270-Y347 HydrophobicContact CB-CG 4.44Å; I270-Y347 HydrophobicContact CG2-CD1 3.74Å; I270-Y347 HydrophobicContact CG2-CD2 3.63Å; I270-Y347 HydrophobicContact CG2-CE1 3.88Å; I270-Y347 HydrophobicContact CG2-CE2 3.82Å; I270-Y347 HydrophobicContact CG2-CG 3.61Å; K271-Y347 HydrophobicContact CB-CE2 4.08Å; A306-Y347 HydrophobicContact CB-CD1 3.65Å; A306-Y347 HydrophobicContact CB-CE1 4.09Å; A306-Y347 HydrophobicContact CB-CG 4.38Å; H310-Y347 HydrophobicContact CB-CE1 4.19Å; H310-Y347 AromaticContact ND1-CZ 3.96Å; H310-Y347 PolarHBondContact ND1-OH 2.88Å; Y343-Y347 WeakPolarHBondContact O-CB 3.32Å; Y343-Y347 PolarHBondContact O-N 2.86Å; Y343-Y347 VanDerWaalsContact O-N 3.08Å; V344-Y347 PolarHBondContact O-N 2.89Å; Y345-Y347 VanDerWaalsContact C-N 3.32Å; Y345-Y347 PolarHBondContact O-N 2.97Å; Y347-Y349 VanDerWaalsContact C-N 3.27Å; Y347-Y349 PolarHBondContact O-N 3.03Å; Y347-L350 HydrophobicContact CD2-CD1 4.39Å; Y347-L350 PolarHBondContact O-N 2.92Å; Y347-L351 HydrophobicContact CD1-CD1 3.76Å; Y347-L351 HydrophobicContact CD1-CG 4.34Å; Y347-L351 HydrophobicContact CE1-CD1 3.66Å; Y347-L351 HydrophobicContact CE1-CD2 4.41Å; Y347-L351 HydrophobicContact CE1-CG 4.15Å; Y347-L351 WeakPolarHBondContact O-CG 3.41Å; Y347-L351 PolarHBondContact O-N 2.98Å
348	S	98.1	Very high	96.9	Very high	17 Å²	17	50.1 Å²	50.1	12%	0.119	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-37.3	172.1	-159.1	0	0	0	0	112.4	A317 V344 Y345 K352	A317-S348 PolarHBondContact N-OG 3.41Å; V344-S348 WeakPolarHBondContact O-CB 3.42Å; V344-S348 PolarHBondContact O-N 2.84Å; Y345-S348 WeakPolarHBondContact O-CB 3.12Å; Y345-S348 PolarHBondContact O-N 3.01Å; S348-K352 WeakPolarHBondContact O-CB 3.46Å; S348-K352 PolarHBondContact O-N 3.26Å
349	Y	96.2	Very high	96.7	Very high	40 Å²	40	53.3 Å²	53.3	16%	0.157	25%	0.249	C	C	.	.	H	α-helix	trans	-69.8	-42.3	177.6	-178.9	-85	0	0	0	112	Y345 Y346 Y347 N353 L355 F448 I469	Y345-Y349 PolarHBondContact O-N 2.87Å; Y346-Y349 WeakPolarHBondContact O-CB 3.47Å; Y346-Y349 PolarHBondContact O-N 3.46Å; Y347-Y349 VanDerWaalsContact C-N 3.27Å; Y347-Y349 PolarHBondContact O-N 3.03Å; Y349-N353 VanDerWaalsContact CD2-ND2 3.26Å; Y349-N353 WeakPolarHBondContact CD2-ND2 3.48Å; Y349-N353 VanDerWaalsContact CE2-ND2 3.28Å; Y349-N353 WeakPolarHBondContact CE2-ND2 3.35Å; Y349-N353 WeakPolarHBondContact O-CB 3.18Å; Y349-N353 PolarHBondContact O-N 2.93Å; Y349-N353 VanDerWaalsContact O-N 3.09Å; Y349-N353 PolarHBondContact O-ND2 3.18Å; Y349-L355 HydrophobicContact CD1-CD1 4.2Å; Y349-L355 HydrophobicContact CE1-CD1 3.62Å; Y349-F448 AromaticContact CD1-CD1 3.88Å; Y349-F448 HydrophobicContact CD1-CD1 3.88Å; Y349-F448 AromaticContact CD1-CE1 3.73Å; Y349-F448 HydrophobicContact CD1-CE1 3.73Å; Y349-F448 HydrophobicContact CE1-CD1 4.35Å; Y349-F448 HydrophobicContact CG-CD1 4.34Å; Y349-F448 HydrophobicContact CG-CE1 4.28Å; Y349-I469 HydrophobicContact CD2-CD1 3.79Å; Y349-I469 HydrophobicContact CG-CD1 4.19Å
350	L	96.6	Very high	96.5	Very high	15 Å²	15	54.8 Å²	54.8	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-48	174.2	-67.1	173.9	0	0	0	111.2	L267 Y346 Y347 H354 L355 F447 F448	L267-L350 HydrophobicContact CD2-CD1 4.25Å; Y346-L350 WeakPolarHBondContact O-CG 3.11Å; Y346-L350 PolarHBondContact O-N 3.07Å; Y346-L350 VanDerWaalsContact O-N 3.08Å; Y347-L350 HydrophobicContact CD2-CD1 4.39Å; Y347-L350 PolarHBondContact O-N 2.92Å; L350-H354 PolarHBondContact O-N 3.24Å; L350-H354 VanDerWaalsContact O-N 3.11Å; L350-L355 HydrophobicContact CD2-CB 3.96Å; L350-L355 PolarHBondContact O-N 2.7Å; L350-F447 HydrophobicContact CD2-CD1 4.22Å; L350-F447 HydrophobicContact CD2-CE1 3.45Å; L350-F447 VanDerWaalsContact CD2-CE1 3.45Å; L350-F447 HydrophobicContact CD2-CZ 3.75Å; L350-F448 HydrophobicContact CD1-CZ 4.23Å; L350-F448 HydrophobicContact CD2-CE1 4.29Å; L350-F448 HydrophobicContact CD2-CZ 4.15Å; L350-F448 HydrophobicContact CG-CE1 4.21Å; L350-F448 HydrophobicContact CG-CZ 3.99Å
351	L	96.8	Very high	96.4	Very high	53 Å²	53	56.8 Å²	56.8	28%	0.277	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-48.4	178.3	-70.2	170.4	0	0	0	112.5	L309 H310 Y347 H354	L309-L351 HydrophobicContact CB-CD1 3.76Å; H310-L351 HydrophobicContact CB-CD1 4.44Å; Y347-L351 HydrophobicContact CD1-CD1 3.76Å; Y347-L351 HydrophobicContact CD1-CG 4.34Å; Y347-L351 HydrophobicContact CE1-CD1 3.66Å; Y347-L351 HydrophobicContact CE1-CD2 4.41Å; Y347-L351 HydrophobicContact CE1-CG 4.15Å; Y347-L351 WeakPolarHBondContact O-CG 3.41Å; Y347-L351 PolarHBondContact O-N 2.98Å; L351-H354 PolarHBondContact O-N 3.4Å; L351-H354 PolarHBondContact O-ND1 2.66Å
352	K	94.9	Very high	96.3	Very high	108 Å²	108	53.7 Å²	53.7	47%	0.47	26%	0.263	S	S	.	.	H	α-helix	trans	-63.8	-41.8	-176.7	-175.8	-165.5	175.8	-166	0	112.6	S348 D466	S348-K352 WeakPolarHBondContact O-CB 3.46Å; S348-K352 PolarHBondContact O-N 3.26Å; K352-D466 IonicContact NZ-OD1 3.71Å; K352-D466 PolarHBondContact NZ-OD1 2.74Å; K352-D466 IonicContact NZ-OD2 2.78Å; K352-D466 PolarHBondContact NZ-OD2 2.98Å
353	N	93.8	Very high	96.3	Very high	66 Å²	66	54.9 Å²	54.9	35%	0.353	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	5.9	-176	-59.8	-58.8	0	0	0	112.9	Y349 L355	Y349-N353 VanDerWaalsContact CD2-ND2 3.26Å; Y349-N353 WeakPolarHBondContact CD2-ND2 3.48Å; Y349-N353 VanDerWaalsContact CE2-ND2 3.28Å; Y349-N353 WeakPolarHBondContact CE2-ND2 3.35Å; Y349-N353 WeakPolarHBondContact O-CB 3.18Å; Y349-N353 PolarHBondContact O-N 2.93Å; Y349-N353 VanDerWaalsContact O-N 3.09Å; Y349-N353 PolarHBondContact O-ND2 3.18Å; N353-L355 VanDerWaalsContact C-N 3.26Å; N353-L355 HydrophobicContact CB-CD1 3.79Å; N353-L355 HydrophobicContact CB-CG 3.78Å; N353-L355 PolarHBondContact O-N 2.84Å
354	H	94.8	Very high	96.2	Very high	174 Å²	174	54.9 Å²	54.9	81%	0.806	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	40.6	-177	-54.5	-54.1	0	0	0	113.7	L350 L351	L350-H354 PolarHBondContact O-N 3.24Å; L350-H354 VanDerWaalsContact O-N 3.11Å; L351-H354 PolarHBondContact O-N 3.4Å; L351-H354 PolarHBondContact O-ND1 2.66Å
355	L	94.3	Very high	96.1	Very high	68 Å²	68	56.1 Å²	56.1	36%	0.356	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-97.9	125	-177.4	-61.8	173.5	0	0	0	111.2	Y349 L350 N353 F447	Y349-L355 HydrophobicContact CD1-CD1 4.2Å; Y349-L355 HydrophobicContact CE1-CD1 3.62Å; L350-L355 HydrophobicContact CD2-CB 3.96Å; L350-L355 PolarHBondContact O-N 2.7Å; N353-L355 VanDerWaalsContact C-N 3.26Å; N353-L355 HydrophobicContact CB-CD1 3.79Å; N353-L355 HydrophobicContact CB-CG 3.78Å; N353-L355 PolarHBondContact O-N 2.84Å; L355-F447 HydrophobicContact CB-CZ 4.25Å; L355-F447 HydrophobicContact CD1-CE1 4.29Å; L355-F447 HydrophobicContact CD1-CZ 4.13Å
356	D	94	Very high	96.1	Very high	131 Å²	131	55.9 Å²	55.9	70%	0.701	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-75.3	135.4	159.6	-76.4	-53.2	0	0	0	110
357	Y	95.9	Very high	96.1	Very high	45 Å²	45	55.2 Å²	55.2	18%	0.176	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-73.7	137.4	178.6	167.2	-98.2	0	0	0	111.4	L267 E268 P359 G420 N445 F447	L267-Y357 HydrophobicContact CD2-CD1 4.42Å; L267-Y357 HydrophobicContact CD2-CD2 3.32Å; L267-Y357 HydrophobicContact CD2-CE2 3.5Å; L267-Y357 VanDerWaalsContact CD2-CE2 3.5Å; L267-Y357 HydrophobicContact CD2-CG 3.79Å; E268-Y357 HydrophobicContact CG-CD1 3.63Å; E268-Y357 HydrophobicContact CG-CE1 3.43Å; E268-Y357 VanDerWaalsContact CG-CE1 3.43Å; E268-Y357 WeakPolarHBondContact OE1-CE1 3.32Å; Y357-P359 HydrophobicContact CE1-CG 4.09Å; Y357-G420 WeakPolarHBondContact OH-CA 3.49Å; Y357-N445 WeakPolarHBondContact CE2-OD1 3.49Å; Y357-N445 PolarHBondContact OH-ND2 2.94Å; Y357-N445 VanDerWaalsContact OH-ND2 3.14Å; Y357-F447 HydrophobicContact CD2-CB 3.86Å; Y357-F447 HydrophobicContact CD2-CD1 4.4Å; Y357-F447 AromaticContact CD2-CD2 3.89Å; Y357-F447 HydrophobicContact CD2-CD2 3.89Å; Y357-F447 AromaticContact CD2-CG 3.81Å; Y357-F447 HydrophobicContact CD2-CG 3.81Å; Y357-F447 HydrophobicContact CE2-CB 3.66Å; Y357-F447 HydrophobicContact CE2-CD2 4.38Å; Y357-F447 HydrophobicContact CE2-CG 4.15Å
358	R	93.9	Very high	96.1	Very high	167 Å²	167	55.4 Å²	55.4	63%	0.63	28%	0.276	S	S	*	.			trans	-131.6	139.6	168	55.9	179	178.2	154.8	0.8	109.7	V360 F447	R358-V360 PolarHBondContact O-N 3.32Å; R358-F447 HydrophobicContact CG-CD2 4.34Å; R358-F447 HydrophobicContact CG-CE2 4.19Å; R358-F447 WeakPolarHBondContact O-CD2 3.47Å
359	P	93.9	Very high	96.1	Very high	77 Å²	77	54.6 Å²	54.6	50%	0.5	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-60.9	124.1	174.4	-22.7	33.6	0	0	0	111.4	Y357 C419	Y357-P359 HydrophobicContact CE1-CG 4.09Å; P359-C419 WeakPolarHBondContact CB-SG 3.28Å
360	V	94.9	Very high	95.9	Very high	32 Å²	32	54.5 Å²	54.5	19%	0.194	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-102.7	118.1	179.2	177.3	0	0	0	0	109.8	R358 L362 C419 T446 F447 P450	R358-V360 PolarHBondContact O-N 3.32Å; V360-L362 HydrophobicContact CG1-CD2 3.98Å; V360-L362 HydrophobicContact CG1-CG 4.19Å; V360-C419 VanDerWaalsContact C-SG 3.58Å; V360-T446 VanDerWaalsContact O-CB 3.23Å; V360-T446 WeakPolarHBondContact O-CB 3.49Å; V360-T446 PolarHBondContact O-OG1 2.8Å; V360-F447 HydrophobicContact CG2-CB 4.19Å; V360-F447 HydrophobicContact CG2-CD2 3.95Å; V360-F447 HydrophobicContact CG2-CG 4.46Å; V360-P450 HydrophobicContact CG1-CG 4.29Å
361	A	96.5	Very high	95.9	Very high	44 Å²	44	55 Å²	55	36%	0.364	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	127.9	175.6	0	0	0	0	0	110.9	T519	A361-T519 HydrophobicContact CB-CG2 3.93Å; A361-T519 PolarHBondContact O-OG1 3.18Å
362	L	96.4	Very high	95.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156.2	176.9	-60.2	177.4	0	0	0	110.4	V360 V418 T446 I449 L485 F516 T517	V360-L362 HydrophobicContact CG1-CD2 3.98Å; V360-L362 HydrophobicContact CG1-CG 4.19Å; L362-V418 HydrophobicContact CB-CG2 4.08Å; L362-V418 PolarHBondContact N-O 3.41Å; L362-V418 WeakPolarHBondContact O-CG2 3.48Å; L362-V418 PolarHBondContact O-N 3.26Å; L362-T446 HydrophobicContact CD1-CG2 4.12Å; L362-T446 HydrophobicContact CG-CG2 4.48Å; L362-I449 HydrophobicContact CD1-CB 3.83Å; L362-I449 HydrophobicContact CD1-CD1 4.27Å; L362-I449 HydrophobicContact CD1-CG2 3.89Å; L362-L485 HydrophobicContact CD2-CD1 4.18Å; L362-F516 HydrophobicContact CB-CB 4.41Å; L362-F516 HydrophobicContact CB-CD1 4.26Å; L362-F516 HydrophobicContact CD1-CB 4.19Å; L362-F516 HydrophobicContact CD1-CD1 4.24Å; L362-F516 HydrophobicContact CD1-CG 4.26Å; L362-T517 WeakPolarHBondContact CA-O 3.32Å
363	L	97.6	Very high	96	Very high	51 Å²	51	48.9 Å²	48.9	27%	0.267	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.1	165.3	-61.7	-179.2	0	0	0	108.8	H365 P415 P417 F516 T517 T519	L363-H365 PolarHBondContact O-CD2 2.92Å; L363-P415 HydrophobicContact CB-CB 3.9Å; L363-P415 HydrophobicContact CD1-CB 4.39Å; L363-P417 HydrophobicContact CD2-CB 4.35Å; L363-F516 CarbonylContact O-C 3.2Å; L363-F516 WeakPolarHBondContact O-CA 3.22Å; L363-T517 PolarHBondContact N-O 3.42Å; L363-T517 PolarHBondContact O-N 2.7Å; L363-T519 HydrophobicContact CD2-CG2 4Å; L363-T519 HydrophobicContact CG-CG2 3.97Å
364	F	97.9	Very high	96.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	113.4	178.6	-173.6	-165.7	0	0	0	109.2	K366 M367 V386 F412 L416 V418 V424 L514 F516	F364-K366 WeakPolarHBondContact CE2-O 3.12Å; F364-M367 HydrophobicContact CE1-CE 4.36Å; F364-M367 HydrophobicContact CE2-CG 3.99Å; F364-M367 HydrophobicContact CZ-CE 3.9Å; F364-M367 HydrophobicContact CZ-CG 3.73Å; F364-M367 HydrophobicContact CZ-SD 3.91Å; F364-V386 HydrophobicContact CE1-CG2 4.47Å; F364-F412 HydrophobicContact CB-CE2 4.28Å; F364-F412 AromaticContact CD1-CE2 3.62Å; F364-F412 HydrophobicContact CD1-CE2 3.62Å; F364-F412 AromaticContact CD1-CZ 3.65Å; F364-F412 HydrophobicContact CD1-CZ 3.65Å; F364-F412 AromaticContact CD2-CE2 3.88Å; F364-F412 HydrophobicContact CD2-CE2 3.88Å; F364-F412 AromaticContact CE1-CE2 3.85Å; F364-F412 HydrophobicContact CE1-CE2 3.85Å; F364-F412 AromaticContact CE1-CZ 3.69Å; F364-F412 HydrophobicContact CE1-CZ 3.69Å; F364-F412 HydrophobicContact CE2-CE2 4.08Å; F364-F412 AromaticContact CG-CE2 3.63Å; F364-F412 HydrophobicContact CG-CE2 3.63Å; F364-F412 HydrophobicContact CG-CZ 4.16Å; F364-F412 HydrophobicContact CZ-CE2 4.07Å; F364-F412 HydrophobicContact CZ-CZ 4.22Å; F364-F412 WeakPolarHBondContact O-CD2 3.44Å; F364-L416 HydrophobicContact CB-CB 4.35Å; F364-L416 WeakPolarHBondContact CB-O 3.24Å; F364-L416 HydrophobicContact CD1-CD2 4.43Å; F364-L416 PolarHBondContact N-O 2.8Å; F364-L416 PolarHBondContact O-N 3.45Å; F364-V418 HydrophobicContact CB-CG1 4.2Å; F364-V418 HydrophobicContact CB-CG2 3.96Å; F364-V418 HydrophobicContact CD1-CG1 4.28Å; F364-V424 HydrophobicContact CE1-CG2 4.22Å; F364-L514 HydrophobicContact CE2-CB 4.28Å; F364-L514 HydrophobicContact CE2-CD2 3.87Å; F364-L514 HydrophobicContact CZ-CD2 3.57Å; F364-F516 HydrophobicContact CB-CD1 3.68Å; F364-F516 HydrophobicContact CB-CE1 3.66Å; F364-F516 AromaticContact CD1-CE1 4Å; F364-F516 HydrophobicContact CD1-CE1 4Å; F364-F516 AromaticContact CD2-CD1 3.77Å; F364-F516 HydrophobicContact CD2-CD1 3.77Å; F364-F516 AromaticContact CD2-CE1 3.38Å; F364-F516 HydrophobicContact CD2-CE1 3.38Å; F364-F516 HydrophobicContact CD2-CE2 4.43Å; F364-F516 HydrophobicContact CD2-CG 4.42Å; F364-F516 AromaticContact CD2-CZ 3.76Å; F364-F516 HydrophobicContact CD2-CZ 3.76Å; F364-F516 AromaticContact CE2-CE1 3.97Å; F364-F516 HydrophobicContact CE2-CE1 3.97Å; F364-F516 HydrophobicContact CE2-CE2 4.48Å; F364-F516 AromaticContact CE2-CZ 3.88Å; F364-F516 HydrophobicContact CE2-CZ 3.88Å; F364-F516 AromaticContact CG-CD1 3.87Å; F364-F516 HydrophobicContact CG-CD1 3.87Å; F364-F516 AromaticContact CG-CE1 3.41Å; F364-F516 HydrophobicContact CG-CE1 3.41Å; F364-F516 VanDerWaalsContact CG-CE1 3.41Å; F364-F516 HydrophobicContact CG-CZ 4.15Å; F364-F516 HydrophobicContact CZ-CE1 4.5Å; F364-F516 HydrophobicContact CZ-CZ 4.34Å
365	H	97.3	Very high	96.1	Very high	25 Å²	25	43 Å²	43	12%	0.116	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-42.1	-168.3	-65.4	-102.5	0	0	0	113.3	L363 F412 P415 Y484 Y515 T517	L363-H365 PolarHBondContact O-CD2 2.92Å; H365-F412 WeakPolarHBondContact O-CD2 3.25Å; H365-F412 PolarHBondContact O-N 3.16Å; H365-F412 VanDerWaalsContact O-N 3.13Å; H365-P415 WeakPolarHBondContact ND1-CG 3.44Å; H365-Y484 HydrophobicContact CB-CE1 3.89Å; H365-Y484 AromaticContact CD2-CE1 3.82Å; H365-Y484 AromaticContact CG-CE1 3.68Å; H365-Y515 PolarHBondContact N-O 2.68Å; H365-T517 WeakPolarHBondContact NE2-CG2 3.42Å; H365-T517 PolarHBondContact NE2-OG1 2.85Å
366	K	97.5	Very high	96	Very high	38 Å²	38	42.6 Å²	42.6	17%	0.165	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	163.9	180	61	-173.5	178.9	-176.7	0	114.5	F364 F410 E411 Y515	F364-K366 WeakPolarHBondContact CE2-O 3.12Å; K366-F410 CarbonylContact C-O 3.51Å; K366-F410 VanDerWaalsContact CA-O 3.25Å; K366-F410 WeakPolarHBondContact CA-O 3.43Å; K366-E411 HydrophobicContact CB-CB 4.25Å; K366-E411 HydrophobicContact CB-CG 3.53Å; K366-E411 HydrophobicContact CD-CG 3.68Å; K366-E411 HydrophobicContact CG-CG 4.26Å; K366-E411 IonicContact NZ-OE1 3.96Å; K366-Y515 HydrophobicContact CG-CD2 3.75Å; K366-Y515 HydrophobicContact CG-CG 3.84Å; K366-Y515 PolarHBondContact O-N 3.03Å
367	M	98.4	Very high	95.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	154.4	160.1	-76.5	167	-77.5	0	0	111.6	F364 F384 Y409 F410 F412 V424 F426 F442 V512 K513 L514	F364-M367 HydrophobicContact CE1-CE 4.36Å; F364-M367 HydrophobicContact CE2-CG 3.99Å; F364-M367 HydrophobicContact CZ-CE 3.9Å; F364-M367 HydrophobicContact CZ-CG 3.73Å; F364-M367 HydrophobicContact CZ-SD 3.91Å; M367-F384 HydrophobicContact CE-CD1 4.45Å; M367-F384 HydrophobicContact CE-CD2 3.64Å; M367-F384 HydrophobicContact CE-CE1 4.26Å; M367-F384 HydrophobicContact CE-CE2 3.38Å; M367-F384 HydrophobicContact CE-CG 4.16Å; M367-F384 HydrophobicContact CE-CZ 3.72Å; M367-Y409 WeakPolarHBondContact O-CA 3.44Å; M367-F410 HydrophobicContact CB-CB 4.11Å; M367-F410 HydrophobicContact CB-CD2 4.23Å; M367-F410 PolarHBondContact N-O 2.95Å; M367-F410 PolarHBondContact O-N 2.78Å; M367-F412 HydrophobicContact CE-CZ 4.28Å; M367-V424 HydrophobicContact CE-CG1 4.04Å; M367-V424 HydrophobicContact SD-CG1 3.91Å; M367-F426 HydrophobicContact CE-CE2 4.26Å; M367-F426 HydrophobicContact CE-CZ 3.92Å; M367-F426 HydrophobicContact SD-CE2 3.64Å; M367-F426 HydrophobicContact SD-CZ 3.63Å; M367-F442 HydrophobicContact SD-CZ 4.35Å; M367-V512 HydrophobicContact CG-CG1 4.38Å; M367-K513 CarbonylContact C-O 3.6Å; M367-K513 VanDerWaalsContact CA-O 3.26Å; M367-K513 WeakPolarHBondContact CA-O 3.33Å; M367-L514 HydrophobicContact CG-CD2 3.37Å; M367-L514 HydrophobicContact CG-CG 4.45Å; M367-L514 HydrophobicContact SD-CD2 3.74Å
368	M	97.8	Very high	95.4	Very high	13 Å²	13	40.7 Å²	40.7	6%	0.064	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134	169.7	-174	-163.7	78.5	0	0	110.5	E370 F407 M408 Y409 V512 K513 Y515	M368-E370 HydrophobicContact CE-CG 3.77Å; M368-F407 HydrophobicContact CE-CD1 3.92Å; M368-F407 HydrophobicContact CE-CE1 4.11Å; M368-F407 HydrophobicContact CG-CD1 4.41Å; M368-F407 HydrophobicContact SD-CD1 3.84Å; M368-F407 HydrophobicContact SD-CE1 4.43Å; M368-M408 CarbonylContact C-O 3.5Å; M368-M408 WeakPolarHBondContact CA-O 3.43Å; M368-Y409 HydrophobicContact CB-CD1 4.05Å; M368-Y409 HydrophobicContact CB-CE1 4.13Å; M368-Y409 HydrophobicContact CG-CD1 3.78Å; M368-Y409 HydrophobicContact CG-CE1 3.5Å; M368-Y409 HydrophobicContact CG-CG 4.46Å; M368-Y409 HydrophobicContact SD-CD1 4.41Å; M368-Y409 HydrophobicContact SD-CE1 3.56Å; M368-Y409 VanDerWaalsContact SD-CE1 3.56Å; M368-V512 CarbonylContact O-C 3.56Å; M368-V512 WeakPolarHBondContact O-CA 3.49Å; M368-K513 HydrophobicContact CB-CB 4.44Å; M368-K513 HydrophobicContact CE-CB 4.49Å; M368-K513 HydrophobicContact CE-CD 3.95Å; M368-K513 HydrophobicContact CE-CG 4.22Å; M368-K513 PolarHBondContact N-O 2.82Å; M368-K513 PolarHBondContact O-N 3.22Å; M368-Y515 HydrophobicContact CB-CE2 4.17Å
369	F	98.2	Very high	95.4	Very high	0 Å²	0	35 Å²	35	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.1	165.8	-63.7	-4.7	0	0	0	109.9	P373 F407 M408 F410 F426 F440 F510 K511 V512	F369-P373 HydrophobicContact CD2-CG 3.99Å; F369-P373 HydrophobicContact CE2-CG 3.96Å; F369-F407 WeakPolarHBondContact O-CA 3.39Å; F369-M408 HydrophobicContact CB-CB 4.23Å; F369-M408 HydrophobicContact CD2-CB 4.27Å; F369-M408 HydrophobicContact CD2-SD 4.34Å; F369-M408 HydrophobicContact CG-CB 4.47Å; F369-M408 PolarHBondContact N-O 3.43Å; F369-M408 PolarHBondContact O-N 2.71Å; F369-F410 HydrophobicContact CD1-CD2 4.4Å; F369-F410 AromaticContact CD1-CE2 3.79Å; F369-F410 HydrophobicContact CD1-CE2 3.79Å; F369-F410 AromaticContact CD2-CE2 3.8Å; F369-F410 HydrophobicContact CD2-CE2 3.8Å; F369-F410 HydrophobicContact CD2-CZ 4.13Å; F369-F410 HydrophobicContact CE1-CD2 4.27Å; F369-F410 AromaticContact CE1-CE2 3.67Å; F369-F410 HydrophobicContact CE1-CE2 3.67Å; F369-F410 HydrophobicContact CE1-CZ 4.36Å; F369-F410 AromaticContact CE2-CE2 3.71Å; F369-F410 HydrophobicContact CE2-CE2 3.71Å; F369-F410 AromaticContact CE2-CZ 3.73Å; F369-F410 HydrophobicContact CE2-CZ 3.73Å; F369-F410 AromaticContact CG-CE2 3.86Å; F369-F410 HydrophobicContact CG-CE2 3.86Å; F369-F410 AromaticContact CZ-CE2 3.64Å; F369-F410 HydrophobicContact CZ-CE2 3.64Å; F369-F410 AromaticContact CZ-CZ 3.87Å; F369-F410 HydrophobicContact CZ-CZ 3.87Å; F369-F426 HydrophobicContact CE1-CD1 4.42Å; F369-F426 AromaticContact CE1-CE1 3.86Å; F369-F426 HydrophobicContact CE1-CE1 3.86Å; F369-F426 HydrophobicContact CE1-CE2 4.18Å; F369-F426 AromaticContact CE1-CZ 3.73Å; F369-F426 HydrophobicContact CE1-CZ 3.73Å; F369-F426 HydrophobicContact CE2-CE1 4.41Å; F369-F426 AromaticContact CZ-CD1 3.63Å; F369-F426 HydrophobicContact CZ-CD1 3.63Å; F369-F426 HydrophobicContact CZ-CD2 4.44Å; F369-F426 AromaticContact CZ-CE1 3.4Å; F369-F426 HydrophobicContact CZ-CE1 3.4Å; F369-F426 VanDerWaalsContact CZ-CE1 3.4Å; F369-F426 HydrophobicContact CZ-CE2 4.26Å; F369-F426 HydrophobicContact CZ-CG 4.15Å; F369-F426 AromaticContact CZ-CZ 3.76Å; F369-F426 HydrophobicContact CZ-CZ 3.76Å; F369-F440 HydrophobicContact CE1-CE1 4.31Å; F369-F440 AromaticContact CE1-CZ 3.73Å; F369-F440 HydrophobicContact CE1-CZ 3.73Å; F369-F440 HydrophobicContact CE2-CE1 4.37Å; F369-F440 AromaticContact CZ-CE1 3.76Å; F369-F440 HydrophobicContact CZ-CE1 3.76Å; F369-F440 AromaticContact CZ-CZ 3.59Å; F369-F440 HydrophobicContact CZ-CZ 3.59Å; F369-F510 HydrophobicContact CB-CE2 3.88Å; F369-F510 HydrophobicContact CD1-CE2 4.26Å; F369-F510 HydrophobicContact CD1-CZ 4.11Å; F369-F510 AromaticContact CD2-CE2 3.74Å; F369-F510 HydrophobicContact CD2-CE2 3.74Å; F369-F510 AromaticContact CD2-CZ 3.99Å; F369-F510 HydrophobicContact CD2-CZ 3.99Å; F369-F510 HydrophobicContact CE1-CZ 4.26Å; F369-F510 HydrophobicContact CE2-CE2 4.3Å; F369-F510 HydrophobicContact CE2-CZ 4.13Å; F369-F510 AromaticContact CG-CE2 3.7Å; F369-F510 HydrophobicContact CG-CE2 3.7Å; F369-F510 AromaticContact CG-CZ 3.98Å; F369-F510 HydrophobicContact CG-CZ 3.98Å; F369-F510 HydrophobicContact CZ-CZ 4.25Å; F369-K511 WeakPolarHBondContact CA-O 3.33Å; F369-V512 HydrophobicContact CD1-CB 4.38Å; F369-V512 HydrophobicContact CD1-CG1 4.16Å; F369-V512 HydrophobicContact CD1-CG2 3.74Å; F369-V512 HydrophobicContact CE1-CG1 4.09Å; F369-V512 HydrophobicContact CE1-CG2 3.74Å
370	E	93.6	Very high	95.4	Very high	38 Å²	38	31.9 Å²	31.9	18%	0.178	21%	0.21	C	C	.	.	S	Bend	trans	-78.7	-22.8	175.2	-72.3	-174.1	-167	0	0	114.1	M368 F407 K511	M368-E370 HydrophobicContact CE-CG 3.77Å; E370-F407 HydrophobicContact CB-CE1 4.35Å; E370-F407 HydrophobicContact CG-CE1 4.31Å; E370-K511 HydrophobicContact CB-CB 4.42Å; E370-K511 HydrophobicContact CG-CB 4.11Å; E370-K511 PolarHBondContact N-O 3.36Å; E370-K511 VanDerWaalsContact N-O 3.08Å; E370-K511 WeakPolarHBondContact OE1-CD 3.24Å; E370-K511 IonicContact OE1-NZ 3.14Å; E370-K511 PolarHBondContact OE1-NZ 3.02Å; E370-K511 IonicContact OE2-NZ 2.76Å; E370-K511 PolarHBondContact OE2-NZ 3.42Å
371	T	96.3	Very high	95.4	Very high	25 Å²	25	32.1 Å²	32.1	15%	0.153	21%	0.21	C	C	.	.	S	Bend	trans	-143.1	153.6	176.3	68.3	0	0	0	0	111.2	P373 K406 S507 F510	T371-P373 WeakPolarHBondContact O-CD 3.15Å; T371-K406 CarbonylContact C-O 3.58Å; T371-K406 WeakPolarHBondContact CA-O 3.01Å; T371-S507 WeakPolarHBondContact OG1-CB 3.32Å; T371-F510 VanDerWaalsContact O-CD2 3.24Å; T371-F510 WeakPolarHBondContact O-CD2 3.39Å; T371-F510 WeakPolarHBondContact O-CE2 3.36Å
372	I	96.9	Very high	95.5	Very high	32 Å²	32	30 Å²	30	16%	0.164	19%	0.193	C	C	.	.			trans	-74.1	127.1	-178.9	-59.2	144.8	0	0	0	112	K406 M408	I372-K406 PolarHBondContact N-O 3.04Å; I372-M408 HydrophobicContact CG1-CE 4.26Å; I372-M408 HydrophobicContact CG2-CE 3.92Å
373	P	97.2	Very high	95.5	Very high	0 Å²	0	31 Å²	31	0%	0	20%	0.197	C	C	.	.			trans	-69.4	142.6	166.4	-21.5	34.6	0	0	0	113.1	F369 T371 F375 T379 C380 M439 Y505 F506 F510	F369-P373 HydrophobicContact CD2-CG 3.99Å; F369-P373 HydrophobicContact CE2-CG 3.96Å; T371-P373 WeakPolarHBondContact O-CD 3.15Å; P373-F375 HydrophobicContact CB-CD2 3.84Å; P373-F375 HydrophobicContact CB-CE2 3.92Å; P373-T379 CarbonylContact O-C 3.02Å; P373-T379 WeakPolarHBondContact O-CA 3.49Å; P373-C380 HydrophobicContact CB-CB 4.33Å; P373-C380 WeakPolarHBondContact O-CB 3.17Å; P373-C380 PolarHBondContact O-N 2.98Å; P373-M439 HydrophobicContact CB-CE 3.6Å; P373-M439 HydrophobicContact CG-CE 3.7Å; P373-Y505 CarbonylContact C-O 3.45Å; P373-Y505 WeakPolarHBondContact CA-O 3.39Å; P373-F506 HydrophobicContact CB-CD1 3.98Å; P373-F506 HydrophobicContact CB-CE1 3.91Å; P373-F506 HydrophobicContact CG-CD1 4.1Å; P373-F506 HydrophobicContact CG-CE1 4.04Å; P373-F510 HydrophobicContact CG-CD2 4.45Å; P373-F510 HydrophobicContact CG-CE2 3.71Å; P373-F510 HydrophobicContact CG-CZ 4.03Å
374	M	95.9	Very high	95.5	Very high	77 Å²	77	28.8 Å²	28.8	38%	0.379	19%	0.185	S	C	.	.			trans	-107.8	61.2	-167.4	-59.1	-178.2	-66	0	0	112.2	N503 Y505	M374-N503 WeakPolarHBondContact CE-O 3.25Å; M374-Y505 PolarHBondContact N-O 2.98Å
375	F	94.3	Very high	95.5	Very high	41 Å²	41	29.8 Å²	29.8	18%	0.18	19%	0.191	C	C	.	.	S	Bend	trans	-86.7	-24.8	-176.5	-80.1	-103.3	0	0	0	114.2	P373 T379 C380 H428 M439 Y505 F506	P373-F375 HydrophobicContact CB-CD2 3.84Å; P373-F375 HydrophobicContact CB-CE2 3.92Å; F375-T379 PolarHBondContact N-O 3.36Å; F375-C380 HydrophobicContact CB-CB 4.17Å; F375-C380 HydrophobicContact CD2-CB 4.37Å; F375-H428 HydrophobicContact CB-CB 4.07Å; F375-H428 HydrophobicContact CD1-CB 4.03Å; F375-H428 HydrophobicContact CG-CB 4.11Å; F375-M439 HydrophobicContact CD1-CG 4.21Å; F375-M439 HydrophobicContact CD2-CE 3.97Å; F375-M439 HydrophobicContact CD2-CG 4.2Å; F375-M439 HydrophobicContact CE1-CB 4.24Å; F375-M439 HydrophobicContact CE1-CG 3.84Å; F375-M439 HydrophobicContact CE2-CB 4.07Å; F375-M439 HydrophobicContact CE2-CE 3.88Å; F375-M439 HydrophobicContact CE2-CG 3.84Å; F375-M439 HydrophobicContact CG-CG 4.4Å; F375-M439 HydrophobicContact CZ-CB 3.72Å; F375-M439 HydrophobicContact CZ-CG 3.66Å; F375-Y505 HydrophobicContact CD1-CD1 4.01Å; F375-Y505 HydrophobicContact CD1-CE1 4.33Å; F375-Y505 HydrophobicContact CD2-CD1 4.28Å; F375-Y505 AromaticContact CE1-CD1 3.93Å; F375-Y505 HydrophobicContact CE1-CD1 3.93Å; F375-Y505 HydrophobicContact CE1-CE1 4.38Å; F375-Y505 HydrophobicContact CE1-CG 4.43Å; F375-Y505 HydrophobicContact CE2-CD1 4.2Å; F375-Y505 HydrophobicContact CE2-CG 4.4Å; F375-Y505 HydrophobicContact CG-CD1 4.17Å; F375-Y505 HydrophobicContact CZ-CD1 4.01Å; F375-Y505 HydrophobicContact CZ-CG 4.15Å; F375-F506 AromaticContact CE2-CE1 3.96Å; F375-F506 HydrophobicContact CE2-CE1 3.96Å; F375-F506 AromaticContact CE2-CE2 4Å; F375-F506 HydrophobicContact CE2-CE2 4Å; F375-F506 AromaticContact CE2-CZ 3.55Å; F375-F506 HydrophobicContact CE2-CZ 3.55Å; F375-F506 HydrophobicContact CZ-CE1 4.49Å; F375-F506 AromaticContact CZ-CE2 3.91Å; F375-F506 HydrophobicContact CZ-CE2 3.91Å; F375-F506 AromaticContact CZ-CZ 3.65Å; F375-F506 HydrophobicContact CZ-CZ 3.65Å
376	S	91.9	Very high	95.6	Very high	58 Å²	58	28.6 Å²	28.6	41%	0.406	19%	0.186	S	C	.	.	B	Isolated β-bridge	trans	-153.5	121.8	176.1	-163.8	0	0	0	0	110.2	G378 T379	S376-G378 VanDerWaalsContact C-N 3.29Å; S376-G378 PolarHBondContact O-N 3.08Å; S376-T379 PolarHBondContact N-O 3.11Å; S376-T379 CarbonylContact O-C 3.51Å; S376-T379 WeakPolarHBondContact O-CG2 3.28Å; S376-T379 PolarHBondContact O-N 2.85Å
377	G	87.9	Confident	95.7	Very high	86 Å²	86	27.9 Å²	27.9	89%	0.887	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	35	177.3	0	0	0	0	0	114.9	T379	G377-T379 VanDerWaalsContact C-N 3.27Å; G377-T379 PolarHBondContact O-N 2.74Å
378	G	90	Very high	95.5	Very high	51 Å²	51	30.4 Å²	30.4	53%	0.526	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	75	8.7	-176.8	0	0	0	0	0	115.1	S376	S376-G378 VanDerWaalsContact C-N 3.29Å; S376-G378 PolarHBondContact O-N 3.08Å
379	T	92.9	Very high	95.2	Very high	47 Å²	47	33.9 Å²	33.9	29%	0.288	22%	0.216	S	C	.	.	B	Isolated β-bridge	trans	-137.6	-179.5	177.5	-170.5	0	0	0	0	110.7	P373 F375 S376 G377 R403	P373-T379 CarbonylContact O-C 3.02Å; P373-T379 WeakPolarHBondContact O-CA 3.49Å; F375-T379 PolarHBondContact N-O 3.36Å; S376-T379 PolarHBondContact N-O 3.11Å; S376-T379 CarbonylContact O-C 3.51Å; S376-T379 WeakPolarHBondContact O-CG2 3.28Å; S376-T379 PolarHBondContact O-N 2.85Å; G377-T379 VanDerWaalsContact C-N 3.27Å; G377-T379 PolarHBondContact O-N 2.74Å; T379-R403 PolarHBondContact OG1-NH1 2.99Å
380	C	94.9	Very high	94.7	Very high	11 Å²	11	41.6 Å²	41.6	7%	0.074	25%	0.25	C	C	.	.			trans	-134.7	155.6	169.9	63.9	0	0	0	0	111.3	P373 F375 P382 M439	P373-C380 HydrophobicContact CB-CB 4.33Å; P373-C380 WeakPolarHBondContact O-CB 3.17Å; P373-C380 PolarHBondContact O-N 2.98Å; F375-C380 HydrophobicContact CB-CB 4.17Å; F375-C380 HydrophobicContact CD2-CB 4.37Å; C380-P382 WeakPolarHBondContact O-CD 3.41Å; C380-M439 HydrophobicContact CB-CE 4.14Å
381	N	95	Very high	94.8	Very high	38 Å²	38	44.4 Å²	44.4	20%	0.203	27%	0.269	C	S	.	.			trans	-105.4	91.4	161.6	-178.8	4.5	0	0	0	107.6	G399 H428 K429 N431	N381-G399 PolarHBondContact OD1-N 2.99Å; N381-H428 PolarHBondContact N-CE1 3.35Å; N381-H428 PolarHBondContact N-ND1 2.62Å; N381-H428 VanDerWaalsContact N-ND1 3.14Å; N381-H428 WeakPolarHBondContact O-CA 3.12Å; N381-H428 PolarHBondContact O-ND1 3.4Å; N381-K429 WeakPolarHBondContact CB-O 3.31Å; N381-K429 PolarHBondContact ND2-O 3.07Å; N381-K429 PolarHBondContact O-N 3.12Å; N381-N431 PolarHBondContact ND2-OD1 3.16Å
382	P	96.7	Very high	94.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	147.9	-173.7	31.7	-35.5	0	0	0	112.6	C380 G399 M408 F410 F426 F427 M439	C380-P382 WeakPolarHBondContact O-CD 3.41Å; P382-G399 PolarHBondContact O-N 2.9Å; P382-M408 HydrophobicContact CG-SD 4.49Å; P382-F410 HydrophobicContact CB-CE1 3.89Å; P382-F410 HydrophobicContact CB-CZ 3.98Å; P382-F410 HydrophobicContact CG-CE1 3.55Å; P382-F410 HydrophobicContact CG-CZ 3.66Å; P382-F426 HydrophobicContact CB-CD1 4.49Å; P382-F427 CarbonylContact C-O 3.55Å; P382-F427 WeakPolarHBondContact CA-O 3.24Å; P382-M439 HydrophobicContact CB-SD 4.34Å
383	Q	96.9	Very high	94.9	Very high	20 Å²	20	50.7 Å²	50.7	9%	0.093	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.6	162.7	-178	178.6	36.2	0	0	107.4	S396 F426 F427	Q383-S396 WeakPolarHBondContact CG-OG 3.45Å; Q383-S396 PolarHBondContact NE2-O 2.92Å; Q383-F426 WeakPolarHBondContact O-CA 2.97Å; Q383-F427 PolarHBondContact N-O 3Å; Q383-F427 PolarHBondContact O-N 3.46Å
384	F	98.3	Very high	95	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	159.8	176.4	73.1	-86.2	0	0	0	113.8	M367 V386 Y394 S396 F410 F412 V424 E425 F426	M367-F384 HydrophobicContact CE-CD1 4.45Å; M367-F384 HydrophobicContact CE-CD2 3.64Å; M367-F384 HydrophobicContact CE-CE1 4.26Å; M367-F384 HydrophobicContact CE-CE2 3.38Å; M367-F384 HydrophobicContact CE-CG 4.16Å; M367-F384 HydrophobicContact CE-CZ 3.72Å; F384-V386 HydrophobicContact CD2-CG2 3.91Å; F384-V386 HydrophobicContact CE2-CG2 3.8Å; F384-Y394 HydrophobicContact CD2-CD1 4.32Å; F384-Y394 HydrophobicContact CE1-CE1 4.27Å; F384-Y394 AromaticContact CE2-CD1 3.6Å; F384-Y394 HydrophobicContact CE2-CD1 3.6Å; F384-Y394 AromaticContact CE2-CE1 3.64Å; F384-Y394 HydrophobicContact CE2-CE1 3.64Å; F384-Y394 AromaticContact CZ-CD1 3.98Å; F384-Y394 HydrophobicContact CZ-CD1 3.98Å; F384-Y394 AromaticContact CZ-CE1 3.5Å; F384-Y394 HydrophobicContact CZ-CE1 3.5Å; F384-Y394 VanDerWaalsContact CZ-CE1 3.5Å; F384-S396 VanDerWaalsContact CD1-CB 3.45Å; F384-S396 WeakPolarHBondContact CD1-OG 3.38Å; F384-S396 PolarHBondContact N-OG 2.99Å; F384-S396 PolarHBondContact O-N 2.86Å; F384-S396 PolarHBondContact O-OG 3.16Å; F384-F410 HydrophobicContact CD1-CB 4.42Å; F384-F410 AromaticContact CD1-CD1 3.94Å; F384-F410 HydrophobicContact CD1-CD1 3.94Å; F384-F410 HydrophobicContact CD1-CG 4.44Å; F384-F410 HydrophobicContact CE1-CB 3.75Å; F384-F410 AromaticContact CE1-CD1 3.91Å; F384-F410 HydrophobicContact CE1-CD1 3.91Å; F384-F410 HydrophobicContact CE1-CG 4.2Å; F384-F410 HydrophobicContact CZ-CB 4.3Å; F384-F412 AromaticContact CE2-CE1 3.64Å; F384-F412 HydrophobicContact CE2-CE1 3.64Å; F384-F412 AromaticContact CE2-CZ 3.8Å; F384-F412 HydrophobicContact CE2-CZ 3.8Å; F384-F412 HydrophobicContact CZ-CD1 4.46Å; F384-F412 AromaticContact CZ-CE1 3.87Å; F384-F412 HydrophobicContact CZ-CE1 3.87Å; F384-F412 HydrophobicContact CZ-CZ 4.12Å; F384-V424 HydrophobicContact CD2-CG1 4.26Å; F384-E425 CarbonylContact C-O 3.51Å; F384-E425 VanDerWaalsContact CA-O 3.25Å; F384-E425 WeakPolarHBondContact CA-O 3.34Å; F384-F426 HydrophobicContact CB-CD1 3.65Å; F384-F426 HydrophobicContact CB-CD2 4.11Å; F384-F426 HydrophobicContact CB-CE1 3.59Å; F384-F426 HydrophobicContact CB-CE2 4.05Å; F384-F426 HydrophobicContact CB-CG 3.92Å; F384-F426 HydrophobicContact CB-CZ 3.8Å; F384-F426 AromaticContact CD1-CE1 3.97Å; F384-F426 HydrophobicContact CD1-CE1 3.97Å; F384-F426 HydrophobicContact CD1-CZ 4.22Å; F384-F426 HydrophobicContact CG-CE1 4.02Å; F384-F426 HydrophobicContact CG-CZ 4.03Å
385	V	98.4	Very high	95.1	Very high	21 Å²	21	52 Å²	52	13%	0.127	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.9	175.6	176.2	0	0	0	0	107.9	K392 Y394 V424 E425 F427	V385-K392 HydrophobicContact CG1-CD 3.89Å; V385-K392 HydrophobicContact CG1-CG 3.49Å; V385-K392 VanDerWaalsContact CG1-CG 3.49Å; V385-Y394 WeakPolarHBondContact CA-O 3.13Å; V385-V424 WeakPolarHBondContact O-CA 3.33Å; V385-E425 PolarHBondContact N-O 2.92Å; V385-E425 PolarHBondContact O-N 2.88Å; V385-F427 HydrophobicContact CB-CE2 4.48Å; V385-F427 HydrophobicContact CG2-CE2 4.04Å
386	V	98.7	Very high	95.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129	170.1	-170.7	0	0	0	0	108.3	F364 F384 I393 Y394 F412 L416 K423 V424	F364-V386 HydrophobicContact CE1-CG2 4.47Å; F384-V386 HydrophobicContact CD2-CG2 3.91Å; F384-V386 HydrophobicContact CE2-CG2 3.8Å; V386-I393 HydrophobicContact CB-CG1 4.17Å; V386-I393 HydrophobicContact CG1-CD1 3.95Å; V386-I393 HydrophobicContact CG1-CG1 3.96Å; V386-I393 WeakPolarHBondContact O-CG1 3.43Å; V386-I393 PolarHBondContact O-N 3.12Å; V386-Y394 HydrophobicContact CG2-CD1 4.42Å; V386-Y394 PolarHBondContact N-O 3.13Å; V386-Y394 PolarHBondContact O-N 2.71Å; V386-Y394 VanDerWaalsContact O-N 3.11Å; V386-F412 HydrophobicContact CG2-CE1 4.1Å; V386-F412 HydrophobicContact CG2-CZ 4.04Å; V386-L416 HydrophobicContact CB-CD2 4.08Å; V386-L416 HydrophobicContact CG1-CD2 4.02Å; V386-L416 HydrophobicContact CG2-CD2 4.12Å; V386-K423 WeakPolarHBondContact CA-O 3.41Å; V386-V424 HydrophobicContact CG1-CG2 4.35Å; V386-V424 HydrophobicContact CG2-CG1 4.44Å; V386-V424 HydrophobicContact CG2-CG2 4.34Å
387	C	98.5	Very high	95.3	Very high	24 Å²	24	54.6 Å²	54.6	16%	0.162	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.8	170.6	-57.7	0	0	0	0	110.3	V391 I422 K423	C387-V391 CarbonylContact C-O 3.59Å; C387-V391 WeakPolarHBondContact CA-O 3.44Å; C387-V391 WeakPolarHBondContact CB-O 3.17Å; C387-I422 WeakPolarHBondContact O-CA 3.33Å; C387-K423 HydrophobicContact CB-CB 4.35Å; C387-K423 PolarHBondContact N-O 2.89Å; C387-K423 PolarHBondContact O-N 2.97Å
388	Q	95.8	Very high	95.6	Very high	53 Å²	53	52.7 Å²	52.7	25%	0.248	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.9	165.3	-175.7	173.4	-51	0	0	106.9	K390 V391 I393 C419 I422	Q388-K390 PolarHBondContact O-N 2.85Å; Q388-V391 PolarHBondContact N-O 2.87Å; Q388-V391 PolarHBondContact O-N 2.7Å; Q388-I393 HydrophobicContact CB-CD1 4.07Å; Q388-I393 HydrophobicContact CB-CG2 4.24Å; Q388-C419 WeakPolarHBondContact CG-O 3.34Å; Q388-C419 PolarHBondContact NE2-O 2.68Å; Q388-C419 PolarHBondContact OE1-O 3.16Å; Q388-I422 HydrophobicContact CB-CG2 4.17Å; Q388-I422 HydrophobicContact CG-CG2 4.12Å
389	L	90.4	Very high	95.8	Very high	85 Å²	85	51.4 Å²	51.4	45%	0.445	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	-119.8	-165.2	-50.8	177.2	0	0	0	111	Q266 D421	Q266-L389 HydrophobicContact CG-CD2 4.29Å; L389-D421 PolarHBondContact N-O 2.63Å
390	K	87.6	Confident	95.9	Very high	163 Å²	163	51 Å²	51	71%	0.709	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-1.2	175	-66.1	-172.2	172.6	-170.8	0	114	E260 Q388	E260-K390 WeakPolarHBondContact OE1-CE 3.32Å; E260-K390 IonicContact OE1-NZ 2.63Å; E260-K390 PolarHBondContact OE1-NZ 2.81Å; Q388-K390 PolarHBondContact O-N 2.85Å
391	V	96.4	Very high	95.9	Very high	97 Å²	97	54.3 Å²	54.3	59%	0.588	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	129.2	-173.6	-178.1	0	0	0	0	111	C387 Q388 I393	C387-V391 CarbonylContact C-O 3.59Å; C387-V391 WeakPolarHBondContact CA-O 3.44Å; C387-V391 WeakPolarHBondContact CB-O 3.17Å; Q388-V391 PolarHBondContact N-O 2.87Å; Q388-V391 PolarHBondContact O-N 2.7Å; V391-I393 HydrophobicContact CG1-CG2 4.2Å; V391-I393 PolarHBondContact O-N 3.37Å
392	K	97.8	Very high	95.9	Very high	129 Å²	129	57.6 Å²	57.6	56%	0.561	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	88.3	177.3	-168.3	-158.5	72.3	-177.5	0	111.5	V385	V385-K392 HydrophobicContact CG1-CD 3.89Å; V385-K392 HydrophobicContact CG1-CG 3.49Å; V385-K392 VanDerWaalsContact CG1-CG 3.49Å
393	I	98.1	Very high	95.7	Very high	59 Å²	59	63.5 Å²	63.5	30%	0.303	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-24.3	-176.9	61.2	168.4	0	0	0	114.3	V386 Q388 V391 L416 V418	V386-I393 HydrophobicContact CB-CG1 4.17Å; V386-I393 HydrophobicContact CG1-CD1 3.95Å; V386-I393 HydrophobicContact CG1-CG1 3.96Å; V386-I393 WeakPolarHBondContact O-CG1 3.43Å; V386-I393 PolarHBondContact O-N 3.12Å; Q388-I393 HydrophobicContact CB-CD1 4.07Å; Q388-I393 HydrophobicContact CB-CG2 4.24Å; V391-I393 HydrophobicContact CG1-CG2 4.2Å; V391-I393 PolarHBondContact O-N 3.37Å; I393-L416 HydrophobicContact CD1-CD1 4.37Å; I393-L416 HydrophobicContact CD1-CD2 3.9Å; I393-L416 HydrophobicContact CD1-CG 4.18Å; I393-L416 HydrophobicContact CG1-CD2 4.24Å; I393-V418 HydrophobicContact CD1-CG1 3.92Å
394	Y	98.5	Very high	95.5	Very high	53 Å²	53	66.2 Å²	66.2	21%	0.208	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	152.7	174.5	-173	-99.2	0	0	0	113.2	F384 V385 V386 F412	F384-Y394 HydrophobicContact CD2-CD1 4.32Å; F384-Y394 HydrophobicContact CE1-CE1 4.27Å; F384-Y394 AromaticContact CE2-CD1 3.6Å; F384-Y394 HydrophobicContact CE2-CD1 3.6Å; F384-Y394 AromaticContact CE2-CE1 3.64Å; F384-Y394 HydrophobicContact CE2-CE1 3.64Å; F384-Y394 AromaticContact CZ-CD1 3.98Å; F384-Y394 HydrophobicContact CZ-CD1 3.98Å; F384-Y394 AromaticContact CZ-CE1 3.5Å; F384-Y394 HydrophobicContact CZ-CE1 3.5Å; F384-Y394 VanDerWaalsContact CZ-CE1 3.5Å; V385-Y394 WeakPolarHBondContact CA-O 3.13Å; V386-Y394 HydrophobicContact CG2-CD1 4.42Å; V386-Y394 PolarHBondContact N-O 3.13Å; V386-Y394 PolarHBondContact O-N 2.71Å; V386-Y394 VanDerWaalsContact O-N 3.11Å; Y394-F412 AromaticContact CD1-CD1 3.82Å; Y394-F412 HydrophobicContact CD1-CD1 3.82Å; Y394-F412 AromaticContact CD1-CE1 3.46Å; Y394-F412 HydrophobicContact CD1-CE1 3.46Å; Y394-F412 VanDerWaalsContact CD1-CE1 3.46Å; Y394-F412 AromaticContact CD2-CD1 3.97Å; Y394-F412 HydrophobicContact CD2-CD1 3.97Å; Y394-F412 HydrophobicContact CD2-CE1 4.27Å; Y394-F412 AromaticContact CE1-CD1 3.69Å; Y394-F412 HydrophobicContact CE1-CD1 3.69Å; Y394-F412 AromaticContact CE1-CE1 3.68Å; Y394-F412 HydrophobicContact CE1-CE1 3.68Å; Y394-F412 AromaticContact CE2-CD1 3.87Å; Y394-F412 HydrophobicContact CE2-CD1 3.87Å; Y394-F412 HydrophobicContact CE2-CE1 4.48Å; Y394-F412 AromaticContact CG-CD1 3.93Å; Y394-F412 HydrophobicContact CG-CD1 3.93Å; Y394-F412 AromaticContact CG-CE1 3.75Å; Y394-F412 HydrophobicContact CG-CE1 3.75Å; Y394-F412 AromaticContact CZ-CD1 3.7Å
395	S	97.9	Very high	95.1	Very high	51 Å²	51	71.5 Å²	71.5	36%	0.357	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	115.3	175.6	175.8	0	0	0	0	108.9
396	S	97.6	Very high	94.8	Very high	8 Å²	8	75.6 Å²	75.6	6%	0.056	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-73.7	163.5	-175.1	81.4	0	0	0	0	113	Q383 F384	Q383-S396 WeakPolarHBondContact CG-OG 3.45Å; Q383-S396 PolarHBondContact NE2-O 2.92Å; F384-S396 VanDerWaalsContact CD1-CB 3.45Å; F384-S396 WeakPolarHBondContact CD1-OG 3.38Å; F384-S396 PolarHBondContact N-OG 2.99Å; F384-S396 PolarHBondContact O-N 2.86Å; F384-S396 PolarHBondContact O-OG 3.16Å
397	N	94.1	Very high	94.7	Very high	146 Å²	146	79.3 Å²	79.3	78%	0.781	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-67.8	174	155.9	-74.5	-36.1	0	0	0	110.8
398	S	93.4	Very high	94.6	Very high	47 Å²	47	78.2 Å²	78.2	33%	0.329	39%	0.392	S	S	.	.	S	Bend	trans	-88.9	135.5	176.3	-49.9	0	0	0	0	110.8	K429	S398-K429 WeakPolarHBondContact OG-CD 3.27Å
399	G	93.4	Very high	94.7	Very high	23 Å²	23	77 Å²	77	24%	0.237	39%	0.385	C	S	.	.	S	Bend	trans	102.6	157.1	-170.9	0	0	0	0	0	112.6	N381 P382	N381-G399 PolarHBondContact OD1-N 2.99Å; P382-G399 PolarHBondContact O-N 2.9Å
400	P	95.6	Very high	95.1	Very high	40 Å²	40	73 Å²	73	26%	0.26	36%	0.364	S	S	.	.			trans	-70.4	160.4	164.6	33.3	-35.1	0	0	0	111	R403 M408 Y409 F410	P400-R403 HydrophobicContact CG-CB 4.32Å; P400-M408 HydrophobicContact CB-CB 4.06Å; P400-M408 HydrophobicContact CB-CG 4.41Å; P400-M408 HydrophobicContact CG-CB 4.49Å; P400-M408 HydrophobicContact CG-CG 4.3Å; P400-Y409 CarbonylContact C-O 3.45Å; P400-Y409 WeakPolarHBondContact CA-O 2.9Å; P400-Y409 WeakPolarHBondContact CB-O 3.15Å; P400-F410 HydrophobicContact CB-CD1 4.37Å; P400-F410 HydrophobicContact CB-CE1 3.98Å; P400-F410 HydrophobicContact CB-CZ 4.14Å
401	T	95.2	Very high	95.6	Very high	80 Å²	80	68 Å²	68	49%	0.491	34%	0.343	S	S	.	.	S	Bend	trans	-70.7	-37.6	172.1	53.4	0	0	0	0	111.6	Y409 E411	T401-Y409 PolarHBondContact N-O 3.39Å; T401-Y409 PolarHBondContact OG1-O 2.76Å; T401-E411 HydrophobicContact CG2-CB 4.18Å; T401-E411 WeakPolarHBondContact CG2-O 3.34Å; T401-E411 PolarHBondContact OG1-N 3Å; T401-E411 VanDerWaalsContact OG1-N 3.1Å; T401-E411 PolarHBondContact OG1-OE2 2.87Å
402	R	93.9	Very high	95.6	Very high	107 Å²	107	64.1 Å²	64.1	40%	0.404	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	148.5	178.5	-166.3	176.4	79.4	-179.7	22.4	110	E404 Y409	R402-E404 WeakPolarHBondContact CD-OE1 3.34Å; R402-E404 HydrophobicContact CG-CG 4.32Å; R402-E404 IonicContact CZ-OE1 3.9Å; R402-E404 IonicContact CZ-OE2 2.96Å; R402-E404 VanDerWaalsContact CZ-OE2 3.28Å; R402-E404 IonicContact NE-OE1 3.54Å; R402-E404 PolarHBondContact NE-OE1 3.33Å; R402-E404 IonicContact NE-OE2 3.29Å; R402-E404 PolarHBondContact NE-OE2 3.1Å; R402-E404 VanDerWaalsContact NE-OE2 3.14Å; R402-E404 IonicContact NH1-OE1 2.66Å; R402-E404 VanDerWaalsContact NH2-CD 3.33Å; R402-E404 IonicContact NH2-OE1 3.62Å; R402-E404 PolarHBondContact NH2-OE1 2.92Å; R402-E404 IonicContact NH2-OE2 2.74Å; R402-E404 PolarHBondContact NH2-OE2 3Å; R402-Y409 HydrophobicContact CB-CD2 4.04Å; R402-Y409 HydrophobicContact CB-CG 4.39Å; R402-Y409 HydrophobicContact CG-CD2 4.38Å; R402-Y409 PolarHBondContact O-N 2.52Å
403	R	93.1	Very high	95.6	Very high	123 Å²	123	63.5 Å²	63.5	46%	0.464	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.4	174.3	177.9	-179.8	172.6	166.4	-5.1	109.6	T379 P400 F407 M408	T379-R403 PolarHBondContact OG1-NH1 2.99Å; P400-R403 HydrophobicContact CG-CB 4.32Å; R403-F407 WeakPolarHBondContact CA-O 3.45Å; R403-F407 WeakPolarHBondContact CG-O 3.27Å; R403-M408 HydrophobicContact CG-CG 4.33Å
404	E	92.1	Very high	95.4	Very high	77 Å²	77	68.5 Å²	68.5	36%	0.36	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	104.3	-175.2	-71.4	167.5	160.1	0	0	108.2	R402 K406 F407 Y409	R402-E404 WeakPolarHBondContact CD-OE1 3.34Å; R402-E404 HydrophobicContact CG-CG 4.32Å; R402-E404 IonicContact CZ-OE1 3.9Å; R402-E404 IonicContact CZ-OE2 2.96Å; R402-E404 VanDerWaalsContact CZ-OE2 3.28Å; R402-E404 IonicContact NE-OE1 3.54Å; R402-E404 PolarHBondContact NE-OE1 3.33Å; R402-E404 IonicContact NE-OE2 3.29Å; R402-E404 PolarHBondContact NE-OE2 3.1Å; R402-E404 VanDerWaalsContact NE-OE2 3.14Å; R402-E404 IonicContact NH1-OE1 2.66Å; R402-E404 VanDerWaalsContact NH2-CD 3.33Å; R402-E404 IonicContact NH2-OE1 3.62Å; R402-E404 PolarHBondContact NH2-OE1 2.92Å; R402-E404 IonicContact NH2-OE2 2.74Å; R402-E404 PolarHBondContact NH2-OE2 3Å; E404-K406 PolarHBondContact O-N 2.84Å; E404-F407 PolarHBondContact N-O 3.39Å; E404-F407 WeakPolarHBondContact O-CB 3.41Å; E404-F407 WeakPolarHBondContact O-CD2 3.29Å; E404-F407 PolarHBondContact O-N 2.96Å; E404-Y409 HydrophobicContact CB-CE2 4.32Å; E404-Y409 HydrophobicContact CG-CE2 4.4Å; E404-Y409 WeakPolarHBondContact OE2-CE2 3.48Å; E404-Y409 PolarHBondContact OE2-OH 3.06Å
405	D	89.8	Confident	95.4	Very high	115 Å²	115	68.6 Å²	68.6	62%	0.615	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	-101.3	-171.1	173.7	43.8	0	0	0	112.5
406	K	93.1	Very high	95.4	Very high	107 Å²	107	67.2 Å²	67.2	47%	0.465	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-14.3	-178.8	-67.8	165.6	-164	69.4	0	113.8	T371 I372 E404	T371-K406 CarbonylContact C-O 3.58Å; T371-K406 WeakPolarHBondContact CA-O 3.01Å; I372-K406 PolarHBondContact N-O 3.04Å; E404-K406 PolarHBondContact O-N 2.84Å
407	F	95.8	Very high	95.4	Very high	78 Å²	78	70.9 Å²	70.9	34%	0.342	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	141.6	-176.5	-58.9	-82.2	0	0	0	112.1	M368 F369 E370 R403 E404 Y409	M368-F407 HydrophobicContact CE-CD1 3.92Å; M368-F407 HydrophobicContact CE-CE1 4.11Å; M368-F407 HydrophobicContact CG-CD1 4.41Å; M368-F407 HydrophobicContact SD-CD1 3.84Å; M368-F407 HydrophobicContact SD-CE1 4.43Å; F369-F407 WeakPolarHBondContact O-CA 3.39Å; E370-F407 HydrophobicContact CB-CE1 4.35Å; E370-F407 HydrophobicContact CG-CE1 4.31Å; R403-F407 WeakPolarHBondContact CA-O 3.45Å; R403-F407 WeakPolarHBondContact CG-O 3.27Å; E404-F407 PolarHBondContact N-O 3.39Å; E404-F407 WeakPolarHBondContact O-CB 3.41Å; E404-F407 WeakPolarHBondContact O-CD2 3.29Å; E404-F407 PolarHBondContact O-N 2.96Å; F407-Y409 HydrophobicContact CB-CE2 3.78Å
408	M	97.6	Very high	95.6	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.1	170.8	-71.1	-177.7	164.6	0	0	109.7	M368 F369 I372 P382 P400 R403 F410	M368-M408 CarbonylContact C-O 3.5Å; M368-M408 WeakPolarHBondContact CA-O 3.43Å; F369-M408 HydrophobicContact CB-CB 4.23Å; F369-M408 HydrophobicContact CD2-CB 4.27Å; F369-M408 HydrophobicContact CD2-SD 4.34Å; F369-M408 HydrophobicContact CG-CB 4.47Å; F369-M408 PolarHBondContact N-O 3.43Å; F369-M408 PolarHBondContact O-N 2.71Å; I372-M408 HydrophobicContact CG1-CE 4.26Å; I372-M408 HydrophobicContact CG2-CE 3.92Å; P382-M408 HydrophobicContact CG-SD 4.49Å; P400-M408 HydrophobicContact CB-CB 4.06Å; P400-M408 HydrophobicContact CB-CG 4.41Å; P400-M408 HydrophobicContact CG-CB 4.49Å; P400-M408 HydrophobicContact CG-CG 4.3Å; R403-M408 HydrophobicContact CG-CG 4.33Å; M408-F410 HydrophobicContact CB-CE2 3.92Å; M408-F410 HydrophobicContact CB-CZ 4.17Å
409	Y	97.8	Very high	95.8	Very high	28 Å²	28	63.6 Å²	63.6	11%	0.11	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148.1	179.6	-59	-93.2	0	0	0	111	M367 M368 P400 T401 R402 E404 F407	M367-Y409 WeakPolarHBondContact O-CA 3.44Å; M368-Y409 HydrophobicContact CB-CD1 4.05Å; M368-Y409 HydrophobicContact CB-CE1 4.13Å; M368-Y409 HydrophobicContact CG-CD1 3.78Å; M368-Y409 HydrophobicContact CG-CE1 3.5Å; M368-Y409 HydrophobicContact CG-CG 4.46Å; M368-Y409 HydrophobicContact SD-CD1 4.41Å; M368-Y409 HydrophobicContact SD-CE1 3.56Å; M368-Y409 VanDerWaalsContact SD-CE1 3.56Å; P400-Y409 CarbonylContact C-O 3.45Å; P400-Y409 WeakPolarHBondContact CA-O 2.9Å; P400-Y409 WeakPolarHBondContact CB-O 3.15Å; T401-Y409 PolarHBondContact N-O 3.39Å; T401-Y409 PolarHBondContact OG1-O 2.76Å; R402-Y409 HydrophobicContact CB-CD2 4.04Å; R402-Y409 HydrophobicContact CB-CG 4.39Å; R402-Y409 HydrophobicContact CG-CD2 4.38Å; R402-Y409 PolarHBondContact O-N 2.52Å; E404-Y409 HydrophobicContact CB-CE2 4.32Å; E404-Y409 HydrophobicContact CG-CE2 4.4Å; E404-Y409 WeakPolarHBondContact OE2-CE2 3.48Å; E404-Y409 PolarHBondContact OE2-OH 3.06Å; F407-Y409 HydrophobicContact CB-CE2 3.78Å
410	F	98.2	Very high	96	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.009	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	81.4	-179.8	-57.8	-89.2	0	0	0	108.3	K366 M367 F369 P382 F384 P400 M408 F426	K366-F410 CarbonylContact C-O 3.51Å; K366-F410 VanDerWaalsContact CA-O 3.25Å; K366-F410 WeakPolarHBondContact CA-O 3.43Å; M367-F410 HydrophobicContact CB-CB 4.11Å; M367-F410 HydrophobicContact CB-CD2 4.23Å; M367-F410 PolarHBondContact N-O 2.95Å; M367-F410 PolarHBondContact O-N 2.78Å; F369-F410 HydrophobicContact CD1-CD2 4.4Å; F369-F410 AromaticContact CD1-CE2 3.79Å; F369-F410 HydrophobicContact CD1-CE2 3.79Å; F369-F410 AromaticContact CD2-CE2 3.8Å; F369-F410 HydrophobicContact CD2-CE2 3.8Å; F369-F410 HydrophobicContact CD2-CZ 4.13Å; F369-F410 HydrophobicContact CE1-CD2 4.27Å; F369-F410 AromaticContact CE1-CE2 3.67Å; F369-F410 HydrophobicContact CE1-CE2 3.67Å; F369-F410 HydrophobicContact CE1-CZ 4.36Å; F369-F410 AromaticContact CE2-CE2 3.71Å; F369-F410 HydrophobicContact CE2-CE2 3.71Å; F369-F410 AromaticContact CE2-CZ 3.73Å; F369-F410 HydrophobicContact CE2-CZ 3.73Å; F369-F410 AromaticContact CG-CE2 3.86Å; F369-F410 HydrophobicContact CG-CE2 3.86Å; F369-F410 AromaticContact CZ-CE2 3.64Å; F369-F410 HydrophobicContact CZ-CE2 3.64Å; F369-F410 AromaticContact CZ-CZ 3.87Å; F369-F410 HydrophobicContact CZ-CZ 3.87Å; P382-F410 HydrophobicContact CB-CE1 3.89Å; P382-F410 HydrophobicContact CB-CZ 3.98Å; P382-F410 HydrophobicContact CG-CE1 3.55Å; P382-F410 HydrophobicContact CG-CZ 3.66Å; F384-F410 HydrophobicContact CD1-CB 4.42Å; F384-F410 AromaticContact CD1-CD1 3.94Å; F384-F410 HydrophobicContact CD1-CD1 3.94Å; F384-F410 HydrophobicContact CD1-CG 4.44Å; F384-F410 HydrophobicContact CE1-CB 3.75Å; F384-F410 AromaticContact CE1-CD1 3.91Å; F384-F410 HydrophobicContact CE1-CD1 3.91Å; F384-F410 HydrophobicContact CE1-CG 4.2Å; F384-F410 HydrophobicContact CZ-CB 4.3Å; P400-F410 HydrophobicContact CB-CD1 4.37Å; P400-F410 HydrophobicContact CB-CE1 3.98Å; P400-F410 HydrophobicContact CB-CZ 4.14Å; M408-F410 HydrophobicContact CB-CE2 3.92Å; M408-F410 HydrophobicContact CB-CZ 4.17Å; F410-F426 HydrophobicContact CD1-CE1 4.14Å; F410-F426 HydrophobicContact CD2-CE1 4.3Å; F410-F426 HydrophobicContact CD2-CZ 4.44Å; F410-F426 AromaticContact CE1-CE1 3.92Å; F410-F426 HydrophobicContact CE1-CE1 3.92Å; F410-F426 HydrophobicContact CE2-CE1 4.1Å; F410-F426 HydrophobicContact CG-CE1 4.32Å; F410-F426 AromaticContact CZ-CE1 3.9Å; F410-F426 HydrophobicContact CZ-CE1 3.9Å
411	E	97.7	Very high	96.1	Very high	58 Å²	58	61.1 Å²	61.1	27%	0.271	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	140	179.9	-72	145.9	149.4	0	0	111	K366 T401	K366-E411 HydrophobicContact CB-CB 4.25Å; K366-E411 HydrophobicContact CB-CG 3.53Å; K366-E411 HydrophobicContact CD-CG 3.68Å; K366-E411 HydrophobicContact CG-CG 4.26Å; K366-E411 IonicContact NZ-OE1 3.96Å; T401-E411 HydrophobicContact CG2-CB 4.18Å; T401-E411 WeakPolarHBondContact CG2-O 3.34Å; T401-E411 PolarHBondContact OG1-N 3Å; T401-E411 VanDerWaalsContact OG1-N 3.1Å; T401-E411 PolarHBondContact OG1-OE2 2.87Å
412	F	97.5	Very high	96.3	Very high	15 Å²	15	57.3 Å²	57.3	7%	0.066	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	140.4	171	-60.5	-86.1	0	0	0	109.3	F364 H365 M367 F384 V386 Y394 Q414 L416	F364-F412 HydrophobicContact CB-CE2 4.28Å; F364-F412 AromaticContact CD1-CE2 3.62Å; F364-F412 HydrophobicContact CD1-CE2 3.62Å; F364-F412 AromaticContact CD1-CZ 3.65Å; F364-F412 HydrophobicContact CD1-CZ 3.65Å; F364-F412 AromaticContact CD2-CE2 3.88Å; F364-F412 HydrophobicContact CD2-CE2 3.88Å; F364-F412 AromaticContact CE1-CE2 3.85Å; F364-F412 HydrophobicContact CE1-CE2 3.85Å; F364-F412 AromaticContact CE1-CZ 3.69Å; F364-F412 HydrophobicContact CE1-CZ 3.69Å; F364-F412 HydrophobicContact CE2-CE2 4.08Å; F364-F412 AromaticContact CG-CE2 3.63Å; F364-F412 HydrophobicContact CG-CE2 3.63Å; F364-F412 HydrophobicContact CG-CZ 4.16Å; F364-F412 HydrophobicContact CZ-CE2 4.07Å; F364-F412 HydrophobicContact CZ-CZ 4.22Å; F364-F412 WeakPolarHBondContact O-CD2 3.44Å; H365-F412 WeakPolarHBondContact O-CD2 3.25Å; H365-F412 PolarHBondContact O-N 3.16Å; H365-F412 VanDerWaalsContact O-N 3.13Å; M367-F412 HydrophobicContact CE-CZ 4.28Å; F384-F412 AromaticContact CE2-CE1 3.64Å; F384-F412 HydrophobicContact CE2-CE1 3.64Å; F384-F412 AromaticContact CE2-CZ 3.8Å; F384-F412 HydrophobicContact CE2-CZ 3.8Å; F384-F412 HydrophobicContact CZ-CD1 4.46Å; F384-F412 AromaticContact CZ-CE1 3.87Å; F384-F412 HydrophobicContact CZ-CE1 3.87Å; F384-F412 HydrophobicContact CZ-CZ 4.12Å; V386-F412 HydrophobicContact CG2-CE1 4.1Å; V386-F412 HydrophobicContact CG2-CZ 4.04Å; Y394-F412 AromaticContact CD1-CD1 3.82Å; Y394-F412 HydrophobicContact CD1-CD1 3.82Å; Y394-F412 AromaticContact CD1-CE1 3.46Å; Y394-F412 HydrophobicContact CD1-CE1 3.46Å; Y394-F412 VanDerWaalsContact CD1-CE1 3.46Å; Y394-F412 AromaticContact CD2-CD1 3.97Å; Y394-F412 HydrophobicContact CD2-CD1 3.97Å; Y394-F412 HydrophobicContact CD2-CE1 4.27Å; Y394-F412 AromaticContact CE1-CD1 3.69Å; Y394-F412 HydrophobicContact CE1-CD1 3.69Å; Y394-F412 AromaticContact CE1-CE1 3.68Å; Y394-F412 HydrophobicContact CE1-CE1 3.68Å; Y394-F412 AromaticContact CE2-CD1 3.87Å; Y394-F412 HydrophobicContact CE2-CD1 3.87Å; Y394-F412 HydrophobicContact CE2-CE1 4.48Å; Y394-F412 AromaticContact CG-CD1 3.93Å; Y394-F412 HydrophobicContact CG-CD1 3.93Å; Y394-F412 AromaticContact CG-CE1 3.75Å; Y394-F412 HydrophobicContact CG-CE1 3.75Å; Y394-F412 AromaticContact CZ-CD1 3.7Å; F412-Q414 WeakPolarHBondContact CB-O 3.43Å; F412-Q414 PolarHBondContact O-N 3.27Å; F412-Q414 VanDerWaalsContact O-N 3.16Å; F412-L416 HydrophobicContact CD1-CB 4.03Å; F412-L416 HydrophobicContact CD1-CD2 4.24Å; F412-L416 HydrophobicContact CD2-CB 4.31Å; F412-L416 HydrophobicContact CE1-CB 4.16Å; F412-L416 HydrophobicContact CE1-CD2 3.63Å; F412-L416 HydrophobicContact CE1-CG 4.49Å; F412-L416 HydrophobicContact CE2-CB 4.45Å; F412-L416 HydrophobicContact CG-CB 4.12Å; F412-L416 HydrophobicContact CZ-CB 4.38Å; F412-L416 HydrophobicContact CZ-CD2 3.9Å
413	P	96.3	Very high	96.5	Very high	116 Å²	116	53.8 Å²	53.8	75%	0.753	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	-26.6	179.2	-25.8	35	0	0	0	114.2
414	Q	95.8	Very high	96.7	Very high	163 Å²	163	47.9 Å²	47.9	76%	0.762	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	149.9	164.7	-62.8	-179.5	5.9	0	0	106.9	F412 L416	F412-Q414 WeakPolarHBondContact CB-O 3.43Å; F412-Q414 PolarHBondContact O-N 3.27Å; F412-Q414 VanDerWaalsContact O-N 3.16Å; Q414-L416 PolarHBondContact O-N 2.98Å
415	P	97.4	Very high	97.1	Very high	56 Å²	56	45.5 Å²	45.5	36%	0.364	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	126.1	-179	-23.3	34.5	0	0	0	111.5	L363 H365 P417	L363-P415 HydrophobicContact CB-CB 3.9Å; L363-P415 HydrophobicContact CD1-CB 4.39Å; H365-P415 WeakPolarHBondContact ND1-CG 3.44Å; P415-P417 WeakPolarHBondContact O-CD 3.34Å
416	L	98.3	Very high	97.5	Very high	21 Å²	21	40 Å²	40	11%	0.11	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.6	-174.8	-179.8	71	0	0	0	109.6	F364 V386 I393 F412 Q414 V418	F364-L416 HydrophobicContact CB-CB 4.35Å; F364-L416 WeakPolarHBondContact CB-O 3.24Å; F364-L416 HydrophobicContact CD1-CD2 4.43Å; F364-L416 PolarHBondContact N-O 2.8Å; F364-L416 PolarHBondContact O-N 3.45Å; V386-L416 HydrophobicContact CB-CD2 4.08Å; V386-L416 HydrophobicContact CG1-CD2 4.02Å; V386-L416 HydrophobicContact CG2-CD2 4.12Å; I393-L416 HydrophobicContact CD1-CD1 4.37Å; I393-L416 HydrophobicContact CD1-CD2 3.9Å; I393-L416 HydrophobicContact CD1-CG 4.18Å; I393-L416 HydrophobicContact CG1-CD2 4.24Å; F412-L416 HydrophobicContact CD1-CB 4.03Å; F412-L416 HydrophobicContact CD1-CD2 4.24Å; F412-L416 HydrophobicContact CD2-CB 4.31Å; F412-L416 HydrophobicContact CE1-CB 4.16Å; F412-L416 HydrophobicContact CE1-CD2 3.63Å; F412-L416 HydrophobicContact CE1-CG 4.49Å; F412-L416 HydrophobicContact CE2-CB 4.45Å; F412-L416 HydrophobicContact CG-CB 4.12Å; F412-L416 HydrophobicContact CZ-CB 4.38Å; F412-L416 HydrophobicContact CZ-CD2 3.9Å; Q414-L416 PolarHBondContact O-N 2.98Å; L416-V418 HydrophobicContact CD2-CG1 4.26Å; L416-V418 HydrophobicContact CG-CG1 4.26Å; L416-V418 PolarHBondContact O-N 2.84Å
417	P	98	Very high	97.7	Very high	86 Å²	86	36.7 Å²	36.7	56%	0.558	20%	0.197	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66	132.2	173.8	27.5	-34.1	0	0	0	110.3	L363 P415	L363-P417 HydrophobicContact CD2-CB 4.35Å; P415-P417 WeakPolarHBondContact O-CD 3.34Å
418	V	98.2	Very high	97.7	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.024	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	145.8	-179.5	-69.2	0	0	0	0	111.1	L362 F364 I393 L416 I422 T446 F516	L362-V418 HydrophobicContact CB-CG2 4.08Å; L362-V418 PolarHBondContact N-O 3.41Å; L362-V418 WeakPolarHBondContact O-CG2 3.48Å; L362-V418 PolarHBondContact O-N 3.26Å; F364-V418 HydrophobicContact CB-CG1 4.2Å; F364-V418 HydrophobicContact CB-CG2 3.96Å; F364-V418 HydrophobicContact CD1-CG1 4.28Å; I393-V418 HydrophobicContact CD1-CG1 3.92Å; L416-V418 HydrophobicContact CD2-CG1 4.26Å; L416-V418 HydrophobicContact CG-CG1 4.26Å; L416-V418 PolarHBondContact O-N 2.84Å; V418-I422 HydrophobicContact CB-CD1 4.36Å; V418-I422 HydrophobicContact CB-CG2 4.06Å; V418-I422 HydrophobicContact CG1-CD1 4.37Å; V418-I422 HydrophobicContact CG1-CG2 4.22Å; V418-I422 HydrophobicContact CG2-CD1 4.45Å; V418-T446 HydrophobicContact CB-CG2 4.37Å; V418-T446 HydrophobicContact CG2-CG2 4Å; V418-F516 HydrophobicContact CG2-CD1 4.21Å; V418-F516 HydrophobicContact CG2-CE1 4.08Å
419	C	97.4	Very high	97.4	Very high	35 Å²	35	37.6 Å²	37.6	24%	0.236	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	137.6	177.9	-166.6	0	0	0	0	111.8	P359 V360 Q388	P359-C419 WeakPolarHBondContact CB-SG 3.28Å; V360-C419 VanDerWaalsContact C-SG 3.58Å; Q388-C419 WeakPolarHBondContact CG-O 3.34Å; Q388-C419 PolarHBondContact NE2-O 2.68Å; Q388-C419 PolarHBondContact OE1-O 3.16Å
420	G	97.1	Very high	96.7	Very high	6 Å²	6	39.8 Å²	39.8	6%	0.062	21%	0.212	C	C	.	.	S	Bend	trans	68.8	-140.1	179.2	0	0	0	0	0	113.2	Y357 I422 N445 T446	Y357-G420 WeakPolarHBondContact OH-CA 3.49Å; G420-I422 PolarHBondContact O-N 3.15Å; G420-N445 WeakPolarHBondContact O-CA 3.4Å; G420-T446 PolarHBondContact N-OG1 3.1Å; G420-T446 PolarHBondContact O-N 2.81Å; G420-T446 VanDerWaalsContact O-N 3.13Å
421	D	98.3	Very high	95.4	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.027	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	110.2	-175.3	-62.3	-35.9	0	0	0	112.1	Q266 L267 Y343 L389 W443 N445	Q266-D421 WeakPolarHBondContact CA-OD2 3.41Å; L267-D421 PolarHBondContact N-OD2 2.7Å; Y343-D421 WeakPolarHBondContact CE1-OD1 3.27Å; Y343-D421 PolarHBondContact OH-OD1 2.88Å; Y343-D421 VanDerWaalsContact OH-OD1 3.04Å; L389-D421 PolarHBondContact N-O 2.63Å; D421-W443 HydrophobicContact CB-CE3 4.41Å; D421-W443 HydrophobicContact CB-CZ3 4.36Å; D421-N445 WeakPolarHBondContact OD1-CB 3.2Å; D421-N445 PolarHBondContact OD1-ND2 3.5Å
422	I	98.2	Very high	94	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.9	176.4	61.5	172.9	0	0	0	112.3	C387 Q388 V418 G420 W443 V444 F516	C387-I422 WeakPolarHBondContact O-CA 3.33Å; Q388-I422 HydrophobicContact CB-CG2 4.17Å; Q388-I422 HydrophobicContact CG-CG2 4.12Å; V418-I422 HydrophobicContact CB-CD1 4.36Å; V418-I422 HydrophobicContact CB-CG2 4.06Å; V418-I422 HydrophobicContact CG1-CD1 4.37Å; V418-I422 HydrophobicContact CG1-CG2 4.22Å; V418-I422 HydrophobicContact CG2-CD1 4.45Å; G420-I422 PolarHBondContact O-N 3.15Å; I422-W443 VanDerWaalsContact O-CA 3.3Å; I422-W443 WeakPolarHBondContact O-CA 3.26Å; I422-V444 HydrophobicContact CD1-CG2 3.94Å; I422-V444 HydrophobicContact CG1-CG2 3.64Å; I422-V444 PolarHBondContact N-O 2.92Å; I422-V444 PolarHBondContact O-N 3.46Å; I422-F516 HydrophobicContact CD1-CE1 4.34Å; I422-F516 HydrophobicContact CD1-CZ 4.49Å
423	K	98.6	Very high	92.6	Very high	32 Å²	32	58 Å²	58	14%	0.139	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.2	172.6	-172.2	-164.5	-179.1	-160	0	109.4	V386 C387 E425 F442 W443	V386-K423 WeakPolarHBondContact CA-O 3.41Å; C387-K423 HydrophobicContact CB-CB 4.35Å; C387-K423 PolarHBondContact N-O 2.89Å; C387-K423 PolarHBondContact O-N 2.97Å; K423-E425 WeakPolarHBondContact CE-OE1 3.4Å; K423-E425 IonicContact NZ-OE1 2.74Å; K423-E425 PolarHBondContact NZ-OE1 2.85Å; K423-E425 IonicContact NZ-OE2 3.67Å; K423-E425 PolarHBondContact NZ-OE2 2.58Å; K423-F442 WeakPolarHBondContact CA-O 3.34Å; K423-W443 HydrophobicContact CB-CD2 3.72Å; K423-W443 HydrophobicContact CB-CE3 3.84Å; K423-W443 HydrophobicContact CB-CG 4.39Å; K423-W443 HydrophobicContact CB-CH2 3.93Å; K423-W443 HydrophobicContact CB-CZ2 3.83Å; K423-W443 HydrophobicContact CB-CZ3 3.93Å; K423-W443 HydrophobicContact CD-CZ2 3.86Å; K423-W443 HydrophobicContact CG-CD2 4.07Å; K423-W443 HydrophobicContact CG-CG 4.4Å; K423-W443 HydrophobicContact CG-CZ2 4.02Å
424	V	98.7	Very high	91.5	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.2	165	-170.5	0	0	0	0	109.3	F364 M367 F384 V385 V386 F426 H441 F442	F364-V424 HydrophobicContact CE1-CG2 4.22Å; M367-V424 HydrophobicContact CE-CG1 4.04Å; M367-V424 HydrophobicContact SD-CG1 3.91Å; F384-V424 HydrophobicContact CD2-CG1 4.26Å; V385-V424 WeakPolarHBondContact O-CA 3.33Å; V386-V424 HydrophobicContact CG1-CG2 4.35Å; V386-V424 HydrophobicContact CG2-CG1 4.44Å; V386-V424 HydrophobicContact CG2-CG2 4.34Å; V424-F426 HydrophobicContact CG1-CD2 4.11Å; V424-F426 HydrophobicContact CG1-CE2 3.69Å; V424-H441 CarbonylContact O-C 3.53Å; V424-H441 WeakPolarHBondContact O-CA 3.25Å; V424-H441 VanDerWaalsContact O-CB 3.28Å; V424-H441 WeakPolarHBondContact O-CB 3.17Å; V424-F442 HydrophobicContact CB-CD1 4.45Å; V424-F442 HydrophobicContact CB-CD2 4.43Å; V424-F442 HydrophobicContact CB-CE1 3.81Å; V424-F442 HydrophobicContact CB-CE2 3.78Å; V424-F442 HydrophobicContact CB-CZ 3.43Å; V424-F442 VanDerWaalsContact CB-CZ 3.43Å; V424-F442 HydrophobicContact CG1-CE1 4.26Å; V424-F442 HydrophobicContact CG1-CZ 4.06Å; V424-F442 HydrophobicContact CG2-CE1 4.47Å; V424-F442 HydrophobicContact CG2-CE2 3.64Å; V424-F442 HydrophobicContact CG2-CZ 3.61Å; V424-F442 PolarHBondContact N-O 3.32Å; V424-F442 PolarHBondContact O-N 3.21Å
425	E	98.5	Very high	90.6	Very high	27 Å²	27	60 Å²	60	13%	0.126	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	122.9	-175.7	-174.3	160	-113.7	0	0	111	F384 V385 K423 F427 K438 H441	F384-E425 CarbonylContact C-O 3.51Å; F384-E425 VanDerWaalsContact CA-O 3.25Å; F384-E425 WeakPolarHBondContact CA-O 3.34Å; V385-E425 PolarHBondContact N-O 2.92Å; V385-E425 PolarHBondContact O-N 2.88Å; K423-E425 WeakPolarHBondContact CE-OE1 3.4Å; K423-E425 IonicContact NZ-OE1 2.74Å; K423-E425 PolarHBondContact NZ-OE1 2.85Å; K423-E425 IonicContact NZ-OE2 3.67Å; K423-E425 PolarHBondContact NZ-OE2 2.58Å; E425-F427 HydrophobicContact CB-CE2 4.24Å; E425-F427 HydrophobicContact CG-CE1 4.33Å; E425-F427 HydrophobicContact CG-CE2 3.72Å; E425-F427 HydrophobicContact CG-CZ 3.6Å; E425-K438 WeakPolarHBondContact OE1-CE 3.35Å; E425-K438 IonicContact OE1-NZ 3.42Å; E425-K438 PolarHBondContact OE1-NZ 3.15Å; E425-H441 HydrophobicContact CB-CB 3.96Å; E425-H441 HydrophobicContact CG-CB 3.94Å; E425-H441 IonicContact OE1-CD2 2.71Å; E425-H441 IonicContact OE1-CG 3.19Å
426	F	98.5	Very high	90	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.8	-177.6	-81.3	-95.6	0	0	0	111.5	M367 F369 P382 Q383 F384 F410 V424 M439 F440	M367-F426 HydrophobicContact CE-CE2 4.26Å; M367-F426 HydrophobicContact CE-CZ 3.92Å; M367-F426 HydrophobicContact SD-CE2 3.64Å; M367-F426 HydrophobicContact SD-CZ 3.63Å; F369-F426 HydrophobicContact CE1-CD1 4.42Å; F369-F426 AromaticContact CE1-CE1 3.86Å; F369-F426 HydrophobicContact CE1-CE1 3.86Å; F369-F426 HydrophobicContact CE1-CE2 4.18Å; F369-F426 AromaticContact CE1-CZ 3.73Å; F369-F426 HydrophobicContact CE1-CZ 3.73Å; F369-F426 HydrophobicContact CE2-CE1 4.41Å; F369-F426 AromaticContact CZ-CD1 3.63Å; F369-F426 HydrophobicContact CZ-CD1 3.63Å; F369-F426 HydrophobicContact CZ-CD2 4.44Å; F369-F426 AromaticContact CZ-CE1 3.4Å; F369-F426 HydrophobicContact CZ-CE1 3.4Å; F369-F426 VanDerWaalsContact CZ-CE1 3.4Å; F369-F426 HydrophobicContact CZ-CE2 4.26Å; F369-F426 HydrophobicContact CZ-CG 4.15Å; F369-F426 AromaticContact CZ-CZ 3.76Å; F369-F426 HydrophobicContact CZ-CZ 3.76Å; P382-F426 HydrophobicContact CB-CD1 4.49Å; Q383-F426 WeakPolarHBondContact O-CA 2.97Å; F384-F426 HydrophobicContact CB-CD1 3.65Å; F384-F426 HydrophobicContact CB-CD2 4.11Å; F384-F426 HydrophobicContact CB-CE1 3.59Å; F384-F426 HydrophobicContact CB-CE2 4.05Å; F384-F426 HydrophobicContact CB-CG 3.92Å; F384-F426 HydrophobicContact CB-CZ 3.8Å; F384-F426 AromaticContact CD1-CE1 3.97Å; F384-F426 HydrophobicContact CD1-CE1 3.97Å; F384-F426 HydrophobicContact CD1-CZ 4.22Å; F384-F426 HydrophobicContact CG-CE1 4.02Å; F384-F426 HydrophobicContact CG-CZ 4.03Å; F410-F426 HydrophobicContact CD1-CE1 4.14Å; F410-F426 HydrophobicContact CD2-CE1 4.3Å; F410-F426 HydrophobicContact CD2-CZ 4.44Å; F410-F426 AromaticContact CE1-CE1 3.92Å; F410-F426 HydrophobicContact CE1-CE1 3.92Å; F410-F426 HydrophobicContact CE2-CE1 4.1Å; F410-F426 HydrophobicContact CG-CE1 4.32Å; F410-F426 AromaticContact CZ-CE1 3.9Å; F410-F426 HydrophobicContact CZ-CE1 3.9Å; V424-F426 HydrophobicContact CG1-CD2 4.11Å; V424-F426 HydrophobicContact CG1-CE2 3.69Å; F426-M439 HydrophobicContact CB-CB 4.27Å; F426-M439 HydrophobicContact CB-SD 4.35Å; F426-M439 WeakPolarHBondContact O-CB 3.26Å; F426-M439 PolarHBondContact O-N 3.43Å; F426-F440 HydrophobicContact CB-CD1 4.15Å; F426-F440 HydrophobicContact CB-CE1 3.88Å; F426-F440 HydrophobicContact CB-CE2 4.45Å; F426-F440 HydrophobicContact CB-CZ 4.04Å; F426-F440 HydrophobicContact CD1-CZ 4.48Å; F426-F440 HydrophobicContact CD2-CD2 4.4Å; F426-F440 HydrophobicContact CD2-CE1 4.15Å; F426-F440 AromaticContact CD2-CE2 3.58Å; F426-F440 HydrophobicContact CD2-CE2 3.58Å; F426-F440 AromaticContact CD2-CZ 3.43Å; F426-F440 HydrophobicContact CD2-CZ 3.43Å; F426-F440 VanDerWaalsContact CD2-CZ 3.43Å; F426-F440 HydrophobicContact CE2-CE2 4.14Å; F426-F440 AromaticContact CE2-CZ 3.94Å; F426-F440 HydrophobicContact CE2-CZ 3.94Å; F426-F440 HydrophobicContact CG-CE1 4.01Å; F426-F440 HydrophobicContact CG-CE2 4.24Å; F426-F440 AromaticContact CG-CZ 3.74Å; F426-F440 HydrophobicContact CG-CZ 3.74Å; F426-F440 PolarHBondContact N-O 3.17Å; F426-F440 PolarHBondContact O-N 3.33Å
427	F	97.4	Very high	89.7	Confident	37 Å²	37	63.2 Å²	63.2	16%	0.162	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	144.3	179.5	-52.7	-97.9	0	0	0	110.6	P382 Q383 V385 E425 K436 D437 K438	P382-F427 CarbonylContact C-O 3.55Å; P382-F427 WeakPolarHBondContact CA-O 3.24Å; Q383-F427 PolarHBondContact N-O 3Å; Q383-F427 PolarHBondContact O-N 3.46Å; V385-F427 HydrophobicContact CB-CE2 4.48Å; V385-F427 HydrophobicContact CG2-CE2 4.04Å; E425-F427 HydrophobicContact CB-CE2 4.24Å; E425-F427 HydrophobicContact CG-CE1 4.33Å; E425-F427 HydrophobicContact CG-CE2 3.72Å; E425-F427 HydrophobicContact CG-CZ 3.6Å; F427-K436 HydrophobicContact CB-CB 3.9Å; F427-K436 HydrophobicContact CB-CD 4.42Å; F427-K436 HydrophobicContact CD1-CB 4.19Å; F427-K436 HydrophobicContact CG-CB 4.33Å; F427-D437 CarbonylContact C-O 3.52Å; F427-D437 WeakPolarHBondContact CA-O 3.42Å; F427-K438 HydrophobicContact CD1-CB 4.1Å; F427-K438 HydrophobicContact CE1-CB 4.25Å
428	H	95.9	Very high	89.6	Confident	7 Å²	7	62.1 Å²	62.1	3%	0.032	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	124.2	164.6	176.8	35.6	0	0	0	108.8	F375 N381 K436 D437 M439	F375-H428 HydrophobicContact CB-CB 4.07Å; F375-H428 HydrophobicContact CD1-CB 4.03Å; F375-H428 HydrophobicContact CG-CB 4.11Å; N381-H428 PolarHBondContact N-CE1 3.35Å; N381-H428 PolarHBondContact N-ND1 2.62Å; N381-H428 VanDerWaalsContact N-ND1 3.14Å; N381-H428 WeakPolarHBondContact O-CA 3.12Å; N381-H428 PolarHBondContact O-ND1 3.4Å; H428-K436 CarbonylContact O-C 3.55Å; H428-K436 VanDerWaalsContact O-CA 3.32Å; H428-K436 WeakPolarHBondContact O-CA 3.48Å; H428-D437 HydrophobicContact CB-CB 4.45Å; H428-D437 PolarHBondContact N-O 3.31Å; H428-D437 PolarHBondContact O-N 2.88Å; H428-M439 HydrophobicContact CB-CG 4.01Å; H428-M439 HydrophobicContact CB-SD 4.13Å; H428-M439 PolarHBondContact N-SD 3.09Å
429	K	91.1	Very high	89.6	Confident	91 Å²	91	62 Å²	62	40%	0.396	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.2	169.9	-172.1	-176.8	179.8	-175.1	0	109.6	N381 S398	N381-K429 WeakPolarHBondContact CB-O 3.31Å; N381-K429 PolarHBondContact ND2-O 3.07Å; N381-K429 PolarHBondContact O-N 3.12Å; S398-K429 WeakPolarHBondContact OG-CD 3.27Å
430	Q	83.1	Confident	89.6	Confident	74 Å²	74	60.3 Å²	60.3	35%	0.346	29%	0.286	S	S	.	.			trans	-81.1	132.8	179	-155.3	-178.4	37.5	0	0	110.7	K432 M433	Q430-K432 PolarHBondContact O-N 2.72Å; Q430-M433 PolarHBondContact O-N 2.61Å
431	N	71.3	Confident	89.7	Confident	138 Å²	138	61 Å²	61	74%	0.738	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-0.4	-168	-65.7	-2.4	0	0	0	115.8	N381	N381-N431 PolarHBondContact ND2-OD1 3.16Å
432	K	68.3	Low	89.7	Confident	203 Å²	203	60.8 Å²	60.8	88%	0.883	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.8	2.8	-178.5	-65.3	-171.3	178.7	-177	0	114.5	Q430	Q430-K432 PolarHBondContact O-N 2.72Å
433	M	68.7	Low	89.8	Confident	115 Å²	115	62.3 Å²	62.3	57%	0.567	29%	0.292	S	S	*	.			trans	-134.4	150.4	-178.5	-60.1	-169.5	86.9	0	0	111.2	Q430 K435	Q430-M433 PolarHBondContact O-N 2.61Å; M433-K435 VanDerWaalsContact C-N 3.31Å
434	L	72.3	Confident	89.7	Confident	180 Å²	180	60.9 Å²	60.9	94%	0.942	29%	0.286	S	S	*	.	S	Bend	trans	-77.2	-19.5	173.1	-66.4	174.2	0	0	0	112.5
435	K	77.8	Confident	89.7	Confident	141 Å²	141	60.9 Å²	60.9	61%	0.613	29%	0.286	S	S	*	.			trans	-64.3	140.1	173.1	-172.9	167	-179.4	166.9	0	110	M433	M433-K435 VanDerWaalsContact C-N 3.31Å
436	K	84.5	Confident	89.6	Confident	89 Å²	89	59.6 Å²	59.6	39%	0.387	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.6	171.2	-44.3	180	-168.4	179.4	0	108.4	F427 H428 K438	F427-K436 HydrophobicContact CB-CB 3.9Å; F427-K436 HydrophobicContact CB-CD 4.42Å; F427-K436 HydrophobicContact CD1-CB 4.19Å; F427-K436 HydrophobicContact CG-CB 4.33Å; H428-K436 CarbonylContact O-C 3.55Å; H428-K436 VanDerWaalsContact O-CA 3.32Å; H428-K436 WeakPolarHBondContact O-CA 3.48Å; K436-K438 PolarHBondContact O-N 2.62Å
437	D	92.3	Very high	89.5	Confident	57 Å²	57	61 Å²	61	31%	0.305	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	113.7	-178	-58.5	-48.1	0	0	0	109.6	F427 H428 M439	F427-D437 CarbonylContact C-O 3.52Å; F427-D437 WeakPolarHBondContact CA-O 3.42Å; H428-D437 HydrophobicContact CB-CB 4.45Å; H428-D437 PolarHBondContact N-O 3.31Å; H428-D437 PolarHBondContact O-N 2.88Å; D437-M439 PolarHBondContact O-N 2.88Å
438	K	95.8	Very high	89.4	Confident	62 Å²	62	59.8 Å²	59.8	27%	0.27	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	114.2	177.5	176	167.8	170.6	167.6	0	109.9	E425 F427 K436 H441 K496	E425-K438 WeakPolarHBondContact OE1-CE 3.35Å; E425-K438 IonicContact OE1-NZ 3.42Å; E425-K438 PolarHBondContact OE1-NZ 3.15Å; F427-K438 HydrophobicContact CD1-CB 4.1Å; F427-K438 HydrophobicContact CE1-CB 4.25Å; K436-K438 PolarHBondContact O-N 2.62Å; K438-H441 WeakPolarHBondContact CE-CE1 3.39Å; K438-H441 VanDerWaalsContact CE-ND1 3.26Å; K438-H441 WeakPolarHBondContact CE-ND1 3.25Å; K438-H441 PolarHBondContact NZ-CD2 3.33Å; K438-H441 VanDerWaalsContact NZ-CD2 3.32Å; K438-H441 PolarHBondContact NZ-CE1 2.88Å; K438-H441 PolarHBondContact NZ-NE2 2.94Å; K438-K496 HydrophobicContact CG-CD 4.42Å; K438-K496 WeakPolarHBondContact O-CD 3.39Å; K438-K496 WeakPolarHBondContact O-CE 3.47Å; K438-K496 PolarHBondContact O-NZ 2.92Å
439	M	97.8	Very high	89.2	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-63.8	-178.7	-62.6	169.1	67.3	0	0	109.5	P373 F375 C380 P382 F426 H428 D437 F506	P373-M439 HydrophobicContact CB-CE 3.6Å; P373-M439 HydrophobicContact CG-CE 3.7Å; F375-M439 HydrophobicContact CD1-CG 4.21Å; F375-M439 HydrophobicContact CD2-CE 3.97Å; F375-M439 HydrophobicContact CD2-CG 4.2Å; F375-M439 HydrophobicContact CE1-CB 4.24Å; F375-M439 HydrophobicContact CE1-CG 3.84Å; F375-M439 HydrophobicContact CE2-CB 4.07Å; F375-M439 HydrophobicContact CE2-CE 3.88Å; F375-M439 HydrophobicContact CE2-CG 3.84Å; F375-M439 HydrophobicContact CG-CG 4.4Å; F375-M439 HydrophobicContact CZ-CB 3.72Å; F375-M439 HydrophobicContact CZ-CG 3.66Å; C380-M439 HydrophobicContact CB-CE 4.14Å; P382-M439 HydrophobicContact CB-SD 4.34Å; F426-M439 HydrophobicContact CB-CB 4.27Å; F426-M439 HydrophobicContact CB-SD 4.35Å; F426-M439 WeakPolarHBondContact O-CB 3.26Å; F426-M439 PolarHBondContact O-N 3.43Å; H428-M439 HydrophobicContact CB-CG 4.01Å; H428-M439 HydrophobicContact CB-SD 4.13Å; H428-M439 PolarHBondContact N-SD 3.09Å; D437-M439 PolarHBondContact O-N 2.88Å; M439-F506 HydrophobicContact CB-CZ 4.17Å
440	F	98.6	Very high	88.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	172.9	178.9	68	-90.2	0	0	0	110.6	F369 F426 F442 L494 D495 A497 F506 F510 V512	F369-F440 HydrophobicContact CE1-CE1 4.31Å; F369-F440 AromaticContact CE1-CZ 3.73Å; F369-F440 HydrophobicContact CE1-CZ 3.73Å; F369-F440 HydrophobicContact CE2-CE1 4.37Å; F369-F440 AromaticContact CZ-CE1 3.76Å; F369-F440 HydrophobicContact CZ-CE1 3.76Å; F369-F440 AromaticContact CZ-CZ 3.59Å; F369-F440 HydrophobicContact CZ-CZ 3.59Å; F426-F440 HydrophobicContact CB-CD1 4.15Å; F426-F440 HydrophobicContact CB-CE1 3.88Å; F426-F440 HydrophobicContact CB-CE2 4.45Å; F426-F440 HydrophobicContact CB-CZ 4.04Å; F426-F440 HydrophobicContact CD1-CZ 4.48Å; F426-F440 HydrophobicContact CD2-CD2 4.4Å; F426-F440 HydrophobicContact CD2-CE1 4.15Å; F426-F440 AromaticContact CD2-CE2 3.58Å; F426-F440 HydrophobicContact CD2-CE2 3.58Å; F426-F440 AromaticContact CD2-CZ 3.43Å; F426-F440 HydrophobicContact CD2-CZ 3.43Å; F426-F440 VanDerWaalsContact CD2-CZ 3.43Å; F426-F440 HydrophobicContact CE2-CE2 4.14Å; F426-F440 AromaticContact CE2-CZ 3.94Å; F426-F440 HydrophobicContact CE2-CZ 3.94Å; F426-F440 HydrophobicContact CG-CE1 4.01Å; F426-F440 HydrophobicContact CG-CE2 4.24Å; F426-F440 AromaticContact CG-CZ 3.74Å; F426-F440 HydrophobicContact CG-CZ 3.74Å; F426-F440 PolarHBondContact N-O 3.17Å; F426-F440 PolarHBondContact O-N 3.33Å; F440-F442 HydrophobicContact CD2-CD1 4.32Å; F440-F442 HydrophobicContact CE2-CD1 4.08Å; F440-F442 HydrophobicContact CE2-CE1 4.06Å; F440-L494 HydrophobicContact CB-CB 4.44Å; F440-L494 HydrophobicContact CD2-CB 4.11Å; F440-L494 HydrophobicContact CD2-CD1 4Å; F440-L494 HydrophobicContact CD2-CD2 3.84Å; F440-L494 HydrophobicContact CD2-CG 4.2Å; F440-L494 HydrophobicContact CE2-CD1 4.03Å; F440-L494 HydrophobicContact CE2-CD2 3.88Å; F440-L494 HydrophobicContact CE2-CG 4.47Å; F440-L494 HydrophobicContact CG-CB 4.49Å; F440-L494 HydrophobicContact CG-CD1 4.46Å; F440-D495 CarbonylContact C-O 3.52Å; F440-D495 VanDerWaalsContact CA-O 3.25Å; F440-D495 WeakPolarHBondContact CA-O 3.31Å; F440-D495 WeakPolarHBondContact CB-O 3.33Å; F440-A497 HydrophobicContact CB-CB 3.74Å; F440-A497 HydrophobicContact CG-CB 4.38Å; F440-F506 HydrophobicContact CB-CZ 4.37Å; F440-F506 AromaticContact CD1-CE1 3.63Å; F440-F506 HydrophobicContact CD1-CE1 3.63Å; F440-F506 AromaticContact CD1-CZ 3.78Å; F440-F506 HydrophobicContact CD1-CZ 3.78Å; F440-F506 HydrophobicContact CE1-CE1 4.1Å; F440-F510 HydrophobicContact CD1-CE1 4.33Å; F440-F510 AromaticContact CE1-CE1 3.91Å; F440-F510 HydrophobicContact CE1-CE1 3.91Å; F440-F510 AromaticContact CE1-CZ 3.76Å; F440-F510 HydrophobicContact CE1-CZ 3.76Å; F440-F510 HydrophobicContact CZ-CE1 4.2Å; F440-F510 HydrophobicContact CZ-CZ 4.06Å; F440-V512 HydrophobicContact CE2-CG2 3.96Å; F440-V512 HydrophobicContact CZ-CG2 3.72Å
441	H	98.7	Very high	87.8	Confident	22 Å²	22	54.7 Å²	54.7	10%	0.102	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	169.8	172.4	54.2	-38.7	0	0	0	110.2	V424 E425 K438 D495	V424-H441 CarbonylContact O-C 3.53Å; V424-H441 WeakPolarHBondContact O-CA 3.25Å; V424-H441 VanDerWaalsContact O-CB 3.28Å; V424-H441 WeakPolarHBondContact O-CB 3.17Å; E425-H441 HydrophobicContact CB-CB 3.96Å; E425-H441 HydrophobicContact CG-CB 3.94Å; E425-H441 IonicContact OE1-CD2 2.71Å; E425-H441 IonicContact OE1-CG 3.19Å; K438-H441 WeakPolarHBondContact CE-CE1 3.39Å; K438-H441 VanDerWaalsContact CE-ND1 3.26Å; K438-H441 WeakPolarHBondContact CE-ND1 3.25Å; K438-H441 PolarHBondContact NZ-CD2 3.33Å; K438-H441 VanDerWaalsContact NZ-CD2 3.32Å; K438-H441 PolarHBondContact NZ-CE1 2.88Å; K438-H441 PolarHBondContact NZ-NE2 2.94Å; H441-D495 WeakPolarHBondContact CE1-CB 3.3Å; H441-D495 PolarHBondContact N-O 2.66Å; H441-D495 VanDerWaalsContact ND1-CB 3.32Å; H441-D495 WeakPolarHBondContact ND1-CB 3.33Å; H441-D495 PolarHBondContact ND1-O 2.83Å; H441-D495 VanDerWaalsContact ND1-O 3.15Å; H441-D495 WeakPolarHBondContact O-CA 3.32Å; H441-D495 WeakPolarHBondContact O-CB 3.08Å; H441-D495 PolarHBondContact O-N 2.98Å
442	F	98.6	Very high	86.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	156.2	169.9	55.1	-90	0	0	0	110.2	M367 K423 V424 F440 V444 L489 L494 V512 L514	M367-F442 HydrophobicContact SD-CZ 4.35Å; K423-F442 WeakPolarHBondContact CA-O 3.34Å; V424-F442 HydrophobicContact CB-CD1 4.45Å; V424-F442 HydrophobicContact CB-CD2 4.43Å; V424-F442 HydrophobicContact CB-CE1 3.81Å; V424-F442 HydrophobicContact CB-CE2 3.78Å; V424-F442 HydrophobicContact CB-CZ 3.43Å; V424-F442 VanDerWaalsContact CB-CZ 3.43Å; V424-F442 HydrophobicContact CG1-CE1 4.26Å; V424-F442 HydrophobicContact CG1-CZ 4.06Å; V424-F442 HydrophobicContact CG2-CE1 4.47Å; V424-F442 HydrophobicContact CG2-CE2 3.64Å; V424-F442 HydrophobicContact CG2-CZ 3.61Å; V424-F442 PolarHBondContact N-O 3.32Å; V424-F442 PolarHBondContact O-N 3.21Å; F440-F442 HydrophobicContact CD2-CD1 4.32Å; F440-F442 HydrophobicContact CE2-CD1 4.08Å; F440-F442 HydrophobicContact CE2-CE1 4.06Å; F442-V444 HydrophobicContact CD2-CG1 4.04Å; F442-V444 HydrophobicContact CD2-CG2 4.47Å; F442-V444 HydrophobicContact CE2-CG2 4.42Å; F442-L489 HydrophobicContact CB-CD1 3.94Å; F442-L489 HydrophobicContact CD1-CD1 3.95Å; F442-L489 HydrophobicContact CD2-CD1 3.5Å; F442-L489 VanDerWaalsContact CD2-CD1 3.5Å; F442-L489 HydrophobicContact CE1-CD1 4.31Å; F442-L489 HydrophobicContact CE2-CD1 3.9Å; F442-L489 HydrophobicContact CG-CD1 3.51Å; F442-L489 HydrophobicContact CZ-CD1 4.28Å; F442-L494 HydrophobicContact CB-CD2 4.12Å; F442-L494 HydrophobicContact CD1-CD2 3.46Å; F442-L494 VanDerWaalsContact CD1-CD2 3.46Å; F442-L494 HydrophobicContact CE1-CD2 4.19Å; F442-L494 HydrophobicContact CG-CD2 4.07Å; F442-V512 HydrophobicContact CE1-CG1 4.47Å; F442-L514 HydrophobicContact CE2-CD1 3.79Å; F442-L514 HydrophobicContact CE2-CD2 3.93Å; F442-L514 HydrophobicContact CZ-CD1 4.01Å; F442-L514 HydrophobicContact CZ-CD2 3.52Å; F442-L514 HydrophobicContact CZ-CG 4.33Å
443	W	98.6	Very high	86.1	Confident	33 Å²	33	48.3 Å²	48.3	13%	0.125	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.3	164	-68.6	82.6	0	0	0	110.1	N263 P264 S339 R342 Y343 D421 I422 K423	N263-W443 HydrophobicContact CB-CZ2 4.43Å; N263-W443 PolarHBondContact OD1-NE1 2.71Å; P264-W443 HydrophobicContact CG-CB 3.75Å; P264-W443 HydrophobicContact CG-CD2 4.05Å; P264-W443 HydrophobicContact CG-CG 3.62Å; S339-W443 PolarHBondContact OG-N 3.07Å; R342-W443 PolarHBondContact NH1-O 3.44Å; Y343-W443 HydrophobicContact CE2-CB 3.92Å; D421-W443 HydrophobicContact CB-CE3 4.41Å; D421-W443 HydrophobicContact CB-CZ3 4.36Å; I422-W443 VanDerWaalsContact O-CA 3.3Å; I422-W443 WeakPolarHBondContact O-CA 3.26Å; K423-W443 HydrophobicContact CB-CD2 3.72Å; K423-W443 HydrophobicContact CB-CE3 3.84Å; K423-W443 HydrophobicContact CB-CG 4.39Å; K423-W443 HydrophobicContact CB-CH2 3.93Å; K423-W443 HydrophobicContact CB-CZ2 3.83Å; K423-W443 HydrophobicContact CB-CZ3 3.93Å; K423-W443 HydrophobicContact CD-CZ2 3.86Å; K423-W443 HydrophobicContact CG-CD2 4.07Å; K423-W443 HydrophobicContact CG-CG 4.4Å; K423-W443 HydrophobicContact CG-CZ2 4.02Å
444	V	98.3	Very high	84.8	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	158.2	171.2	-65	0	0	0	0	108.5	I422 F442 I449 L487 L489	I422-V444 HydrophobicContact CD1-CG2 3.94Å; I422-V444 HydrophobicContact CG1-CG2 3.64Å; I422-V444 PolarHBondContact N-O 2.92Å; I422-V444 PolarHBondContact O-N 3.46Å; F442-V444 HydrophobicContact CD2-CG1 4.04Å; F442-V444 HydrophobicContact CD2-CG2 4.47Å; F442-V444 HydrophobicContact CE2-CG2 4.42Å; V444-I449 HydrophobicContact CG2-CD1 4.38Å; V444-L487 HydrophobicContact CB-CD2 4.11Å; V444-L487 HydrophobicContact CG1-CD2 3.65Å; V444-L487 HydrophobicContact CG2-CD2 4.39Å; V444-L489 HydrophobicContact CG1-CD1 4.23Å
445	N	97.9	Very high	83	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.2	173.5	-179.9	-62.7	0	0	0	109.1	Y346 Y357 G420 D421 F447 F448	Y346-N445 HydrophobicContact CD2-CB 4.28Å; Y346-N445 HydrophobicContact CE2-CB 3.78Å; Y346-N445 PolarHBondContact OH-N 3.3Å; Y346-N445 VanDerWaalsContact OH-N 3.16Å; Y357-N445 WeakPolarHBondContact CE2-OD1 3.49Å; Y357-N445 PolarHBondContact OH-ND2 2.94Å; Y357-N445 VanDerWaalsContact OH-ND2 3.14Å; G420-N445 WeakPolarHBondContact O-CA 3.4Å; D421-N445 WeakPolarHBondContact OD1-CB 3.2Å; D421-N445 PolarHBondContact OD1-ND2 3.5Å; N445-F447 PolarHBondContact O-N 2.96Å; N445-F447 VanDerWaalsContact OD1-CB 3.26Å; N445-F447 WeakPolarHBondContact OD1-CB 3.33Å; N445-F447 PolarHBondContact OD1-N 2.78Å; N445-F448 HydrophobicContact CB-CD2 3.99Å; N445-F448 HydrophobicContact CB-CE2 4.14Å; N445-F448 PolarHBondContact O-N 3.09Å
446	T	97.2	Very high	80.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-64	-20.9	-173.5	57.1	0	0	0	0	115.1	V360 L362 V418 G420 F448 I449 P450	V360-T446 VanDerWaalsContact O-CB 3.23Å; V360-T446 WeakPolarHBondContact O-CB 3.49Å; V360-T446 PolarHBondContact O-OG1 2.8Å; L362-T446 HydrophobicContact CD1-CG2 4.12Å; L362-T446 HydrophobicContact CG-CG2 4.48Å; V418-T446 HydrophobicContact CB-CG2 4.37Å; V418-T446 HydrophobicContact CG2-CG2 4Å; G420-T446 PolarHBondContact N-OG1 3.1Å; G420-T446 PolarHBondContact O-N 2.81Å; G420-T446 VanDerWaalsContact O-N 3.13Å; T446-F448 PolarHBondContact O-N 3.03Å; T446-I449 PolarHBondContact O-N 3.27Å; T446-P450 WeakPolarHBondContact O-CD 3.36Å
447	F	95.8	Very high	78.3	Confident	30 Å²	30	51.4 Å²	51.4	13%	0.132	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-62	-30.4	177.3	177.2	-86.4	0	0	0	113.1	L350 L355 Y357 R358 V360 N445	L350-F447 HydrophobicContact CD2-CD1 4.22Å; L350-F447 HydrophobicContact CD2-CE1 3.45Å; L350-F447 VanDerWaalsContact CD2-CE1 3.45Å; L350-F447 HydrophobicContact CD2-CZ 3.75Å; L355-F447 HydrophobicContact CB-CZ 4.25Å; L355-F447 HydrophobicContact CD1-CE1 4.29Å; L355-F447 HydrophobicContact CD1-CZ 4.13Å; Y357-F447 HydrophobicContact CD2-CB 3.86Å; Y357-F447 HydrophobicContact CD2-CD1 4.4Å; Y357-F447 AromaticContact CD2-CD2 3.89Å; Y357-F447 HydrophobicContact CD2-CD2 3.89Å; Y357-F447 AromaticContact CD2-CG 3.81Å; Y357-F447 HydrophobicContact CD2-CG 3.81Å; Y357-F447 HydrophobicContact CE2-CB 3.66Å; Y357-F447 HydrophobicContact CE2-CD2 4.38Å; Y357-F447 HydrophobicContact CE2-CG 4.15Å; R358-F447 HydrophobicContact CG-CD2 4.34Å; R358-F447 HydrophobicContact CG-CE2 4.19Å; R358-F447 WeakPolarHBondContact O-CD2 3.47Å; V360-F447 HydrophobicContact CG2-CB 4.19Å; V360-F447 HydrophobicContact CG2-CD2 3.95Å; V360-F447 HydrophobicContact CG2-CG 4.46Å; N445-F447 PolarHBondContact O-N 2.96Å; N445-F447 VanDerWaalsContact OD1-CB 3.26Å; N445-F447 WeakPolarHBondContact OD1-CB 3.33Å; N445-F447 PolarHBondContact OD1-N 2.78Å
448	F	94.9	Very high	75.6	Confident	11 Å²	11	58.7 Å²	58.7	5%	0.048	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-99	18.7	-176.7	-49.7	-94	0	0	0	113	L267 Y346 Y349 L350 N445 T446 C473	L267-F448 HydrophobicContact CD1-CE2 4.25Å; L267-F448 HydrophobicContact CD1-CZ 4.36Å; L267-F448 HydrophobicContact CD2-CE2 3.66Å; L267-F448 HydrophobicContact CD2-CZ 3.97Å; Y346-F448 VanDerWaalsContact CB-CZ 3.47Å; Y346-F448 HydrophobicContact CD1-CB 3.95Å; Y346-F448 AromaticContact CD1-CD1 3.64Å; Y346-F448 HydrophobicContact CD1-CD1 3.64Å; Y346-F448 AromaticContact CD1-CD2 3.51Å; Y346-F448 HydrophobicContact CD1-CD2 3.51Å; Y346-F448 AromaticContact CD1-CE1 3.97Å; Y346-F448 HydrophobicContact CD1-CE1 3.97Å; Y346-F448 AromaticContact CD1-CE2 3.87Å; Y346-F448 HydrophobicContact CD1-CE2 3.87Å; Y346-F448 AromaticContact CD1-CG 3.4Å; Y346-F448 HydrophobicContact CD1-CG 3.4Å; Y346-F448 VanDerWaalsContact CD1-CG 3.4Å; Y346-F448 HydrophobicContact CD1-CZ 4.09Å; Y346-F448 AromaticContact CD2-CD2 3.92Å; Y346-F448 HydrophobicContact CD2-CD2 3.92Å; Y346-F448 AromaticContact CD2-CE2 3.85Å; Y346-F448 HydrophobicContact CD2-CE2 3.85Å; Y346-F448 HydrophobicContact CD2-CZ 4.49Å; Y346-F448 HydrophobicContact CE1-CB 3.48Å; Y346-F448 VanDerWaalsContact CE1-CB 3.48Å; Y346-F448 HydrophobicContact CE1-CD1 4.12Å; Y346-F448 AromaticContact CE1-CD2 3.58Å; Y346-F448 HydrophobicContact CE1-CD2 3.58Å; Y346-F448 HydrophobicContact CE1-CE2 4.35Å; Y346-F448 AromaticContact CE1-CG 3.45Å; Y346-F448 HydrophobicContact CE1-CG 3.45Å; Y346-F448 VanDerWaalsContact CE1-CG 3.45Å; Y346-F448 AromaticContact CE2-CD2 3.99Å; Y346-F448 HydrophobicContact CE2-CD2 3.99Å; Y346-F448 HydrophobicContact CE2-CE2 4.34Å; Y346-F448 HydrophobicContact CG-CD1 4.23Å; Y346-F448 AromaticContact CG-CD2 3.66Å; Y346-F448 HydrophobicContact CG-CD2 3.66Å; Y346-F448 HydrophobicContact CG-CE1 4.13Å; Y346-F448 AromaticContact CG-CE2 3.56Å; Y346-F448 HydrophobicContact CG-CE2 3.56Å; Y346-F448 HydrophobicContact CG-CG 4.02Å; Y346-F448 AromaticContact CG-CZ 3.82Å; Y346-F448 HydrophobicContact CG-CZ 3.82Å; Y346-F448 AromaticContact CZ-CD2 3.79Å; Y346-F448 WeakPolarHBondContact O-CE1 3.36Å; Y349-F448 AromaticContact CD1-CD1 3.88Å; Y349-F448 HydrophobicContact CD1-CD1 3.88Å; Y349-F448 AromaticContact CD1-CE1 3.73Å; Y349-F448 HydrophobicContact CD1-CE1 3.73Å; Y349-F448 HydrophobicContact CE1-CD1 4.35Å; Y349-F448 HydrophobicContact CG-CD1 4.34Å; Y349-F448 HydrophobicContact CG-CE1 4.28Å; L350-F448 HydrophobicContact CD1-CZ 4.23Å; L350-F448 HydrophobicContact CD2-CE1 4.29Å; L350-F448 HydrophobicContact CD2-CZ 4.15Å; L350-F448 HydrophobicContact CG-CE1 4.21Å; L350-F448 HydrophobicContact CG-CZ 3.99Å; N445-F448 HydrophobicContact CB-CD2 3.99Å; N445-F448 HydrophobicContact CB-CE2 4.14Å; N445-F448 PolarHBondContact O-N 3.09Å; T446-F448 PolarHBondContact O-N 3.03Å; F448-C473 PolarHBondContact O-SG 3.17Å
449	I	92.1	Very high	72.4	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	33%	0.331	C	S	.	.	S	Bend	trans	-101.8	-41	-178.5	-59	-174	0	0	0	111.9	L362 V444 T446 G451 L485 L487 F516	L362-I449 HydrophobicContact CD1-CB 3.83Å; L362-I449 HydrophobicContact CD1-CD1 4.27Å; L362-I449 HydrophobicContact CD1-CG2 3.89Å; V444-I449 HydrophobicContact CG2-CD1 4.38Å; T446-I449 PolarHBondContact O-N 3.27Å; I449-G451 PolarHBondContact O-N 3.23Å; I449-L485 HydrophobicContact CG2-CB 4.22Å; I449-L487 HydrophobicContact CD1-CD2 4.29Å; I449-L487 HydrophobicContact CG1-CD2 4.27Å; I449-F516 HydrophobicContact CD1-CD2 4.21Å; I449-F516 HydrophobicContact CD1-CE1 4.23Å; I449-F516 HydrophobicContact CD1-CE2 3.67Å; I449-F516 HydrophobicContact CD1-CZ 3.69Å; I449-F516 HydrophobicContact CG2-CB 4.35Å; I449-F516 HydrophobicContact CG2-CD2 3.49Å; I449-F516 VanDerWaalsContact CG2-CD2 3.49Å; I449-F516 HydrophobicContact CG2-CE2 3.9Å; I449-F516 HydrophobicContact CG2-CG 4.04Å
450	P	79.8	Confident	69.4	Low	28 Å²	28	70 Å²	70	18%	0.182	37%	0.371	C	S	.	.	S	Bend	trans	-57.4	127.6	150.4	-15.9	30.3	0	0	0	107.8	V360 T446 L485	V360-P450 HydrophobicContact CG1-CG 4.29Å; T446-P450 WeakPolarHBondContact O-CD 3.36Å; P450-L485 HydrophobicContact CB-CD1 4.29Å; P450-L485 HydrophobicContact CG-CD1 4.03Å
451	G	64.3	Low	66.1	Low	36 Å²	36	77.6 Å²	77.6	37%	0.371	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-65.8	172.1	163.5	0	0	0	0	0	110.4	I449 E453	I449-G451 PolarHBondContact O-N 3.23Å; G451-E453 PolarHBondContact O-N 2.85Å
452	P	53.7	Low	63.1	Low	80 Å²	80	80.4 Å²	80.4	52%	0.519	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-54.1	126.2	160.8	26.6	-33.3	0	0	0	108.3
453	E	50.3	Low	59.6	Low	128 Å²	128	86.1 Å²	86.1	60%	0.598	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-64.4	154.4	172.7	-58.6	-164.6	155.5	0	0	109.5	G451 T455 K518	G451-E453 PolarHBondContact O-N 2.85Å; E453-T455 PolarHBondContact O-N 2.78Å; E453-K518 IonicContact OE1-NZ 3.26Å; E453-K518 PolarHBondContact OE1-NZ 2.9Å
454	E	42.7	Very low	56.5	Low	177 Å²	177	92.2 Å²	92.2	83%	0.827	52%	0.521	S	S	*	.			trans	-68.4	79.8	-179	-68.3	-168	149.7	0	0	111.7	S456	E454-S456 VanDerWaalsContact C-N 3.29Å; E454-S456 PolarHBondContact O-N 3.1Å; E454-S456 PolarHBondContact O-OG 2.96Å
455	T	32.7	Very low	53.3	Low	132 Å²	132	95.8 Å²	95.8	81%	0.81	55%	0.545	S	S	*	.			trans	-55.4	100	156.5	45.8	0	0	0	0	106.9	E453 E457	E453-T455 PolarHBondContact O-N 2.78Å; T455-E457 PolarHBondContact O-N 3.01Å
456	S	33.9	Very low	50.5	Low	112 Å²	112	100.1 Å²	100.1	78%	0.783	57%	0.568	S	S	*	*			trans	-75.7	55.1	-162.5	-68.3	0	0	0	0	114	E454	E454-S456 VanDerWaalsContact C-N 3.29Å; E454-S456 PolarHBondContact O-N 3.1Å; E454-S456 PolarHBondContact O-OG 2.96Å
457	E	30.1	Very low	47.8	Very low	168 Å²	168	107.1 Å²	107.1	79%	0.785	60%	0.6	S	S	*	*			trans	-114.1	99	167.9	-66.4	-160.9	166.9	0	0	109.9	T455 V459	T455-E457 PolarHBondContact O-N 3.01Å; E457-V459 HydrophobicContact CB-CG2 4.47Å; E457-V459 PolarHBondContact O-N 3.15Å
458	K	35.3	Very low	45.6	Very low	210 Å²	210	111.4 Å²	111.4	91%	0.913	62%	0.621	S	S	*	*			trans	-66.5	94.4	168	-78.5	-174.4	174.3	-176.9	0	109.8	E460	K458-E460 PolarHBondContact O-N 3.28Å
459	V	29.6	Very low	43.5	Very low	123 Å²	123	112.7 Å²	112.7	75%	0.745	63%	0.628	S	S	*	*			trans	-92.2	89.2	169.6	-170.7	0	0	0	0	109.5	E457 N461	E457-V459 HydrophobicContact CB-CG2 4.47Å; E457-V459 PolarHBondContact O-N 3.15Å; V459-N461 PolarHBondContact O-N 2.72Å; V459-N461 VanDerWaalsContact O-N 3.1Å
460	E	34.6	Very low	41.1	Very low	178 Å²	178	116.8 Å²	116.8	83%	0.832	65%	0.65	S	S	*	*			trans	-67.9	102.6	163.9	-73.7	-171	139.6	0	0	109.7	K458	K458-E460 PolarHBondContact O-N 3.28Å
461	N	29.3	Very low	39.8	Very low	159 Å²	159	119.8 Å²	119.8	85%	0.85	67%	0.672	S	S	*	*				-169.4	150.3	128.1	-104.7	-70.9	0	0	0	111.3	V459 S463	V459-N461 PolarHBondContact O-N 2.72Å; V459-N461 VanDerWaalsContact O-N 3.1Å; N461-S463 PolarHBondContact O-N 3.43Å
462	G	35.9	Very low	39.5	Very low	82 Å²	82	120.3 Å²	120.3	85%	0.845	67%	0.665	S	S	*	*			trans	-73	125.3	-165.2	0	0	0	0	0	115.2
463	S	24.8	Very low	40	Very low	119 Å²	119	117.5 Å²	117.5	83%	0.832	65%	0.648	S	S	*	*			trans	-135.3	120.2	154.9	-171.3	0	0	0	0	109.3	N461	N461-S463 PolarHBondContact O-N 3.43Å
464	L	32.9	Very low	41.2	Very low	162 Å²	162	113.8 Å²	113.8	85%	0.848	64%	0.636	S	S	*	*			trans	-92.3	110.3	-177.3	-72.1	166.3	0	0	0	110.4
465	C	32.3	Very low	42.7	Very low	76 Å²	76	110.7 Å²	110.7	51%	0.514	62%	0.623	S	S	.	*			trans	164.9	65.2	135.5	55.8	0	0	0	0	116.8	K316	K316-C465 PolarHBondContact NZ-SG 2.85Å
466	D	38	Very low	44.7	Very low	91 Å²	91	106.9 Å²	106.9	49%	0.487	60%	0.596	S	S	.	*			trans	-135.8	13.3	175.7	-87.5	-61.1	0	0	0	116.2	K352 E468	K352-D466 IonicContact NZ-OD1 3.71Å; K352-D466 PolarHBondContact NZ-OD1 2.74Å; K352-D466 IonicContact NZ-OD2 2.78Å; K352-D466 PolarHBondContact NZ-OD2 2.98Å; D466-E468 PolarHBondContact O-N 3.28Å
467	Q	40.9	Very low	46	Very low	146 Å²	146	111 Å²	111	68%	0.682	60%	0.595	S	S	*	*	H	α-helix	trans	-67	-6.5	-171.3	-69.4	173.8	-24.8	0	0	116.1	I469 S471	Q467-I469 PolarHBondContact O-N 2.85Å; Q467-S471 WeakPolarHBondContact O-CB 3.43Å; Q467-S471 PolarHBondContact O-N 2.85Å; Q467-S471 VanDerWaalsContact O-N 3.16Å; Q467-S471 PolarHBondContact O-OG 2.81Å
468	E	49.2	Very low	47.4	Very low	120 Å²	120	104.7 Å²	104.7	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-77.1	-14.5	-165.6	-63.9	-162.4	141.1	0	0	115.9	Y345 D466 I472	Y345-E468 HydrophobicContact CE1-CB 4.36Å; Y345-E468 WeakPolarHBondContact CE1-OE2 3.14Å; Y345-E468 VanDerWaalsContact CZ-OE2 3.29Å; Y345-E468 PolarHBondContact OH-OE2 3.25Å; D466-E468 PolarHBondContact O-N 3.28Å; E468-I472 WeakPolarHBondContact O-CD1 3.47Å; E468-I472 WeakPolarHBondContact O-CG1 3.26Å
469	I	50.3	Low	48.2	Very low	39 Å²	39	102.7 Å²	102.7	20%	0.2	57%	0.571	C	S	.	*	H	α-helix	trans	-108	-46.8	172.1	-68	174.3	0	0	0	110	Y349 Q467 S471 I472	Y349-I469 HydrophobicContact CD2-CD1 3.79Å; Y349-I469 HydrophobicContact CG-CD1 4.19Å; Q467-I469 PolarHBondContact O-N 2.85Å; I469-S471 PolarHBondContact O-N 2.95Å; I469-I472 WeakPolarHBondContact O-CB 3.35Å; I469-I472 PolarHBondContact O-N 2.99Å
470	D	43.4	Very low	49.5	Very low	87 Å²	87	103.4 Å²	103.4	47%	0.465	57%	0.57	S	S	.	*	H	α-helix	trans	-65.7	-21.1	-176.2	-53.8	-19.6	0	0	0	113.2	I472	D470-I472 VanDerWaalsContact C-N 3.31Å
471	S	50.6	Low	50.8	Low	91 Å²	91	102.7 Å²	102.7	64%	0.636	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-6.3	172.6	-53.1	0	0	0	0	114.2	Q467 I469	Q467-S471 WeakPolarHBondContact O-CB 3.43Å; Q467-S471 PolarHBondContact O-N 2.85Å; Q467-S471 VanDerWaalsContact O-N 3.16Å; Q467-S471 PolarHBondContact O-OG 2.81Å; I469-S471 PolarHBondContact O-N 2.95Å
472	I	58.7	Low	52.7	Low	46 Å²	46	100.9 Å²	100.9	24%	0.236	56%	0.557	C	S	.	*	T	Hydrogen-bonded Turn	trans	-100.9	-31.5	-175.8	-45.1	-172.9	0	0	0	111.3	E468 I469 D470 L487 T488 L489	E468-I472 WeakPolarHBondContact O-CD1 3.47Å; E468-I472 WeakPolarHBondContact O-CG1 3.26Å; I469-I472 WeakPolarHBondContact O-CB 3.35Å; I469-I472 PolarHBondContact O-N 2.99Å; D470-I472 VanDerWaalsContact C-N 3.31Å; I472-L487 HydrophobicContact CB-CD1 4.21Å; I472-L487 HydrophobicContact CG2-CD1 3.5Å; I472-L487 VanDerWaalsContact CG2-CD1 3.5Å; I472-L487 HydrophobicContact CG2-CG 4.39Å; I472-L487 WeakPolarHBondContact O-CA 3.15Å; I472-T488 VanDerWaalsContact CG2-O 3.25Å; I472-T488 WeakPolarHBondContact CG2-O 3.46Å; I472-T488 PolarHBondContact O-N 2.91Å; I472-L489 HydrophobicContact CG2-CD2 4.45Å
473	C	65.3	Low	55	Low	22 Å²	22	101.4 Å²	101.4	15%	0.149	54%	0.537	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.4	176.8	-67.7	0	0	0	0	110.9	F448 V486 L487	F448-C473 PolarHBondContact O-SG 3.17Å; C473-V486 CarbonylContact C-O 3.58Å; C473-V486 WeakPolarHBondContact CA-O 3.46Å; C473-L487 WeakPolarHBondContact SG-CD1 3.43Å
474	S	74.4	Confident	58.2	Low	50 Å²	50	97.1 Å²	97.1	35%	0.35	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.2	179.3	59.1	0	0	0	0	111.4	V486	S474-V486 PolarHBondContact N-O 3.4Å; S474-V486 WeakPolarHBondContact O-CA 3.36Å; S474-V486 WeakPolarHBondContact O-CB 3.46Å; S474-V486 PolarHBondContact O-N 3.46Å
475	I	73.8	Confident	61	Low	111 Å²	111	90.6 Å²	90.6	57%	0.569	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.8	171.5	-62.3	179.1	0	0	0	109	E483 Y484 L485	I475-E483 HydrophobicContact CG2-CG 3.25Å; I475-Y484 WeakPolarHBondContact CA-O 3.3Å; I475-L485 HydrophobicContact CG1-CD2 4.42Å
476	E	75	Confident	64	Low	52 Å²	52	87 Å²	87	24%	0.243	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123	173.3	-64.1	-173.1	170.3	0	0	110.3	Y484 V486 K513 Y515	E476-Y484 PolarHBondContact N-O 2.78Å; E476-Y484 PolarHBondContact O-N 2.62Å; E476-V486 HydrophobicContact CB-CG2 3.73Å; E476-V486 HydrophobicContact CG-CB 4.24Å; E476-V486 HydrophobicContact CG-CG2 3.72Å; E476-K513 IonicContact OE1-NZ 3.28Å; E476-K513 PolarHBondContact OE1-NZ 3.4Å; E476-Y515 WeakPolarHBondContact OE2-CE1 3.34Å; E476-Y515 VanDerWaalsContact OE2-CZ 3.29Å; E476-Y515 PolarHBondContact OE2-OH 2.8Å
477	R	61.4	Low	66.7	Low	199 Å²	199	83 Å²	83	75%	0.751	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	128.5	168.2	-66.6	-178.9	-179.2	165.4	3.1	109.5	E483	R477-E483 HydrophobicContact CG-CG 4.23Å; R477-E483 IonicContact CZ-OE1 2.62Å; R477-E483 IonicContact NE-OE1 2.61Å; R477-E483 PolarHBondContact NE-OE1 3.22Å; R477-E483 IonicContact NH2-OE1 2.66Å; R477-E483 PolarHBondContact NH2-OE1 2.78Å
478	A	59.9	Low	69.3	Low	35 Å²	35	77.1 Å²	77.1	29%	0.289	40%	0.397	S	S	.	.			trans	-90.8	161.3	171	0	0	0	0	0	111.4	N480 D481 K482 Y484	A478-N480 PolarHBondContact O-N 2.81Å; A478-D481 PolarHBondContact O-N 2.81Å; A478-D481 VanDerWaalsContact O-N 3.15Å; A478-K482 PolarHBondContact N-O 3.19Å; A478-Y484 HydrophobicContact CB-CD2 4.23Å; A478-Y484 HydrophobicContact CB-CE2 3.81Å
479	D	52.4	Low	71.6	Confident	168 Å²	168	71.5 Å²	71.5	90%	0.898	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-3.3	-177.6	-49.4	-58.6	0	0	0	115.9
480	N	57.2	Low	73.9	Confident	138 Å²	138	72 Å²	72	74%	0.738	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	34	-179.6	-61.6	-31.9	0	0	0	111.5	A478 K482	A478-N480 PolarHBondContact O-N 2.81Å; N480-K482 PolarHBondContact O-N 3.06Å
481	D	61.2	Low	76.5	Confident	163 Å²	163	68.2 Å²	68.2	87%	0.872	36%	0.355	S	S	*	.	S	Bend	trans	54.4	8	-178	-63.5	-42.5	0	0	0	116.8	A478 E483	A478-D481 PolarHBondContact O-N 2.81Å; A478-D481 VanDerWaalsContact O-N 3.15Å; D481-E483 PolarHBondContact O-N 2.88Å
482	K	69.2	Low	78.7	Confident	122 Å²	122	68.5 Å²	68.5	53%	0.53	35%	0.35	S	S	.	.			trans	-81.4	118.6	176	-70.8	-168.6	175.9	-171.8	0	111.1	A478 N480 Y484	A478-K482 PolarHBondContact N-O 3.19Å; N480-K482 PolarHBondContact O-N 3.06Å; K482-Y484 HydrophobicContact CB-CE2 4.09Å
483	E	84.3	Confident	80.5	Confident	93 Å²	93	68.2 Å²	68.2	44%	0.435	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.6	175.4	-164.9	160	-102.8	0	0	109.9	I475 R477 D481	I475-E483 HydrophobicContact CG2-CG 3.25Å; R477-E483 HydrophobicContact CG-CG 4.23Å; R477-E483 IonicContact CZ-OE1 2.62Å; R477-E483 IonicContact NE-OE1 2.61Å; R477-E483 PolarHBondContact NE-OE1 3.22Å; R477-E483 IonicContact NH2-OE1 2.66Å; R477-E483 PolarHBondContact NH2-OE1 2.78Å; D481-E483 PolarHBondContact O-N 2.88Å
484	Y	90.8	Very high	82	Confident	28 Å²	28	67.1 Å²	67.1	11%	0.11	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.7	179.8	-68.3	-79.2	0	0	0	111.5	H365 I475 E476 A478 K482 Y515 F516 T517	H365-Y484 HydrophobicContact CB-CE1 3.89Å; H365-Y484 AromaticContact CD2-CE1 3.82Å; H365-Y484 AromaticContact CG-CE1 3.68Å; I475-Y484 WeakPolarHBondContact CA-O 3.3Å; E476-Y484 PolarHBondContact N-O 2.78Å; E476-Y484 PolarHBondContact O-N 2.62Å; A478-Y484 HydrophobicContact CB-CD2 4.23Å; A478-Y484 HydrophobicContact CB-CE2 3.81Å; K482-Y484 HydrophobicContact CB-CE2 4.09Å; Y484-Y515 HydrophobicContact CD1-CD1 4.37Å; Y484-Y515 HydrophobicContact CD2-CD1 4.13Å; Y484-Y515 AromaticContact CG-CD1 3.87Å; Y484-Y515 HydrophobicContact CG-CD1 3.87Å; Y484-F516 WeakPolarHBondContact CA-O 3.48Å; Y484-T517 HydrophobicContact CD1-CG2 3.95Å; Y484-T517 HydrophobicContact CE1-CG2 4.21Å
485	L	93.5	Very high	83.1	Confident	25 Å²	25	65 Å²	65	13%	0.131	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	117	159	-56.2	175.9	0	0	0	107.6	L362 I449 P450 I475 F516 K518	L362-L485 HydrophobicContact CD2-CD1 4.18Å; I449-L485 HydrophobicContact CG2-CB 4.22Å; P450-L485 HydrophobicContact CB-CD1 4.29Å; P450-L485 HydrophobicContact CG-CD1 4.03Å; I475-L485 HydrophobicContact CG1-CD2 4.42Å; L485-F516 HydrophobicContact CB-CB 4.36Å; L485-F516 PolarHBondContact N-O 3.18Å; L485-F516 PolarHBondContact O-N 2.85Å; L485-K518 HydrophobicContact CD1-CG 4.39Å
486	V	94	Very high	84.2	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	116.4	-173.9	-172.7	0	0	0	0	111.3	C473 S474 E476 K513 L514 Y515	C473-V486 CarbonylContact C-O 3.58Å; C473-V486 WeakPolarHBondContact CA-O 3.46Å; S474-V486 PolarHBondContact N-O 3.4Å; S474-V486 WeakPolarHBondContact O-CA 3.36Å; S474-V486 WeakPolarHBondContact O-CB 3.46Å; S474-V486 PolarHBondContact O-N 3.46Å; E476-V486 HydrophobicContact CB-CG2 3.73Å; E476-V486 HydrophobicContact CG-CB 4.24Å; E476-V486 HydrophobicContact CG-CG2 3.72Å; V486-K513 HydrophobicContact CG1-CB 4.1Å; V486-K513 HydrophobicContact CG1-CD 4.08Å; V486-K513 HydrophobicContact CG1-CG 4.35Å; V486-L514 VanDerWaalsContact CA-O 3.32Å; V486-L514 WeakPolarHBondContact CA-O 3.49Å; V486-Y515 HydrophobicContact CB-CE1 4.43Å; V486-Y515 HydrophobicContact CG1-CD1 4.41Å; V486-Y515 HydrophobicContact CG1-CE1 4.03Å; V486-Y515 HydrophobicContact CG1-CE2 4.36Å; V486-Y515 HydrophobicContact CG2-CD1 3.53Å; V486-Y515 HydrophobicContact CG2-CE1 3.46Å; V486-Y515 VanDerWaalsContact CG2-CE1 3.46Å; V486-Y515 HydrophobicContact CG2-CG 4.35Å
487	L	95.1	Very high	85.3	Confident	8 Å²	8	61 Å²	61	4%	0.042	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.1	173.5	178.6	72.8	0	0	0	109.9	V444 I449 I472 C473 L489 L514 F516	V444-L487 HydrophobicContact CB-CD2 4.11Å; V444-L487 HydrophobicContact CG1-CD2 3.65Å; V444-L487 HydrophobicContact CG2-CD2 4.39Å; I449-L487 HydrophobicContact CD1-CD2 4.29Å; I449-L487 HydrophobicContact CG1-CD2 4.27Å; I472-L487 HydrophobicContact CB-CD1 4.21Å; I472-L487 HydrophobicContact CG2-CD1 3.5Å; I472-L487 VanDerWaalsContact CG2-CD1 3.5Å; I472-L487 HydrophobicContact CG2-CG 4.39Å; I472-L487 WeakPolarHBondContact O-CA 3.15Å; C473-L487 WeakPolarHBondContact SG-CD1 3.43Å; L487-L489 HydrophobicContact CD2-CD2 4.34Å; L487-L489 HydrophobicContact CG-CD2 4.27Å; L487-L514 HydrophobicContact CB-CB 4.22Å; L487-L514 HydrophobicContact CB-CD1 4.23Å; L487-L514 HydrophobicContact CD2-CD1 3.8Å; L487-L514 HydrophobicContact CG-CD1 4.11Å; L487-L514 PolarHBondContact N-O 3.23Å; L487-L514 WeakPolarHBondContact O-CB 3.47Å; L487-L514 PolarHBondContact O-N 2.99Å; L487-F516 HydrophobicContact CB-CE2 4.47Å
488	T	96.2	Very high	86.9	Confident	23 Å²	23	52.8 Å²	52.8	14%	0.141	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	100.1	-173.9	-59.3	0	0	0	0	112.4	I472 K511 K513	I472-T488 VanDerWaalsContact CG2-O 3.25Å; I472-T488 WeakPolarHBondContact CG2-O 3.46Å; I472-T488 PolarHBondContact O-N 2.91Å; T488-K511 HydrophobicContact CG2-CB 4.29Å; T488-K511 HydrophobicContact CG2-CD 3.53Å; T488-K513 HydrophobicContact CG2-CG 4.03Å
489	L	96.9	Very high	88.6	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.5	178.1	-57.7	-177.2	0	0	0	111.4	F442 V444 I472 L487 D493 L494 K511 V512 L514	F442-L489 HydrophobicContact CB-CD1 3.94Å; F442-L489 HydrophobicContact CD1-CD1 3.95Å; F442-L489 HydrophobicContact CD2-CD1 3.5Å; F442-L489 VanDerWaalsContact CD2-CD1 3.5Å; F442-L489 HydrophobicContact CE1-CD1 4.31Å; F442-L489 HydrophobicContact CE2-CD1 3.9Å; F442-L489 HydrophobicContact CG-CD1 3.51Å; F442-L489 HydrophobicContact CZ-CD1 4.28Å; V444-L489 HydrophobicContact CG1-CD1 4.23Å; I472-L489 HydrophobicContact CG2-CD2 4.45Å; L487-L489 HydrophobicContact CD2-CD2 4.34Å; L487-L489 HydrophobicContact CG-CD2 4.27Å; L489-D493 HydrophobicContact CB-CB 4.01Å; L489-D493 HydrophobicContact CD2-CB 4.19Å; L489-L494 HydrophobicContact CB-CD2 3.92Å; L489-L494 HydrophobicContact CB-CG 4.44Å; L489-L494 HydrophobicContact CD1-CD2 3.96Å; L489-K511 CarbonylContact O-C 3.52Å; L489-K511 VanDerWaalsContact O-CA 3.26Å; L489-K511 WeakPolarHBondContact O-CA 3.34Å; L489-V512 PolarHBondContact N-O 2.79Å; L489-V512 PolarHBondContact O-N 2.94Å; L489-L514 HydrophobicContact CD1-CD1 3.83Å; L489-L514 HydrophobicContact CG-CD1 3.98Å
490	T	97.9	Very high	90.7	Very high	49 Å²	49	50.6 Å²	50.6	30%	0.301	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	169.1	174.4	79.2	0	0	0	0	111.8	N492 D493 L494 F510 K511	T490-N492 PolarHBondContact O-N 2.8Å; T490-N492 PolarHBondContact OG1-N 3.06Å; T490-D493 WeakPolarHBondContact CA-OD2 3.35Å; T490-D493 VanDerWaalsContact CB-OD2 3.24Å; T490-D493 WeakPolarHBondContact CB-OD2 3Å; T490-D493 WeakPolarHBondContact CG2-OD2 3.39Å; T490-D493 PolarHBondContact N-OD2 2.71Å; T490-D493 WeakPolarHBondContact O-CB 3.34Å; T490-D493 PolarHBondContact O-N 2.8Å; T490-D493 PolarHBondContact OG1-OD2 3.32Å; T490-L494 WeakPolarHBondContact O-CG 3.24Å; T490-F510 CarbonylContact C-O 3.49Å; T490-K511 HydrophobicContact CG2-CD 4.4Å
491	K	97.8	Very high	92.5	Very high	9 Å²	9	50.6 Å²	50.6	4%	0.039	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-48.8	-33.8	171.3	-179.8	172.3	174.1	175.5	0	114.1	D493 A497 N498 D500 N503 F506 S507 F510	K491-D493 VanDerWaalsContact C-N 3.33Å; K491-A497 WeakPolarHBondContact CE-O 3.44Å; K491-N498 VanDerWaalsContact O-CA 3.3Å; K491-N498 WeakPolarHBondContact O-CA 3.47Å; K491-N498 PolarHBondContact O-N 3.26Å; K491-D500 VanDerWaalsContact CE-O 3.3Å; K491-D500 WeakPolarHBondContact CE-O 3.41Å; K491-D500 PolarHBondContact NZ-O 3.12Å; K491-D500 IonicContact NZ-OD2 3.03Å; K491-D500 PolarHBondContact NZ-OD2 3.08Å; K491-N503 PolarHBondContact NZ-OD1 2.88Å; K491-F506 HydrophobicContact CD-CB 3.83Å; K491-F506 HydrophobicContact CG-CB 4.45Å; K491-F506 PolarHBondContact NZ-O 3.37Å; K491-S507 VanDerWaalsContact CD-O 3.29Å; K491-S507 WeakPolarHBondContact CD-O 3.46Å; K491-F510 HydrophobicContact CB-CB 4.32Å; K491-F510 PolarHBondContact N-O 2.84Å
492	N	96.9	Very high	94.2	Very high	96 Å²	96	46.2 Å²	46.2	51%	0.513	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-76.5	-21.3	179.2	-70.3	-51.5	0	0	0	112.9	P338 T490 L494 N498 K501	P338-N492 WeakPolarHBondContact CG-O 3.41Å; T490-N492 PolarHBondContact O-N 2.8Å; T490-N492 PolarHBondContact OG1-N 3.06Å; N492-L494 VanDerWaalsContact C-N 3.32Å; N492-N498 WeakPolarHBondContact O-CB 3.15Å; N492-K501 PolarHBondContact OD1-NZ 3.45Å
493	D	96.9	Very high	95.5	Very high	40 Å²	40	43.3 Å²	43.3	21%	0.214	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-83.6	-8.2	180	-61.9	-63.6	0	0	0	113.9	P338 R342 L489 T490 K491	P338-D493 VanDerWaalsContact CB-C 3.47Å; P338-D493 VanDerWaalsContact CB-O 3.27Å; P338-D493 WeakPolarHBondContact CB-O 3.14Å; R342-D493 PolarHBondContact NH2-O 2.93Å; L489-D493 HydrophobicContact CB-CB 4.01Å; L489-D493 HydrophobicContact CD2-CB 4.19Å; T490-D493 WeakPolarHBondContact CA-OD2 3.35Å; T490-D493 VanDerWaalsContact CB-OD2 3.24Å; T490-D493 WeakPolarHBondContact CB-OD2 3Å; T490-D493 WeakPolarHBondContact CG2-OD2 3.39Å; T490-D493 PolarHBondContact N-OD2 2.71Å; T490-D493 WeakPolarHBondContact O-CB 3.34Å; T490-D493 PolarHBondContact O-N 2.8Å; T490-D493 PolarHBondContact OG1-OD2 3.32Å; K491-D493 VanDerWaalsContact C-N 3.33Å
494	L	97.8	Very high	96.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	-104.6	125.5	-171.2	-62.2	172.7	0	0	0	111	F440 F442 L489 T490 N492 A497 N498 F510 V512	F440-L494 HydrophobicContact CB-CB 4.44Å; F440-L494 HydrophobicContact CD2-CB 4.11Å; F440-L494 HydrophobicContact CD2-CD1 4Å; F440-L494 HydrophobicContact CD2-CD2 3.84Å; F440-L494 HydrophobicContact CD2-CG 4.2Å; F440-L494 HydrophobicContact CE2-CD1 4.03Å; F440-L494 HydrophobicContact CE2-CD2 3.88Å; F440-L494 HydrophobicContact CE2-CG 4.47Å; F440-L494 HydrophobicContact CG-CB 4.49Å; F440-L494 HydrophobicContact CG-CD1 4.46Å; F442-L494 HydrophobicContact CB-CD2 4.12Å; F442-L494 HydrophobicContact CD1-CD2 3.46Å; F442-L494 VanDerWaalsContact CD1-CD2 3.46Å; F442-L494 HydrophobicContact CE1-CD2 4.19Å; F442-L494 HydrophobicContact CG-CD2 4.07Å; L489-L494 HydrophobicContact CB-CD2 3.92Å; L489-L494 HydrophobicContact CB-CG 4.44Å; L489-L494 HydrophobicContact CD1-CD2 3.96Å; T490-L494 WeakPolarHBondContact O-CG 3.24Å; N492-L494 VanDerWaalsContact C-N 3.32Å; L494-A497 HydrophobicContact CB-CB 3.89Å; L494-A497 PolarHBondContact O-N 2.84Å; L494-N498 WeakPolarHBondContact O-CB 3.34Å; L494-N498 PolarHBondContact O-N 3.19Å; L494-N498 PolarHBondContact O-ND2 3.2Å; L494-F510 HydrophobicContact CD1-CD1 3.91Å; L494-F510 HydrophobicContact CD1-CE1 3.55Å; L494-V512 HydrophobicContact CD1-CG2 3.77Å; L494-V512 HydrophobicContact CD2-CG2 4.41Å
495	D	97.3	Very high	96.4	Very high	4 Å²	4	52 Å²	52	2%	0.021	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-69.1	133.7	179.9	-55.7	-40.3	0	0	0	110.5	I337 P338 S339 F440 H441 A497	I337-D495 HydrophobicContact CG2-CB 4.42Å; I337-D495 WeakPolarHBondContact CG2-OD1 3.22Å; P338-D495 WeakPolarHBondContact CD-OD1 3.3Å; S339-D495 WeakPolarHBondContact CB-OD2 3.29Å; S339-D495 PolarHBondContact N-OD1 3.28Å; S339-D495 VanDerWaalsContact OG-CG 3.31Å; S339-D495 PolarHBondContact OG-OD1 3.49Å; S339-D495 PolarHBondContact OG-OD2 3.19Å; F440-D495 CarbonylContact C-O 3.52Å; F440-D495 VanDerWaalsContact CA-O 3.25Å; F440-D495 WeakPolarHBondContact CA-O 3.31Å; F440-D495 WeakPolarHBondContact CB-O 3.33Å; H441-D495 WeakPolarHBondContact CE1-CB 3.3Å; H441-D495 PolarHBondContact N-O 2.66Å; H441-D495 VanDerWaalsContact ND1-CB 3.32Å; H441-D495 WeakPolarHBondContact ND1-CB 3.33Å; H441-D495 PolarHBondContact ND1-O 2.83Å; H441-D495 VanDerWaalsContact ND1-O 3.15Å; H441-D495 WeakPolarHBondContact O-CA 3.32Å; H441-D495 WeakPolarHBondContact O-CB 3.08Å; H441-D495 PolarHBondContact O-N 2.98Å; D495-A497 VanDerWaalsContact C-N 3.29Å; D495-A497 PolarHBondContact O-N 2.76Å
496	K	97.1	Very high	96.6	Very high	80 Å²	80	51 Å²	51	35%	0.348	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	-50.9	-164	-163.5	176.3	-179.1	177.8	0	114.4	K438 N498 K499	K438-K496 HydrophobicContact CG-CD 4.42Å; K438-K496 WeakPolarHBondContact O-CD 3.39Å; K438-K496 WeakPolarHBondContact O-CE 3.47Å; K438-K496 PolarHBondContact O-NZ 2.92Å; K496-N498 VanDerWaalsContact C-N 3.29Å; K496-N498 PolarHBondContact O-N 3.28Å; K496-K499 VanDerWaalsContact O-CB 3.3Å; K496-K499 WeakPolarHBondContact O-CB 3.12Å; K496-K499 PolarHBondContact O-N 2.71Å
497	A	97.2	Very high	96.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-61.1	-34.3	-179.5	0	0	0	0	0	113.5	F440 K491 L494 D495 K499 D500 F506	F440-A497 HydrophobicContact CB-CB 3.74Å; F440-A497 HydrophobicContact CG-CB 4.38Å; K491-A497 WeakPolarHBondContact CE-O 3.44Å; L494-A497 HydrophobicContact CB-CB 3.89Å; L494-A497 PolarHBondContact O-N 2.84Å; D495-A497 VanDerWaalsContact C-N 3.29Å; D495-A497 PolarHBondContact O-N 2.76Å; A497-K499 PolarHBondContact O-N 3.14Å; A497-K499 VanDerWaalsContact O-N 3.12Å; A497-D500 PolarHBondContact O-N 2.83Å; A497-D500 VanDerWaalsContact O-N 3.11Å; A497-F506 HydrophobicContact CB-CD1 4.49Å; A497-F506 HydrophobicContact CB-CD2 3.83Å; A497-F506 HydrophobicContact CB-CE1 4.33Å; A497-F506 HydrophobicContact CB-CE2 3.65Å; A497-F506 HydrophobicContact CB-CG 4.26Å; A497-F506 HydrophobicContact CB-CZ 3.91Å
498	N	95.2	Very high	96.8	Very high	26 Å²	26	56.1 Å²	56.1	14%	0.139	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-59.2	-22.7	174.2	74.6	81.9	0	0	0	114	P338 K491 N492 L494 K496 K501	P338-N498 VanDerWaalsContact CD-ND2 3.27Å; P338-N498 WeakPolarHBondContact CD-ND2 3.43Å; P338-N498 HydrophobicContact CG-CB 4.02Å; P338-N498 VanDerWaalsContact CG-ND2 3.34Å; P338-N498 WeakPolarHBondContact CG-ND2 3.23Å; K491-N498 VanDerWaalsContact O-CA 3.3Å; K491-N498 WeakPolarHBondContact O-CA 3.47Å; K491-N498 PolarHBondContact O-N 3.26Å; N492-N498 WeakPolarHBondContact O-CB 3.15Å; L494-N498 WeakPolarHBondContact O-CB 3.34Å; L494-N498 PolarHBondContact O-N 3.19Å; L494-N498 PolarHBondContact O-ND2 3.2Å; K496-N498 VanDerWaalsContact C-N 3.29Å; K496-N498 PolarHBondContact O-N 3.28Å; N498-K501 WeakPolarHBondContact O-CD 3.39Å; N498-K501 WeakPolarHBondContact O-CE 3.32Å; N498-K501 PolarHBondContact O-NZ 3.01Å
499	K	95.2	Very high	96.7	Very high	139 Å²	139	60.7 Å²	60.7	60%	0.604	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-77.3	-19.7	179.3	-59	-176.4	178.9	-178.6	0	112.9	K496 A497 K501	K496-K499 VanDerWaalsContact O-CB 3.3Å; K496-K499 WeakPolarHBondContact O-CB 3.12Å; K496-K499 PolarHBondContact O-N 2.71Å; A497-K499 PolarHBondContact O-N 3.14Å; A497-K499 VanDerWaalsContact O-N 3.12Å; K499-K501 PolarHBondContact O-N 3.11Å
500	D	96.3	Very high	96.8	Very high	18 Å²	18	60.7 Å²	60.7	10%	0.096	30%	0.303	C	S	.	.			trans	-75.3	64.9	-178.8	176.4	34.6	0	0	0	111.6	K491 A497 A502 N503 R504 Y505 F506	K491-D500 VanDerWaalsContact CE-O 3.3Å; K491-D500 WeakPolarHBondContact CE-O 3.41Å; K491-D500 PolarHBondContact NZ-O 3.12Å; K491-D500 IonicContact NZ-OD2 3.03Å; K491-D500 PolarHBondContact NZ-OD2 3.08Å; A497-D500 PolarHBondContact O-N 2.83Å; A497-D500 VanDerWaalsContact O-N 3.11Å; D500-A502 PolarHBondContact O-N 2.99Å; D500-N503 PolarHBondContact O-N 2.78Å; D500-N503 VanDerWaalsContact O-N 3.12Å; D500-N503 PolarHBondContact OD1-N 2.82Å; D500-N503 WeakPolarHBondContact OD2-CA 3.32Å; D500-R504 PolarHBondContact OD1-N 3.37Å; D500-R504 PolarHBondContact OD2-N 3.31Å; D500-Y505 PolarHBondContact OD2-N 2.92Å; D500-F506 HydrophobicContact CB-CD2 4.28Å; D500-F506 PolarHBondContact OD2-N 3.14Å
501	K	95.4	Very high	96.7	Very high	139 Å²	139	61.5 Å²	61.5	60%	0.604	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-19.7	-179	-60	-48.1	-168.4	-163.9	0	113.4	N492 N498 K499 N503	N492-K501 PolarHBondContact OD1-NZ 3.45Å; N498-K501 WeakPolarHBondContact O-CD 3.39Å; N498-K501 WeakPolarHBondContact O-CE 3.32Å; N498-K501 PolarHBondContact O-NZ 3.01Å; K499-K501 PolarHBondContact O-N 3.11Å; K501-N503 VanDerWaalsContact C-N 3.31Å
502	A	97	Very high	96.7	Very high	70 Å²	70	61 Å²	61	58%	0.579	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-2.7	173.6	0	0	0	0	0	113.8	D500 R504	D500-A502 PolarHBondContact O-N 2.99Å; A502-R504 HydrophobicContact CB-CG 3.95Å; A502-R504 PolarHBondContact O-N 3.21Å
503	N	96.5	Very high	96.8	Very high	61 Å²	61	58.2 Å²	58.2	33%	0.326	28%	0.284	S	S	.	.			trans	55.3	31.1	-178	-53	-59.5	0	0	0	114.4	M374 K491 D500 K501 F506	M374-N503 WeakPolarHBondContact CE-O 3.25Å; K491-N503 PolarHBondContact NZ-OD1 2.88Å; D500-N503 PolarHBondContact O-N 2.78Å; D500-N503 VanDerWaalsContact O-N 3.12Å; D500-N503 PolarHBondContact OD1-N 2.82Å; D500-N503 WeakPolarHBondContact OD2-CA 3.32Å; K501-N503 VanDerWaalsContact C-N 3.31Å; N503-F506 WeakPolarHBondContact CA-O 3.46Å; N503-F506 WeakPolarHBondContact CB-O 3.44Å
504	R	96.4	Very high	96.8	Very high	190 Å²	190	56.3 Å²	56.3	72%	0.717	27%	0.274	S	S	*	.	S	Bend	trans	-70.9	-33	-178.7	-70.2	-178.9	179.8	-178.5	1.2	112.3	D500 A502	D500-R504 PolarHBondContact OD1-N 3.37Å; D500-R504 PolarHBondContact OD2-N 3.31Å; A502-R504 HydrophobicContact CB-CG 3.95Å; A502-R504 PolarHBondContact O-N 3.21Å
505	Y	97.2	Very high	96.7	Very high	113 Å²	113	57.2 Å²	57.2	44%	0.443	28%	0.277	S	S	.	.	S	Bend	trans	-113.2	-28.1	-174.4	-65.5	-72.8	0	0	0	113.2	P373 M374 F375 D500	P373-Y505 CarbonylContact C-O 3.45Å; P373-Y505 WeakPolarHBondContact CA-O 3.39Å; M374-Y505 PolarHBondContact N-O 2.98Å; F375-Y505 HydrophobicContact CD1-CD1 4.01Å; F375-Y505 HydrophobicContact CD1-CE1 4.33Å; F375-Y505 HydrophobicContact CD2-CD1 4.28Å; F375-Y505 AromaticContact CE1-CD1 3.93Å; F375-Y505 HydrophobicContact CE1-CD1 3.93Å; F375-Y505 HydrophobicContact CE1-CE1 4.38Å; F375-Y505 HydrophobicContact CE1-CG 4.43Å; F375-Y505 HydrophobicContact CE2-CD1 4.2Å; F375-Y505 HydrophobicContact CE2-CG 4.4Å; F375-Y505 HydrophobicContact CG-CD1 4.17Å; F375-Y505 HydrophobicContact CZ-CD1 4.01Å; F375-Y505 HydrophobicContact CZ-CG 4.15Å; D500-Y505 PolarHBondContact OD2-N 2.92Å
506	F	97.9	Very high	96.7	Very high	5 Å²	5	57 Å²	57	2%	0.022	28%	0.277	C	S	.	.	S	Bend	trans	-134.3	135.1	-178.7	-54.5	-87.9	0	0	0	110.4	P373 F375 M439 F440 K491 A497 D500 N503 F510	P373-F506 HydrophobicContact CB-CD1 3.98Å; P373-F506 HydrophobicContact CB-CE1 3.91Å; P373-F506 HydrophobicContact CG-CD1 4.1Å; P373-F506 HydrophobicContact CG-CE1 4.04Å; F375-F506 AromaticContact CE2-CE1 3.96Å; F375-F506 HydrophobicContact CE2-CE1 3.96Å; F375-F506 AromaticContact CE2-CE2 4Å; F375-F506 HydrophobicContact CE2-CE2 4Å; F375-F506 AromaticContact CE2-CZ 3.55Å; F375-F506 HydrophobicContact CE2-CZ 3.55Å; F375-F506 HydrophobicContact CZ-CE1 4.49Å; F375-F506 AromaticContact CZ-CE2 3.91Å; F375-F506 HydrophobicContact CZ-CE2 3.91Å; F375-F506 AromaticContact CZ-CZ 3.65Å; F375-F506 HydrophobicContact CZ-CZ 3.65Å; M439-F506 HydrophobicContact CB-CZ 4.17Å; F440-F506 HydrophobicContact CB-CZ 4.37Å; F440-F506 AromaticContact CD1-CE1 3.63Å; F440-F506 HydrophobicContact CD1-CE1 3.63Å; F440-F506 AromaticContact CD1-CZ 3.78Å; F440-F506 HydrophobicContact CD1-CZ 3.78Å; F440-F506 HydrophobicContact CE1-CE1 4.1Å; K491-F506 HydrophobicContact CD-CB 3.83Å; K491-F506 HydrophobicContact CG-CB 4.45Å; K491-F506 PolarHBondContact NZ-O 3.37Å; A497-F506 HydrophobicContact CB-CD1 4.49Å; A497-F506 HydrophobicContact CB-CD2 3.83Å; A497-F506 HydrophobicContact CB-CE1 4.33Å; A497-F506 HydrophobicContact CB-CE2 3.65Å; A497-F506 HydrophobicContact CB-CG 4.26Å; A497-F506 HydrophobicContact CB-CZ 3.91Å; D500-F506 HydrophobicContact CB-CD2 4.28Å; D500-F506 PolarHBondContact OD2-N 3.14Å; N503-F506 WeakPolarHBondContact CA-O 3.46Å; N503-F506 WeakPolarHBondContact CB-O 3.44Å; F506-F510 HydrophobicContact CB-CB 4.16Å; F506-F510 HydrophobicContact CB-CD1 4.3Å; F506-F510 HydrophobicContact CB-CG 4.29Å; F506-F510 AromaticContact CD1-CD1 3.63Å; F506-F510 HydrophobicContact CD1-CD1 3.63Å; F506-F510 HydrophobicContact CD1-CD2 4.39Å; F506-F510 AromaticContact CD1-CE1 3.62Å; F506-F510 HydrophobicContact CD1-CE1 3.62Å; F506-F510 HydrophobicContact CD1-CE2 4.39Å; F506-F510 HydrophobicContact CD1-CG 4.03Å; F506-F510 HydrophobicContact CD1-CZ 4.03Å; F506-F510 HydrophobicContact CE1-CD1 4.35Å; F506-F510 AromaticContact CE1-CE1 3.9Å; F506-F510 HydrophobicContact CE1-CE1 3.9Å; F506-F510 HydrophobicContact CE1-CZ 4.19Å; F506-F510 HydrophobicContact CG-CD1 4.27Å
507	S	96.9	Very high	96.6	Very high	34 Å²	34	54.6 Å²	54.6	24%	0.238	27%	0.268	C	S	.	.			trans	-50.7	145.2	166.5	177.5	0	0	0	0	111	T371 K491 N509 F510	T371-S507 WeakPolarHBondContact OG1-CB 3.32Å; K491-S507 VanDerWaalsContact CD-O 3.29Å; K491-S507 WeakPolarHBondContact CD-O 3.46Å; S507-N509 PolarHBondContact O-N 2.79Å; S507-N509 PolarHBondContact OG-N 3.48Å; S507-F510 VanDerWaalsContact O-CB 3.22Å; S507-F510 WeakPolarHBondContact O-CB 3.36Å; S507-F510 PolarHBondContact O-N 2.86Å
508	P	96.4	Very high	96.3	Very high	82 Å²	82	58.7 Å²	58.7	53%	0.532	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.2	170.7	25.2	-34.7	0	0	0	112.1	F510	P508-F510 VanDerWaalsContact C-N 3.33Å
509	N	95.5	Very high	95.8	Very high	118 Å²	118	60.7 Å²	60.7	63%	0.631	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	12.7	178.9	-60.4	-3.9	0	0	0	113	S507 K511	S507-N509 PolarHBondContact O-N 2.79Å; S507-N509 PolarHBondContact OG-N 3.48Å; N509-K511 PolarHBondContact O-N 3.03Å
510	F	97.9	Very high	94.7	Very high	1 Å²	1	58.3 Å²	58.3	0%	0.004	30%	0.296	C	S	.	.			trans	-64	125	177.1	178.5	-110.5	0	0	0	110.5	F369 T371 P373 F440 T490 K491 L494 F506 S507 P508 V512	F369-F510 HydrophobicContact CB-CE2 3.88Å; F369-F510 HydrophobicContact CD1-CE2 4.26Å; F369-F510 HydrophobicContact CD1-CZ 4.11Å; F369-F510 AromaticContact CD2-CE2 3.74Å; F369-F510 HydrophobicContact CD2-CE2 3.74Å; F369-F510 AromaticContact CD2-CZ 3.99Å; F369-F510 HydrophobicContact CD2-CZ 3.99Å; F369-F510 HydrophobicContact CE1-CZ 4.26Å; F369-F510 HydrophobicContact CE2-CE2 4.3Å; F369-F510 HydrophobicContact CE2-CZ 4.13Å; F369-F510 AromaticContact CG-CE2 3.7Å; F369-F510 HydrophobicContact CG-CE2 3.7Å; F369-F510 AromaticContact CG-CZ 3.98Å; F369-F510 HydrophobicContact CG-CZ 3.98Å; F369-F510 HydrophobicContact CZ-CZ 4.25Å; T371-F510 VanDerWaalsContact O-CD2 3.24Å; T371-F510 WeakPolarHBondContact O-CD2 3.39Å; T371-F510 WeakPolarHBondContact O-CE2 3.36Å; P373-F510 HydrophobicContact CG-CD2 4.45Å; P373-F510 HydrophobicContact CG-CE2 3.71Å; P373-F510 HydrophobicContact CG-CZ 4.03Å; F440-F510 HydrophobicContact CD1-CE1 4.33Å; F440-F510 AromaticContact CE1-CE1 3.91Å; F440-F510 HydrophobicContact CE1-CE1 3.91Å; F440-F510 AromaticContact CE1-CZ 3.76Å; F440-F510 HydrophobicContact CE1-CZ 3.76Å; F440-F510 HydrophobicContact CZ-CE1 4.2Å; F440-F510 HydrophobicContact CZ-CZ 4.06Å; T490-F510 CarbonylContact C-O 3.49Å; K491-F510 HydrophobicContact CB-CB 4.32Å; K491-F510 PolarHBondContact N-O 2.84Å; L494-F510 HydrophobicContact CD1-CD1 3.91Å; L494-F510 HydrophobicContact CD1-CE1 3.55Å; F506-F510 HydrophobicContact CB-CB 4.16Å; F506-F510 HydrophobicContact CB-CD1 4.3Å; F506-F510 HydrophobicContact CB-CG 4.29Å; F506-F510 AromaticContact CD1-CD1 3.63Å; F506-F510 HydrophobicContact CD1-CD1 3.63Å; F506-F510 HydrophobicContact CD1-CD2 4.39Å; F506-F510 AromaticContact CD1-CE1 3.62Å; F506-F510 HydrophobicContact CD1-CE1 3.62Å; F506-F510 HydrophobicContact CD1-CE2 4.39Å; F506-F510 HydrophobicContact CD1-CG 4.03Å; F506-F510 HydrophobicContact CD1-CZ 4.03Å; F506-F510 HydrophobicContact CE1-CD1 4.35Å; F506-F510 AromaticContact CE1-CE1 3.9Å; F506-F510 HydrophobicContact CE1-CE1 3.9Å; F506-F510 HydrophobicContact CE1-CZ 4.19Å; F506-F510 HydrophobicContact CG-CD1 4.27Å; S507-F510 VanDerWaalsContact O-CB 3.22Å; S507-F510 WeakPolarHBondContact O-CB 3.36Å; S507-F510 PolarHBondContact O-N 2.86Å; P508-F510 VanDerWaalsContact C-N 3.33Å; F510-V512 HydrophobicContact CE1-CG2 3.85Å; F510-V512 HydrophobicContact CZ-CG2 3.77Å
511	K	97	Very high	92.7	Very high	66 Å²	66	66.5 Å²	66.5	29%	0.287	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	156.2	169.7	-46.6	-159.2	-154.7	85.3	0	111.3	F369 E370 T488 L489 T490 N509	F369-K511 WeakPolarHBondContact CA-O 3.33Å; E370-K511 HydrophobicContact CB-CB 4.42Å; E370-K511 HydrophobicContact CG-CB 4.11Å; E370-K511 PolarHBondContact N-O 3.36Å; E370-K511 VanDerWaalsContact N-O 3.08Å; E370-K511 WeakPolarHBondContact OE1-CD 3.24Å; E370-K511 IonicContact OE1-NZ 3.14Å; E370-K511 PolarHBondContact OE1-NZ 3.02Å; E370-K511 IonicContact OE2-NZ 2.76Å; E370-K511 PolarHBondContact OE2-NZ 3.42Å; T488-K511 HydrophobicContact CG2-CB 4.29Å; T488-K511 HydrophobicContact CG2-CD 3.53Å; L489-K511 CarbonylContact O-C 3.52Å; L489-K511 VanDerWaalsContact O-CA 3.26Å; L489-K511 WeakPolarHBondContact O-CA 3.34Å; T490-K511 HydrophobicContact CG2-CD 4.4Å; N509-K511 PolarHBondContact O-N 3.03Å
512	V	97.9	Very high	90.2	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112	170.5	-177.2	0	0	0	0	108.2	M367 M368 F369 F440 F442 L489 L494 F510 L514	M367-V512 HydrophobicContact CG-CG1 4.38Å; M368-V512 CarbonylContact O-C 3.56Å; M368-V512 WeakPolarHBondContact O-CA 3.49Å; F369-V512 HydrophobicContact CD1-CB 4.38Å; F369-V512 HydrophobicContact CD1-CG1 4.16Å; F369-V512 HydrophobicContact CD1-CG2 3.74Å; F369-V512 HydrophobicContact CE1-CG1 4.09Å; F369-V512 HydrophobicContact CE1-CG2 3.74Å; F440-V512 HydrophobicContact CE2-CG2 3.96Å; F440-V512 HydrophobicContact CZ-CG2 3.72Å; F442-V512 HydrophobicContact CE1-CG1 4.47Å; L489-V512 PolarHBondContact N-O 2.79Å; L489-V512 PolarHBondContact O-N 2.94Å; L494-V512 HydrophobicContact CD1-CG2 3.77Å; L494-V512 HydrophobicContact CD2-CG2 4.41Å; F510-V512 HydrophobicContact CE1-CG2 3.85Å; F510-V512 HydrophobicContact CZ-CG2 3.77Å; V512-L514 HydrophobicContact CG1-CD2 4.43Å
513	K	97.1	Very high	87.4	Confident	36 Å²	36	68.8 Å²	68.8	16%	0.157	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	141.1	169.6	-68.1	-164.7	172.1	-172.6	0	110.5	M367 M368 E476 V486 T488 Y515	M367-K513 CarbonylContact C-O 3.6Å; M367-K513 VanDerWaalsContact CA-O 3.26Å; M367-K513 WeakPolarHBondContact CA-O 3.33Å; M368-K513 HydrophobicContact CB-CB 4.44Å; M368-K513 HydrophobicContact CE-CB 4.49Å; M368-K513 HydrophobicContact CE-CD 3.95Å; M368-K513 HydrophobicContact CE-CG 4.22Å; M368-K513 PolarHBondContact N-O 2.82Å; M368-K513 PolarHBondContact O-N 3.22Å; E476-K513 IonicContact OE1-NZ 3.28Å; E476-K513 PolarHBondContact OE1-NZ 3.4Å; V486-K513 HydrophobicContact CG1-CB 4.1Å; V486-K513 HydrophobicContact CG1-CD 4.08Å; V486-K513 HydrophobicContact CG1-CG 4.35Å; T488-K513 HydrophobicContact CG2-CG 4.03Å; K513-Y515 HydrophobicContact CB-CD2 4.39Å; K513-Y515 HydrophobicContact CB-CE2 3.59Å; K513-Y515 HydrophobicContact CD-CE2 4.48Å; K513-Y515 WeakPolarHBondContact CD-OH 3.38Å
514	L	97.7	Very high	84.5	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	118.7	-175.2	-61.9	157.3	0	0	0	108.6	F364 M367 F442 V486 L487 L489 V512 F516	F364-L514 HydrophobicContact CE2-CB 4.28Å; F364-L514 HydrophobicContact CE2-CD2 3.87Å; F364-L514 HydrophobicContact CZ-CD2 3.57Å; M367-L514 HydrophobicContact CG-CD2 3.37Å; M367-L514 HydrophobicContact CG-CG 4.45Å; M367-L514 HydrophobicContact SD-CD2 3.74Å; F442-L514 HydrophobicContact CE2-CD1 3.79Å; F442-L514 HydrophobicContact CE2-CD2 3.93Å; F442-L514 HydrophobicContact CZ-CD1 4.01Å; F442-L514 HydrophobicContact CZ-CD2 3.52Å; F442-L514 HydrophobicContact CZ-CG 4.33Å; V486-L514 VanDerWaalsContact CA-O 3.32Å; V486-L514 WeakPolarHBondContact CA-O 3.49Å; L487-L514 HydrophobicContact CB-CB 4.22Å; L487-L514 HydrophobicContact CB-CD1 4.23Å; L487-L514 HydrophobicContact CD2-CD1 3.8Å; L487-L514 HydrophobicContact CG-CD1 4.11Å; L487-L514 PolarHBondContact N-O 3.23Å; L487-L514 WeakPolarHBondContact O-CB 3.47Å; L487-L514 PolarHBondContact O-N 2.99Å; L489-L514 HydrophobicContact CD1-CD1 3.83Å; L489-L514 HydrophobicContact CG-CD1 3.98Å; V512-L514 HydrophobicContact CG1-CD2 4.43Å; L514-F516 HydrophobicContact CB-CD2 4.37Å; L514-F516 HydrophobicContact CB-CE2 3.46Å; L514-F516 VanDerWaalsContact CB-CE2 3.46Å; L514-F516 HydrophobicContact CB-CZ 3.98Å
515	Y	96.4	Very high	81.4	Confident	19 Å²	19	68.3 Å²	68.3	8%	0.075	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.6	-170.2	-71.2	-96.3	0	0	0	112	H365 K366 M368 E476 Y484 V486 K513	H365-Y515 PolarHBondContact N-O 2.68Å; K366-Y515 HydrophobicContact CG-CD2 3.75Å; K366-Y515 HydrophobicContact CG-CG 3.84Å; K366-Y515 PolarHBondContact O-N 3.03Å; M368-Y515 HydrophobicContact CB-CE2 4.17Å; E476-Y515 WeakPolarHBondContact OE2-CE1 3.34Å; E476-Y515 VanDerWaalsContact OE2-CZ 3.29Å; E476-Y515 PolarHBondContact OE2-OH 2.8Å; Y484-Y515 HydrophobicContact CD1-CD1 4.37Å; Y484-Y515 HydrophobicContact CD2-CD1 4.13Å; Y484-Y515 AromaticContact CG-CD1 3.87Å; Y484-Y515 HydrophobicContact CG-CD1 3.87Å; V486-Y515 HydrophobicContact CB-CE1 4.43Å; V486-Y515 HydrophobicContact CG1-CD1 4.41Å; V486-Y515 HydrophobicContact CG1-CE1 4.03Å; V486-Y515 HydrophobicContact CG1-CE2 4.36Å; V486-Y515 HydrophobicContact CG2-CD1 3.53Å; V486-Y515 HydrophobicContact CG2-CE1 3.46Å; V486-Y515 VanDerWaalsContact CG2-CE1 3.46Å; V486-Y515 HydrophobicContact CG2-CG 4.35Å; K513-Y515 HydrophobicContact CB-CD2 4.39Å; K513-Y515 HydrophobicContact CB-CE2 3.59Å; K513-Y515 HydrophobicContact CD-CE2 4.48Å; K513-Y515 WeakPolarHBondContact CD-OH 3.38Å
516	F	96	Very high	78.9	Confident	1 Å²	1	69.1 Å²	69.1	0%	0.004	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	161.5	-178.1	-52.6	-94.9	0	0	0	112.8	L362 L363 F364 V418 I422 I449 Y484 L485 L487 L514	L362-F516 HydrophobicContact CB-CB 4.41Å; L362-F516 HydrophobicContact CB-CD1 4.26Å; L362-F516 HydrophobicContact CD1-CB 4.19Å; L362-F516 HydrophobicContact CD1-CD1 4.24Å; L362-F516 HydrophobicContact CD1-CG 4.26Å; L363-F516 CarbonylContact O-C 3.2Å; L363-F516 WeakPolarHBondContact O-CA 3.22Å; F364-F516 HydrophobicContact CB-CD1 3.68Å; F364-F516 HydrophobicContact CB-CE1 3.66Å; F364-F516 AromaticContact CD1-CE1 4Å; F364-F516 HydrophobicContact CD1-CE1 4Å; F364-F516 AromaticContact CD2-CD1 3.77Å; F364-F516 HydrophobicContact CD2-CD1 3.77Å; F364-F516 AromaticContact CD2-CE1 3.38Å; F364-F516 HydrophobicContact CD2-CE1 3.38Å; F364-F516 HydrophobicContact CD2-CE2 4.43Å; F364-F516 HydrophobicContact CD2-CG 4.42Å; F364-F516 AromaticContact CD2-CZ 3.76Å; F364-F516 HydrophobicContact CD2-CZ 3.76Å; F364-F516 AromaticContact CE2-CE1 3.97Å; F364-F516 HydrophobicContact CE2-CE1 3.97Å; F364-F516 HydrophobicContact CE2-CE2 4.48Å; F364-F516 AromaticContact CE2-CZ 3.88Å; F364-F516 HydrophobicContact CE2-CZ 3.88Å; F364-F516 AromaticContact CG-CD1 3.87Å; F364-F516 HydrophobicContact CG-CD1 3.87Å; F364-F516 AromaticContact CG-CE1 3.41Å; F364-F516 HydrophobicContact CG-CE1 3.41Å; F364-F516 VanDerWaalsContact CG-CE1 3.41Å; F364-F516 HydrophobicContact CG-CZ 4.15Å; F364-F516 HydrophobicContact CZ-CE1 4.5Å; F364-F516 HydrophobicContact CZ-CZ 4.34Å; V418-F516 HydrophobicContact CG2-CD1 4.21Å; V418-F516 HydrophobicContact CG2-CE1 4.08Å; I422-F516 HydrophobicContact CD1-CE1 4.34Å; I422-F516 HydrophobicContact CD1-CZ 4.49Å; I449-F516 HydrophobicContact CD1-CD2 4.21Å; I449-F516 HydrophobicContact CD1-CE1 4.23Å; I449-F516 HydrophobicContact CD1-CE2 3.67Å; I449-F516 HydrophobicContact CD1-CZ 3.69Å; I449-F516 HydrophobicContact CG2-CB 4.35Å; I449-F516 HydrophobicContact CG2-CD2 3.49Å; I449-F516 VanDerWaalsContact CG2-CD2 3.49Å; I449-F516 HydrophobicContact CG2-CE2 3.9Å; I449-F516 HydrophobicContact CG2-CG 4.04Å; Y484-F516 WeakPolarHBondContact CA-O 3.48Å; L485-F516 HydrophobicContact CB-CB 4.36Å; L485-F516 PolarHBondContact N-O 3.18Å; L485-F516 PolarHBondContact O-N 2.85Å; L487-F516 HydrophobicContact CB-CE2 4.47Å; L514-F516 HydrophobicContact CB-CD2 4.37Å; L514-F516 HydrophobicContact CB-CE2 3.46Å; L514-F516 VanDerWaalsContact CB-CE2 3.46Å; L514-F516 HydrophobicContact CB-CZ 3.98Å
517	T	94.6	Very high	75.9	Confident	29 Å²	29	76.6 Å²	76.6	18%	0.178	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159.3	160.2	63.6	0	0	0	0	109.7	L362 L363 H365 Y484	L362-T517 WeakPolarHBondContact CA-O 3.32Å; L363-T517 PolarHBondContact N-O 3.42Å; L363-T517 PolarHBondContact O-N 2.7Å; H365-T517 WeakPolarHBondContact NE2-CG2 3.42Å; H365-T517 PolarHBondContact NE2-OG1 2.85Å; Y484-T517 HydrophobicContact CD1-CG2 3.95Å; Y484-T517 HydrophobicContact CE1-CG2 4.21Å
518	K	91.8	Very high	73	Confident	86 Å²	86	79.5 Å²	79.5	37%	0.374	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	152.9	165.3	-63.6	-177.8	178.6	-178.9	0	109.9	E453 L485 V520	E453-K518 IonicContact OE1-NZ 3.26Å; E453-K518 PolarHBondContact OE1-NZ 2.9Å; L485-K518 HydrophobicContact CD1-CG 4.39Å; K518-V520 VanDerWaalsContact C-N 3.34Å; K518-V520 WeakPolarHBondContact CB-O 3.47Å
519	T	85.7	Confident	70	Confident	68 Å²	68	81.9 Å²	81.9	42%	0.417	47%	0.466	S	S	.	.	S	Bend	trans	-82.1	-13.9	170.1	50.3	0	0	0	0	113.4	A361 L363	A361-T519 HydrophobicContact CB-CG2 3.93Å; A361-T519 PolarHBondContact O-OG1 3.18Å; L363-T519 HydrophobicContact CD2-CG2 4Å; L363-T519 HydrophobicContact CG-CG2 3.97Å
520	V	71.3	Confident	67.1	Low	89 Å²	89	81.3 Å²	81.3	54%	0.539	47%	0.471	S	S	.	.	S	Bend	trans	-133.3	131.4	-180	-166.3	0	0	0	0	108.3	K518 E522	K518-V520 VanDerWaalsContact C-N 3.34Å; K518-V520 WeakPolarHBondContact CB-O 3.47Å; V520-E522 PolarHBondContact O-N 2.76Å
521	E	53.2	Low	64.1	Low	189 Å²	189	86.1 Å²	86.1	88%	0.883	51%	0.505	S	S	*	.			trans	-78.4	105.5	156.7	-70.2	173.8	-171.5	0	0	106.4	P523	E521-P523 WeakPolarHBondContact O-CD 3.33Å
522	E	43.8	Very low	60.9	Low	140 Å²	140	89.4 Å²	89.4	65%	0.654	53%	0.531	S	S	*	.			trans	-68.3	120.2	172.2	-73	-170.2	175.7	0	0	108.2	V520 S524	V520-E522 PolarHBondContact O-N 2.76Å; E522-S524 PolarHBondContact O-N 2.74Å
523	P	37.3	Very low	57.8	Low	117 Å²	117	95.1 Å²	95.1	76%	0.76	57%	0.571	S	S	*	*			trans	-68.8	126	-178.7	27.8	-33.6	0	0	0	109.7	E521 N525	E521-P523 WeakPolarHBondContact O-CD 3.33Å; P523-N525 PolarHBondContact O-N 3.12Å
524	S	37.3	Very low	54.7	Low	131 Å²	131	99.6 Å²	99.6	92%	0.916	60%	0.6	S	S	*	*	S	Bend	trans	-77.8	52.7	-171.8	46.6	0	0	0	0	114.2	E522	E522-S524 PolarHBondContact O-N 2.74Å
525	N	30.7	Very low	51.6	Low	110 Å²	110	105.6 Å²	105.6	59%	0.588	64%	0.637	S	S	*	*			trans	-153.4	120	165.5	-163.8	32.6	0	0	0	113.1	P523 E527	P523-N525 PolarHBondContact O-N 3.12Å; N525-E527 PolarHBondContact O-N 2.74Å; N525-E527 VanDerWaalsContact O-N 3.16Å
526	P	43.7	Very low	48.7	Very low	130 Å²	130	110.2 Å²	110.2	84%	0.844	67%	0.67	S	S	*	*			trans	-88.8	60.5	-179.5	37.1	-36.4	0	0	0	112.9
527	E	35.8	Very low	45.4	Very low	162 Å²	162	117.9 Å²	117.9	76%	0.757	71%	0.711	S	S	*	*			trans	-116.7	114.2	172.1	-72.1	-157	133.2	0	0	113.3	N525	N525-E527 PolarHBondContact O-N 2.74Å; N525-E527 VanDerWaalsContact O-N 3.16Å
528	A	35.7	Very low	42.4	Very low	96 Å²	96	122.4 Å²	122.4	79%	0.793	74%	0.738	S	S	*	*			trans	26.7	111	157.6	0	0	0	0	0	120.4
529	S	34.3	Very low	39.6	Very low	132 Å²	132	123.2 Å²	123.2	92%	0.923	76%	0.755	S	S	*	*				-155.5	147.1	129	-86.1	0	0	0	0	111.8
530	S	33.8	Very low	37.2	Very low	106 Å²	106	127.3 Å²	127.3	74%	0.741	77%	0.774	S	S	*	*			trans	-96.8	147.9	-173.5	56	0	0	0	0	113.5
531	S	35.4	Very low	35.3	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	79%	0.786	S	S	*	*			trans	51	113.3	148.9	62.6	0	0	0	0	119.4
532	T	29.8	Very low	34.8	Very low	135 Å²	135	130.4 Å²	130.4	83%	0.828	79%	0.787	S	S	*	*				-162.2	126.2	109.5	10.9	0	0	0	0	110.9
533	S	33.1	Very low	34.4	Very low	120 Å²	120	129.7 Å²	129.7	84%	0.839	80%	0.795	S	S	*	*			trans	-88.6	112.8	172.8	52.3	0	0	0	0	109.8
534	V	31.1	Very low	34.1	Very low	129 Å²	129	130.9 Å²	130.9	78%	0.782	80%	0.795	S	S	*	*			trans	-118.1	106.7	172.9	-175.8	0	0	0	0	108.6
535	T	33.8	Very low	33.9	Very low	126 Å²	126	133.8 Å²	133.8	77%	0.773	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-78.5	126	173.2	46.1	0	0	0	0	110
536	P	34.4	Very low	33.8	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69.5	137	164.1	30.1	-32.1	0	0	0	109.4
537	D	26.4	Very low	33.4	Very low	163 Å²	163	144.3 Å²	144.3	87%	0.872	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-72.2	149.4	-177.2	-158.9	-1.7	0	0	0	111.8
538	V	32.8	Very low	32.9	Very low	123 Å²	123	146.6 Å²	146.6	75%	0.745	81%	0.813	S	S	*	*			trans	-106.7	97.5	-176.7	-179.6	0	0	0	0	109.1	D540	V538-D540 PolarHBondContact O-N 3.31Å
539	S	32.1	Very low	32.6	Very low	104 Å²	104	145.3 Å²	145.3	73%	0.727	80%	0.798	S	S	*	*			trans	-78.4	119.6	174	52	0	0	0	0	111.6
540	D	35.1	Very low	32.4	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	79%	0.787	S	S	*	*			trans	-57	137.3	174.3	-74.7	-52.8	0	0	0	112.4	V538	V538-D540 PolarHBondContact O-N 3.31Å
541	N	32.6	Very low	32.2	Very low	149 Å²	149	145.8 Å²	145.8	80%	0.797	79%	0.786	S	S	*	*			trans	-154.4	112.1	159	-96	-66.6	0	0	0	108.9
542	E	41.1	Very low	32.1	Very low	193 Å²	193	146.1 Å²	146.1	90%	0.902	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.4	138.4	168.4	-74.4	-156.2	122.5	0	0	111
543	P	35.8	Very low	31.9	Very low	125 Å²	125	147 Å²	147	81%	0.812	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-96.1	124.3	162.6	6.6	13.2	0	0	0	111
544	D	30.4	Very low	31.8	Very low	142 Å²	142	146 Å²	146	76%	0.759	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-49.5	152.5	-178.8	-83.6	-68.6	0	0	0	116.2	Y546	D544-Y546 VanDerWaalsContact C-N 3.34Å; D544-Y546 HydrophobicContact CB-CD2 4.33Å; D544-Y546 HydrophobicContact CB-CE2 4.25Å; D544-Y546 PolarHBondContact O-N 3.22Å
545	H	33.5	Very low	31.7	Very low	193 Å²	193	146.2 Å²	146.2	89%	0.894	77%	0.774	S	S	*	*			trans	-63	78.1	174.6	-82.1	-28.6	0	0	0	114.3	R547	H545-R547 VanDerWaalsContact C-N 3.35Å; H545-R547 PolarHBondContact O-N 3.28Å
546	Y	29.3	Very low	31.7	Very low	212 Å²	212	145.3 Å²	145.3	83%	0.831	77%	0.77	S	S	*	*			trans	-76.7	83.4	168.6	-86.9	-81.9	0	0	0	112.8	D544 Y548	D544-Y546 VanDerWaalsContact C-N 3.34Å; D544-Y546 HydrophobicContact CB-CD2 4.33Å; D544-Y546 HydrophobicContact CB-CE2 4.25Å; D544-Y546 PolarHBondContact O-N 3.22Å; Y546-Y548 PolarHBondContact O-N 3.03Å; Y546-Y548 VanDerWaalsContact O-N 3.16Å
547	R	34.1	Very low	31.6	Very low	249 Å²	249	146.1 Å²	146.1	94%	0.94	76%	0.764	S	S	*	*			trans	-70.3	97.3	171	-171	-176	-159.6	147.6	4	110.6	H545	H545-R547 VanDerWaalsContact C-N 3.35Å; H545-R547 PolarHBondContact O-N 3.28Å
548	Y	27	Very low	31.9	Very low	210 Å²	210	142.6 Å²	142.6	82%	0.824	75%	0.745	S	S	*	*			trans	-109.9	158.9	171.1	-157.6	-101.9	0	0	0	113.1	Y546	Y546-Y548 PolarHBondContact O-N 3.03Å; Y546-Y548 VanDerWaalsContact O-N 3.16Å
549	S	29.1	Very low	31.9	Very low	68 Å²	68	144.6 Å²	144.6	48%	0.476	75%	0.746	S	S	.	*			trans	-72.9	136.8	-161	56.3	0	0	0	0	115	T551	S549-T551 PolarHBondContact O-N 3.35Å
550	D	29.1	Very low	31.9	Very low	129 Å²	129	144.9 Å²	144.9	69%	0.69	75%	0.746	S	S	*	*			trans	-61.1	120	162.5	-175.5	-5.8	0	0	0	110.4	T552	D550-T552 WeakPolarHBondContact OD1-CG2 3.45Å; D550-T552 PolarHBondContact OD1-N 2.88Å; D550-T552 PolarHBondContact OD1-OG1 3.02Å; D550-T552 VanDerWaalsContact OD1-OG1 3.04Å
551	T	29.8	Very low	31.6	Very low	120 Å²	120	146.5 Å²	146.5	74%	0.736	75%	0.746	S	S	*	*			trans	-134.3	65.8	165.8	62.1	0	0	0	0	109.2	S549 D553	S549-T551 PolarHBondContact O-N 3.35Å; T551-D553 PolarHBondContact O-N 2.83Å
552	T	32.9	Very low	31.4	Very low	109 Å²	109	146.8 Å²	146.8	67%	0.669	75%	0.747	S	S	*	*			trans	-63.5	80.9	162.8	39.7	0	0	0	0	111	D550 S554	D550-T552 WeakPolarHBondContact OD1-CG2 3.45Å; D550-T552 PolarHBondContact OD1-N 2.88Å; D550-T552 PolarHBondContact OD1-OG1 3.02Å; D550-T552 VanDerWaalsContact OD1-OG1 3.04Å; T552-S554 PolarHBondContact O-N 3.18Å; T552-S554 PolarHBondContact O-OG 3.38Å
553	D	26.1	Very low	31.1	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	75%	0.745	S	S	*	*			trans	-59.5	129.8	170	-161.9	1.4	0	0	0	109.2	T551 D555	T551-D553 PolarHBondContact O-N 2.83Å; D553-D555 PolarHBondContact O-N 2.96Å; D553-D555 VanDerWaalsContact O-N 3.15Å
554	S	30.8	Very low	30.9	Very low	101 Å²	101	147.8 Å²	147.8	71%	0.706	75%	0.746	S	S	*	*			trans	-96.4	65.5	-159.8	-70.5	0	0	0	0	111.3	T552 P556	T552-S554 PolarHBondContact O-N 3.18Å; T552-S554 PolarHBondContact O-OG 3.38Å; S554-P556 WeakPolarHBondContact O-CD 3.45Å; S554-P556 VanDerWaalsContact O-N 3.12Å
555	D	28.7	Very low	31.1	Very low	132 Å²	132	149.8 Å²	149.8	71%	0.706	75%	0.751	S	S	*	*			trans	-51.3	111.3	-179.1	-107.3	-23.3	0	0	0	111.9	D553 E557	D553-D555 PolarHBondContact O-N 2.96Å; D553-D555 VanDerWaalsContact O-N 3.15Å; D555-E557 PolarHBondContact O-N 3.02Å
556	P	34.8	Very low	31.1	Very low	107 Å²	107	150 Å²	150	70%	0.695	75%	0.752	S	S	*	*			trans	-99.8	54.4	-179.2	38.5	-29	0	0	0	110.2	S554 N558	S554-P556 WeakPolarHBondContact O-CD 3.45Å; S554-P556 VanDerWaalsContact O-N 3.12Å; P556-N558 PolarHBondContact O-N 3.1Å
557	E	32.3	Very low	31.3	Very low	133 Å²	133	145 Å²	145	62%	0.621	75%	0.748	S	S	*	*			trans	-66	77.7	174.1	-82.7	-162	170.8	0	0	110.5	D555	D555-E557 PolarHBondContact O-N 3.02Å
558	N	32.4	Very low	31.2	Very low	90 Å²	90	142.6 Å²	142.6	48%	0.481	75%	0.747	S	S	.	*			trans	-139.1	49.5	173.5	-166.5	51.6	0	0	0	111	R180 P556	R180-N558 PolarHBondContact NH1-OD1 3.22Å; R180-N558 PolarHBondContact NH2-OD1 2.9Å; P556-N558 PolarHBondContact O-N 3.1Å
559	E	32.4	Very low	31.4	Very low	165 Å²	165	140.3 Å²	140.3	77%	0.771	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-55.1	134.1	175.4	-65	-59.8	159.4	0	0	111.3
560	P	31.8	Very low	31.5	Very low	110 Å²	110	142.9 Å²	142.9	71%	0.714	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-69.7	173.8	165.7	32.9	-34.1	0	0	0	110.7
561	F	28.5	Very low	31.5	Very low	187 Å²	187	146.3 Å²	146.3	82%	0.82	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-95.3	133.3	176.8	-166.6	-94.7	0	0	0	109.2	E563	F561-E563 PolarHBondContact O-N 3.24Å; F561-E563 VanDerWaalsContact O-N 3.1Å
562	D	30.2	Very low	31.6	Very low	155 Å²	155	150.9 Å²	150.9	83%	0.829	80%	0.797	S	S	*	*			trans	-67.7	103.9	179.2	-64.8	-51.1	0	0	0	111.2
563	E	32.9	Very low	31.5	Very low	185 Å²	185	153 Å²	153	86%	0.864	80%	0.803	S	S	*	*			trans	-104.4	80.1	163.3	-77.7	-160.9	136.8	0	0	110.2	F561	F561-E563 PolarHBondContact O-N 3.24Å; F561-E563 VanDerWaalsContact O-N 3.1Å
564	D	32	Very low	31.8	Very low	154 Å²	154	153.1 Å²	153.1	82%	0.824	80%	0.803	S	S	*	*			trans	-140.8	67	179.2	-141.4	-12.4	0	0	0	112.4
565	Q	34.3	Very low	31.9	Very low	185 Å²	185	155.9 Å²	155.9	86%	0.864	81%	0.808	S	S	*	*			trans	-151.5	36.9	175.3	-151.9	165.6	93.3	0	0	116.6
566	H	35.4	Very low	32.1	Very low	198 Å²	198	157.4 Å²	157.4	92%	0.917	81%	0.814	S	S	*	*			trans	-142.6	60.4	172.1	-102.1	16.8	0	0	0	115.2
567	S	33.3	Very low	31.9	Very low	107 Å²	107	160.5 Å²	160.5	75%	0.748	82%	0.821	S	S	*	*			trans	-160.8	111.1	150.1	57	0	0	0	0	113.9
568	Q	32.1	Very low	31.8	Very low	198 Å²	198	162.3 Å²	162.3	93%	0.925	84%	0.835	S	S	*	*			trans	169.5	67	146.9	-97	174	68.4	0	0	114.4
569	I	30.8	Very low	31.8	Very low	162 Å²	162	167.5 Å²	167.5	83%	0.831	86%	0.86	S	S	*	*			trans	-145.1	120.5	144.4	-43.4	179	0	0	0	102.8
570	T	30.6	Very low	31.8	Very low	122 Å²	122	167.7 Å²	167.7	75%	0.748	87%	0.867	S	S	*	*			cis	-156.8	141	49.4	-46.9	0	0	0	0	111.1
571	K	28.6	Very low	31.8	Very low	201 Å²	201	172.5 Å²	172.5	87%	0.874	88%	0.879	S	S	*	*			trans	-171.2	131.8	141.2	-113.2	170.1	-174.3	177.6	0	112.5
572	V	32.4	Very low	32.1	Very low	216 Å²	216	171.2 Å²	171.2	100%	1.309	89%	0.885	S	S	*	*			trans	66.2	0	-174.6	-166.5	0	0	0	0	112.5

Retrieved 572 of 572 residues in 2059.2 ms (Link to these results)

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