A0A096NEQ7_PAPAN Loading...

M-phase inducer phosphatase

Tyrosine protein phosphatase which functions as a dosage-dependent inducer of mitotic progression.

AlphaFold DB , UniProt , Accession A0A096NEQ7, Species PAPAN (Papio anubis, Olive baboon), Gene CDC25A, Length 524 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	36.2	Very low	45.3	Very low	239 Å²	239	169.9 Å²	169.9	100%	1.177	87%	0.867	S	S	*	*				0	109.7	0	-60.1	153.8	177.9	0	0	105.6
2	E	41.1	Very low	44.7	Very low	169 Å²	169	175.6 Å²	175.6	79%	0.79	87%	0.87	S	S	*	*			cis	-141.5	139.6	-7.3	-78.2	174.3	86.8	0	0	106.8
3	L	41.4	Very low	44.2	Very low	168 Å²	168	173.8 Å²	173.8	88%	0.88	86%	0.864	S	S	*	*				41.8	124.2	105.2	-47.5	174.5	0	0	0	113.5
4	G	42.8	Very low	43.7	Very low	76 Å²	76	172.4 Å²	172.4	78%	0.784	86%	0.86	S	S	*	*			cis	148.5	179.3	8.2	0	0	0	0	0	108.3
5	P	55.3	Low	43.3	Very low	130 Å²	130	174.5 Å²	174.5	84%	0.844	86%	0.862	S	S	*	*			cis	-125.9	-175.7	-13.2	42.9	-27.1	0	0	0	114.3
6	E	43.5	Very low	42.9	Very low	174 Å²	174	169.8 Å²	169.8	81%	0.813	86%	0.859	S	S	*	*			trans	-88.5	152.2	175.8	-94.1	-93.6	129.8	0	0	114.7
7	P	59.7	Low	42.3	Very low	114 Å²	114	167.1 Å²	167.1	74%	0.74	86%	0.859	S	S	*	*			trans	-126.7	151.3	151.5	37	-24.9	0	0	0	114.6
8	P	54.7	Low	42.1	Very low	123 Å²	123	164.4 Å²	164.4	80%	0.799	86%	0.857	S	S	*	*			trans	-107.2	170.6	-145.5	40.4	-38.2	0	0	0	118.4
9	H	42.2	Very low	42.7	Very low	188 Å²	188	161.9 Å²	161.9	87%	0.87	85%	0.852	S	S	*	*			trans	-53	150.9	177.8	-56	-43.9	0	0	0	116.7
10	R	40.1	Very low	43.3	Very low	252 Å²	252	159.7 Å²	159.7	95%	0.951	85%	0.847	S	S	*	*			trans	-128.6	102.9	158.2	-127.3	-179.1	-170.5	-156.9	2.7	114.3
11	R	41.3	Very low	43.6	Very low	236 Å²	236	158.3 Å²	158.3	89%	0.891	85%	0.847	S	S	*	*			trans	-1.9	121.9	163.4	-61.8	177.6	179.4	178.8	-1.3	118.7
12	R	37.8	Very low	44.1	Very low	238 Å²	238	151.7 Å²	151.7	90%	0.898	83%	0.831	S	S	*	*			trans	-71.5	132.2	155.4	-164.1	-178.6	-162.7	174.7	5.2	109
13	L	39.2	Very low	44.4	Very low	152 Å²	152	148.8 Å²	148.8	80%	0.796	83%	0.827	S	S	*	*			trans	-106.1	143.2	170.7	-87.4	170.6	0	0	0	110.7
14	L	37.1	Very low	44.2	Very low	154 Å²	154	149.1 Å²	149.1	81%	0.806	82%	0.824	S	S	*	*			trans	-102.7	140.1	173.9	-64.5	167.9	0	0	0	108.6
15	F	37	Very low	44.6	Very low	204 Å²	204	150.3 Å²	150.3	90%	0.895	82%	0.818	S	S	*	*			trans	-126.6	139.1	159.7	-95.4	-84.6	0	0	0	108.8
16	A	37.1	Very low	43.5	Very low	99 Å²	99	150.2 Å²	150.2	82%	0.818	81%	0.814	S	S	*	*			trans	-91.7	159.5	-168.8	0	0	0	0	0	112.6
17	C	33.4	Very low	43.2	Very low	125 Å²	125	147.5 Å²	147.5	85%	0.845	81%	0.809	S	S	*	*			trans	-70.3	155.6	176.6	-57.2	0	0	0	0	112.7
18	S	38.7	Very low	42	Very low	118 Å²	118	151 Å²	151	83%	0.825	81%	0.813	S	S	*	*			trans	-148.5	149.9	153.2	-77.4	0	0	0	0	108.9
19	P	53.5	Low	41	Very low	117 Å²	117	149 Å²	149	76%	0.76	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-89.7	161.8	-159.2	35	-37.3	0	0	0	114.5
20	P	54.2	Low	40.7	Very low	118 Å²	118	147.1 Å²	147.1	77%	0.766	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.7	151	167.9	32.1	-35.2	0	0	0	111.9
21	P	50	Low	40.4	Very low	130 Å²	130	144.6 Å²	144.6	84%	0.844	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-78.3	149.7	177.9	32.4	-35.2	0	0	0	112.8
22	A	45.9	Very low	39.8	Very low	101 Å²	101	137 Å²	137	84%	0.835	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-99	143.1	176.1	0	0	0	0	0	112.2
23	P	48.7	Very low	39.7	Very low	108 Å²	108	130.3 Å²	130.3	70%	0.701	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-102.1	139.3	176.4	36.5	-31.4	0	0	0	113.1
24	Q	36.9	Very low	40.1	Very low	175 Å²	175	129.5 Å²	129.5	82%	0.818	79%	0.793	S	S	*	*			trans	-174.5	165.1	166.3	-94.7	-29.5	-76.8	0	0	110.1
25	P	51.6	Low	40	Very low	101 Å²	101	126.9 Å²	126.9	66%	0.656	79%	0.794	S	S	*	*			cis	-136.3	-169.7	-9.6	26.7	-2	0	0	0	114.9
26	V	32.2	Very low	39.9	Very low	128 Å²	128	122 Å²	122	78%	0.776	79%	0.792	S	S	*	*			trans	94.9	129.9	153.1	-177.8	0	0	0	0	119.3
27	V	36.2	Very low	39.6	Very low	116 Å²	116	121.2 Å²	121.2	70%	0.703	79%	0.793	S	S	*	*			cis	-160.3	130	-36.4	71.7	0	0	0	0	110.9
28	K	34	Very low	39.8	Very low	187 Å²	187	118.9 Å²	118.9	81%	0.813	79%	0.79	S	S	*	*			trans	155.8	144.1	149	-86.4	153.2	-178.7	169.9	0	108.4
29	A	33.6	Very low	39.8	Very low	83 Å²	83	121.8 Å²	121.8	69%	0.686	80%	0.795	S	S	*	*			cis	87.5	130.6	34.7	0	0	0	0	0	112.4
30	L	35.4	Very low	39.2	Very low	148 Å²	148	121 Å²	121	78%	0.775	79%	0.792	S	S	*	*			cis	-136	172.5	24.2	-73.7	162.9	0	0	0	114.4
31	F	34.8	Very low	38.9	Very low	198 Å²	198	121.8 Å²	121.8	87%	0.868	80%	0.797	S	S	*	*			trans	-5.3	151.3	166.9	-55.6	-73.2	0	0	0	121.2
32	G	28.5	Very low	38.9	Very low	76 Å²	76	121.4 Å²	121.4	78%	0.784	79%	0.793	S	S	*	*			cis	163.7	156.7	-0.2	0	0	0	0	0	112.3
33	A	35.5	Very low	39	Very low	98 Å²	98	122.9 Å²	122.9	81%	0.81	79%	0.791	S	S	*	*			trans	-98.8	167.6	177.2	0	0	0	0	0	112.1
34	P	47.6	Very low	38.7	Very low	135 Å²	135	125.3 Å²	125.3	88%	0.877	80%	0.798	S	S	*	*				-139.6	-176.3	93.3	38.3	-24.1	0	0	0	114.3
35	A	35.7	Very low	39.1	Very low	100 Å²	100	124.7 Å²	124.7	83%	0.826	80%	0.8	S	S	*	*			trans	-131.9	163	-171.5	0	0	0	0	0	113
36	A	35.1	Very low	38.7	Very low	102 Å²	102	126.3 Å²	126.3	84%	0.843	81%	0.808	S	S	*	*			trans	-177.2	137.8	145.8	0	0	0	0	0	112.7
37	G	31.1	Very low	39.4	Very low	82 Å²	82	126 Å²	126	85%	0.845	81%	0.806	S	S	*	*			trans	71.1	145.5	168.6	0	0	0	0	0	116
38	G	36.4	Very low	39.8	Very low	75 Å²	75	126.7 Å²	126.7	77%	0.773	81%	0.811	S	S	*	*			cis	107.3	92.7	-4.2	0	0	0	0	0	114.1
39	L	39.3	Very low	40.2	Very low	180 Å²	180	126.2 Å²	126.2	94%	0.942	81%	0.814	S	S	*	*			trans	-177.9	171.8	152.8	-100.9	167.3	0	0	0	110.5
40	S	41.4	Very low	40.7	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	82%	0.821	S	S	*	*			trans	-80.3	156.6	-164.4	-59.5	0	0	0	0	116.4	V42	S40-V42 PolarHBondContact O-N 3.29Å
41	P	46.8	Very low	41.2	Very low	135 Å²	135	131.7 Å²	131.7	88%	0.877	83%	0.826	S	S	*	*	S	Bend	trans	-84.4	76.1	-174.9	35.2	-37.2	0	0	0	113.9
42	V	50.8	Low	41.6	Very low	123 Å²	123	131 Å²	131	75%	0.745	83%	0.83	S	S	*	*			trans	-134.3	150.2	160.3	-175.7	0	0	0	0	107.9	S40	S40-V42 PolarHBondContact O-N 3.29Å
43	T	48.1	Very low	42	Very low	131 Å²	131	137.1 Å²	137.1	80%	0.804	84%	0.839	S	S	*	*			trans	66.8	86	-171	68.6	0	0	0	0	114.9
44	N	42.6	Very low	41.9	Very low	159 Å²	159	135.7 Å²	135.7	85%	0.85	83%	0.833	S	S	*	*			trans	-155.3	63.1	162.7	-126.3	-31.9	0	0	0	110.3
45	L	44	Very low	41.5	Very low	163 Å²	163	138 Å²	138	85%	0.853	84%	0.838	S	S	*	*	S	Bend	trans	-148.4	30.8	-168.7	-127.4	173.3	0	0	0	114
46	T	43.4	Very low	41.2	Very low	135 Å²	135	136.8 Å²	136.8	83%	0.828	83%	0.834	S	S	*	*	S	Bend	trans	-145.3	-1.2	-175.6	36.6	0	0	0	0	116.1
47	V	46.7	Very low	41.2	Very low	121 Å²	121	136.9 Å²	136.9	73%	0.733	83%	0.829	S	S	*	*	S	Bend	trans	-126.6	31.5	-162.9	-156.1	0	0	0	0	114.1
48	T	45.6	Very low	41.4	Very low	131 Å²	131	139 Å²	139	80%	0.804	82%	0.821	S	S	*	*	S	Bend	trans	-139.5	37.1	-177.6	62.5	0	0	0	0	114.7
49	M	41.7	Very low	41.2	Very low	177 Å²	177	145.9 Å²	145.9	87%	0.872	83%	0.825	S	S	*	*	S	Bend	trans	-134.1	1.7	179	-80.6	-86.1	64.4	0	0	116.8
50	D	44.1	Very low	40.8	Very low	156 Å²	156	146.1 Å²	146.1	83%	0.834	82%	0.821	S	S	*	*	S	Bend	trans	-130.8	42.6	-167.3	-160.2	31	0	0	0	114
51	Q	45.5	Very low	40.4	Very low	190 Å²	190	149.9 Å²	149.9	89%	0.888	83%	0.828	S	S	*	*			trans	-160.2	55.8	-179.2	-138.6	151.8	103.7	0	0	117
52	L	44.6	Very low	40.4	Very low	183 Å²	183	148.4 Å²	148.4	96%	0.958	82%	0.818	S	S	*	*			trans	-139.9	91.3	163.8	-82	-179.4	0	0	0	111.8
53	Q	36.2	Very low	39.6	Very low	204 Å²	204	149.3 Å²	149.3	95%	0.953	82%	0.818	S	S	*	*			trans	-155.1	125.8	173.1	-162.7	167.2	22.9	0	0	112.6
54	G	33.2	Very low	38.7	Very low	68 Å²	68	151.4 Å²	151.4	70%	0.701	82%	0.819	S	S	*	*			trans	115.2	149.3	164.1	0	0	0	0	0	117.1
55	L	38.6	Very low	38.3	Very low	185 Å²	185	149.7 Å²	149.7	97%	0.969	81%	0.814	S	S	*	*			trans	73.3	124.2	178.6	-49	175.4	0	0	0	116.4
56	G	31	Very low	37.8	Very low	73 Å²	73	150.6 Å²	150.6	75%	0.753	81%	0.811	S	S	*	*			cis	138.4	122.9	-22.5	0	0	0	0	0	116.3
57	S	34.1	Very low	37.4	Very low	105 Å²	105	151 Å²	151	73%	0.734	81%	0.808	S	S	*	*			trans	71.1	144.3	159	153.8	0	0	0	0	117.9
58	D	36	Very low	36.7	Very low	126 Å²	126	152.3 Å²	152.3	67%	0.674	81%	0.811	S	S	*	*			cis	-160.5	170	-10.2	-90.5	-35.5	0	0	0	112.4
59	Y	31.8	Very low	36.2	Very low	219 Å²	219	152 Å²	152	86%	0.859	81%	0.814	S	S	*	*			trans	69.2	147.2	169.5	-63.1	-77.3	0	0	0	118.5
60	E	31.6	Very low	35.7	Very low	186 Å²	186	150.8 Å²	150.8	87%	0.869	81%	0.811	S	S	*	*			cis	-137.2	171.8	7.3	-153.1	178.9	-176.4	0	0	112.6
61	Q	32.8	Very low	35.4	Very low	177 Å²	177	149.7 Å²	149.7	83%	0.827	81%	0.805	S	S	*	*			trans	-114.9	-170.4	178.6	-116.2	-167.7	0	0	0	110.3
62	P	46.3	Very low	34.8	Very low	104 Å²	104	148.7 Å²	148.7	68%	0.675	80%	0.8	S	S	*	*			cis	-127.7	-163.9	9.2	28.9	-1.6	0	0	0	112.4
63	L	33.3	Very low	34.4	Very low	143 Å²	143	150.7 Å²	150.7	75%	0.749	80%	0.795	S	S	*	*			cis	-148.1	147.2	21	-79.2	164.7	0	0	0	112
64	E	30.8	Very low	34.2	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	79%	0.793	S	S	*	*			trans	40.1	155.7	145.2	-46.1	-166.5	119.8	0	0	121.9
65	V	33.5	Very low	34.2	Very low	124 Å²	124	149.9 Å²	149.9	75%	0.752	79%	0.794	S	S	*	*			cis	-142.4	156.6	20.7	175.2	0	0	0	0	110.9
66	K	33.6	Very low	34.1	Very low	182 Å²	182	146.6 Å²	146.6	79%	0.791	79%	0.786	S	S	*	*			trans	-21.3	155.5	160.9	-66.7	165.2	178.8	164.3	0	117.2
67	N	34.4	Very low	34.5	Very low	142 Å²	142	147.7 Å²	147.7	76%	0.759	78%	0.783	S	S	*	*			cis	-162.7	171.4	37.9	-138.8	-1.3	0	0	0	114.7
68	N	32.2	Very low	34.7	Very low	150 Å²	150	151.4 Å²	151.4	80%	0.802	79%	0.788	S	S	*	*			trans	-84.9	151	179.5	-49.2	-52.6	0	0	0	114.3
69	S	35.6	Very low	34.9	Very low	124 Å²	124	149.8 Å²	149.8	87%	0.867	79%	0.786	S	S	*	*				-168.9	169.8	125.1	65.1	0	0	0	0	111.5
70	N	31.1	Very low	35.4	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	79%	0.786	S	S	*	*			trans	-144.7	162.9	-163	-126.3	-30	0	0	0	111.9
71	L	36.8	Very low	35.8	Very low	133 Å²	133	143.8 Å²	143.8	70%	0.696	78%	0.781	S	S	*	*			trans	78.4	131.1	157.2	-67.2	154.7	0	0	0	122.1
72	Q	34	Very low	36.1	Very low	169 Å²	169	140.9 Å²	140.9	79%	0.79	78%	0.78	S	S	*	*			trans	69.1	139.4	143.1	-66.4	167.1	-5.3	0	0	119.1
73	R	34.7	Very low	35.5	Very low	224 Å²	224	138.9 Å²	138.9	85%	0.845	78%	0.778	S	S	*	*			cis	112	135.8	15.4	-175.7	-167.8	-86.2	-153.6	-2.2	111.3
74	M	33.7	Very low	35.6	Very low	186 Å²	186	142 Å²	142	92%	0.916	79%	0.786	S	S	*	*			trans	77.5	147.4	-175.6	-47.1	-174.3	69.2	0	0	113.7
75	G	32	Very low	35.6	Very low	69 Å²	69	138.3 Å²	138.3	71%	0.711	78%	0.778	S	S	*	*			cis	174.9	153.2	-10.1	0	0	0	0	0	113.4
76	S	36.9	Very low	35.8	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	78%	0.781	S	S	*	*			trans	47.2	122.1	158.2	-55.6	0	0	0	0	123.6
77	S	38.8	Very low	35.5	Very low	97 Å²	97	138 Å²	138	68%	0.678	78%	0.78	S	S	*	*				69.6	141.2	128.4	-55.6	0	0	0	0	124
78	E	38.3	Very low	36	Very low	183 Å²	183	136.1 Å²	136.1	86%	0.855	78%	0.778	S	S	*	*			trans	65.2	155.9	152.7	-69.4	163.6	110.9	0	0	118.3
79	S	41.6	Very low	37	Very low	91 Å²	91	135.3 Å²	135.3	64%	0.636	78%	0.781	S	S	*	*			cis	-162	-159.9	-25.6	62.6	0	0	0	0	108.6
80	T	40.8	Very low	36.7	Very low	137 Å²	137	132.9 Å²	132.9	84%	0.84	78%	0.775	S	S	*	*			trans	68.7	168.1	179.6	70.1	0	0	0	0	117.1
81	D	39.8	Very low	37.6	Very low	143 Å²	143	131.5 Å²	131.5	77%	0.765	78%	0.775	S	S	*	*			cis	169.1	151.1	-49.1	179	33.8	0	0	0	107.8
82	S	39.8	Very low	37.6	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	79%	0.786	S	S	*	*			trans	61.9	159.3	-178.9	79.6	0	0	0	0	116.5
83	G	34.4	Very low	37.5	Very low	62 Å²	62	131.6 Å²	131.6	64%	0.639	78%	0.781	S	S	*	*			cis	165.3	134.4	-13.6	0	0	0	0	0	114.6
84	F	34.1	Very low	37.6	Very low	208 Å²	208	126.9 Å²	126.9	91%	0.912	78%	0.782	S	S	*	*			trans	71.2	143.4	155.5	-79.9	-81.6	0	0	0	123.7
85	C	32.1	Very low	37.8	Very low	96 Å²	96	126.4 Å²	126.4	65%	0.649	78%	0.775	S	S	*	*			trans	76.9	124.5	145.6	-72.7	0	0	0	0	123.2
86	L	36.6	Very low	38.1	Very low	154 Å²	154	132.6 Å²	132.6	81%	0.806	79%	0.785	S	S	*	*				46	144.5	122.2	-49.3	176.9	0	0	0	119.5
87	D	28.8	Very low	37.9	Very low	145 Å²	145	134.2 Å²	134.2	78%	0.775	79%	0.785	S	S	*	*			cis	-154.7	-176	21.1	-150.7	-13.3	0	0	0	112.7
88	S	43.1	Very low	37.9	Very low	104 Å²	104	138.1 Å²	138.1	73%	0.727	80%	0.797	S	S	*	*			trans	-137	146.1	174.9	-63.4	0	0	0	0	112.4
89	P	54.3	Low	37.6	Very low	133 Å²	133	137 Å²	137	86%	0.864	79%	0.792	S	S	*	*				-141.2	168.3	95.1	26.8	-5.8	0	0	0	112.6
90	G	29.3	Very low	37.4	Very low	72 Å²	72	138.4 Å²	138.4	74%	0.742	79%	0.792	S	S	*	*			cis	97.7	166.4	44.9	0	0	0	0	0	110.4
91	P	50.3	Low	37.5	Very low	124 Å²	124	137 Å²	137	81%	0.805	79%	0.786	S	S	*	*			cis	-132.2	-178.6	-9.6	43.4	-28.1	0	0	0	114.1
92	L	37.1	Very low	37.3	Very low	175 Å²	175	136.5 Å²	136.5	92%	0.916	78%	0.78	S	S	*	*			trans	-169	155.1	134.6	-108.9	168.7	0	0	0	112.1
93	D	31.7	Very low	37.1	Very low	128 Å²	128	140 Å²	140	68%	0.684	78%	0.776	S	S	*	*			trans	-92.1	152.2	-163.5	-86.3	-72.5	0	0	0	116.4
94	S	36.4	Very low	37.1	Very low	126 Å²	126	146.9 Å²	146.9	88%	0.881	78%	0.782	S	S	*	*			trans	-156.7	136	137.4	-76.5	0	0	0	0	109.4
95	K	37.5	Very low	37.5	Very low	176 Å²	176	143 Å²	143	77%	0.765	77%	0.77	S	S	*	*			trans	-106.4	146.9	-175	-66.7	172.2	179.8	169.5	0	111.7
96	E	38.2	Very low	37.7	Very low	198 Å²	198	146.2 Å²	146.2	93%	0.925	78%	0.775	S	S	*	*				-156.8	154.9	129	-114.5	166	-147.7	0	0	110.1
97	N	33	Very low	37.7	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	78%	0.778	S	S	*	*			trans	-120.7	141.3	-170	-81.3	-68.9	0	0	0	111.9
98	L	38.3	Very low	38.3	Very low	179 Å²	179	145.5 Å²	145.5	94%	0.937	78%	0.781	S	S	*	*			trans	-146.2	143.1	144	-164.3	60.6	0	0	0	110.5
99	E	33.3	Very low	38.3	Very low	159 Å²	159	146.6 Å²	146.6	74%	0.743	79%	0.785	S	S	*	*			trans	-85.4	133.1	-165	-73.1	-162.6	69.4	0	0	115.2
100	N	37.3	Very low	37.5	Very low	120 Å²	120	149 Å²	149	64%	0.642	79%	0.785	S	S	*	*				55.5	161.1	119.3	-58.4	-41.9	0	0	0	121.8
101	P	43.4	Very low	37.8	Very low	108 Å²	108	155.7 Å²	155.7	70%	0.701	79%	0.794	S	S	*	*			cis	-131.9	159.7	-15.6	21.4	2.6	0	0	0	116.4
102	M	34.7	Very low	37.1	Very low	132 Å²	132	157.1 Å²	157.1	65%	0.65	79%	0.794	S	S	*	*				13	146.2	130	-75.1	179.6	-75.2	0	0	120.2
103	R	36.5	Very low	37	Very low	189 Å²	189	157.3 Å²	157.3	71%	0.713	80%	0.795	S	S	*	*			cis	-178.2	164.6	32.6	-123.7	166.6	-151.1	179.4	7.6	113.5
104	R	33.6	Very low	36.8	Very low	208 Å²	208	154.2 Å²	154.2	79%	0.785	79%	0.793	S	S	*	*			trans	28.2	140.9	130	-91.8	176.2	-147.5	-174.7	6.3	121.2
105	I	42.8	Very low	36.7	Very low	125 Å²	125	154.5 Å²	154.5	64%	0.641	79%	0.794	S	S	*	*			cis	-170.6	159.5	-7.5	28.3	176.6	0	0	0	113.9
106	H	35.1	Very low	36.7	Very low	165 Å²	165	151 Å²	151	76%	0.764	79%	0.792	S	S	*	*			trans	63.9	144.2	142.9	-62.6	-38.9	0	0	0	125.5
107	S	37.7	Very low	36.8	Very low	123 Å²	123	147.9 Å²	147.9	86%	0.86	79%	0.788	S	S	*	*			trans	96.9	146.7	146.1	76.6	0	0	0	0	120.3
108	L	40.5	Very low	36.9	Very low	160 Å²	160	145 Å²	145	84%	0.838	79%	0.785	S	S	*	*			trans	-99.7	169.4	-173.8	-69.9	166.5	0	0	0	111.7
109	P	43.5	Very low	36.8	Very low	127 Å²	127	144.9 Å²	144.9	83%	0.825	79%	0.785	S	S	*	*				-135.1	159.6	115.6	38	-30.2	0	0	0	114.7
110	Q	37.3	Very low	36.9	Very low	184 Å²	184	147.1 Å²	147.1	86%	0.86	79%	0.792	S	S	*	*			trans	-77.1	148.3	173	-62.6	169.4	-57.3	0	0	112.4
111	K	35.7	Very low	36.6	Very low	212 Å²	212	151.9 Å²	151.9	92%	0.922	80%	0.801	S	S	*	*			trans	-159.3	168.7	133.1	-111.1	160.7	-172.6	175.9	0	111.8
112	L	36.6	Very low	36.1	Very low	155 Å²	155	152.1 Å²	152.1	81%	0.812	81%	0.805	S	S	*	*			trans	-110.7	168.3	-157.4	-71.4	161.7	0	0	0	113.6
113	L	33.7	Very low	36	Very low	179 Å²	179	153 Å²	153	94%	0.937	81%	0.807	S	S	*	*			trans	72	144.6	168.2	-51.3	117.3	0	0	0	115.8
114	G	28.3	Very low	36	Very low	63 Å²	63	149.5 Å²	149.5	65%	0.649	81%	0.812	S	S	*	*			cis	151.6	137.1	-9	0	0	0	0	0	113
115	C	33.9	Very low	36.1	Very low	132 Å²	132	147 Å²	147	89%	0.892	81%	0.814	S	S	*	*			trans	64.5	159	177.2	-56.4	0	0	0	0	115.3
116	S	36.6	Very low	35.5	Very low	103 Å²	103	146 Å²	146	72%	0.72	82%	0.819	S	S	*	*			cis	-162.7	167.1	-28.9	-82.2	0	0	0	0	106.5
117	P	41.4	Very low	35.6	Very low	132 Å²	132	145.7 Å²	145.7	86%	0.857	82%	0.821	S	S	*	*				-145.6	154.5	96.9	37.1	-21.6	0	0	0	114.4
118	A	34.5	Very low	35.4	Very low	90 Å²	90	145.6 Å²	145.6	74%	0.744	81%	0.811	S	S	*	*			trans	-99	161.2	176.3	0	0	0	0	0	112.8
119	L	36.3	Very low	35	Very low	176 Å²	176	145.3 Å²	145.3	92%	0.921	81%	0.805	S	S	*	*			trans	-9.2	117.2	160.2	-61.2	166.8	0	0	0	116.2
120	K	35	Very low	34.5	Very low	206 Å²	206	145.2 Å²	145.2	90%	0.896	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.6	116.7	158.1	-84	-167.8	172.3	-173.7	0	109.8
121	R	31.7	Very low	34.2	Very low	220 Å²	220	143.4 Å²	143.4	83%	0.83	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-86	119.8	167.2	-166.6	-176.1	-160.3	166.6	5.5	108.3	H123	R121-H123 PolarHBondContact O-N 3.22Å
122	S	32.1	Very low	34.2	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-81.2	118.2	179.9	-60	0	0	0	0	111.2
123	H	33.2	Very low	34.1	Very low	151 Å²	151	142.8 Å²	142.8	70%	0.699	79%	0.786	S	S	*	*			trans	-129.1	139.2	157.4	-70.5	-89.3	0	0	0	107.4	R121	R121-H123 PolarHBondContact O-N 3.22Å
124	S	37.1	Very low	34	Very low	115 Å²	115	141.1 Å²	141.1	80%	0.804	78%	0.777	S	S	*	*			trans	-152.8	97.3	-178.6	56.7	0	0	0	0	109.5
125	D	34.1	Very low	34.2	Very low	156 Å²	156	145.7 Å²	145.7	83%	0.834	79%	0.786	S	S	*	*			trans	-80.5	145.3	170.1	-56.9	-60.8	0	0	0	110.6
126	S	32.1	Very low	34.4	Very low	105 Å²	105	146.2 Å²	146.2	73%	0.734	78%	0.78	S	S	*	*			trans	177.6	127.6	135	34.6	0	0	0	0	112.6
127	L	35.5	Very low	35.1	Very low	157 Å²	157	146.7 Å²	146.7	82%	0.822	78%	0.78	S	S	*	*				53.4	135.6	124.8	-56	179.8	0	0	0	119.4
128	D	34.7	Very low	34.9	Very low	122 Å²	122	148.3 Å²	148.3	65%	0.652	78%	0.781	S	S	*	*			cis	-167.2	-172.3	-7.7	-147.9	-22	0	0	0	110.3
129	H	32.1	Very low	35	Very low	154 Å²	154	151.2 Å²	151.2	71%	0.713	78%	0.78	S	S	*	*			trans	103.5	93.9	158.5	-62.2	-56.4	0	0	0	120
130	D	33.3	Very low	35	Very low	125 Å²	125	147.6 Å²	147.6	67%	0.668	76%	0.761	S	S	*	*				57.5	112.7	111.4	-62.4	-51.1	0	0	0	121.2
131	I	31.4	Very low	35.3	Very low	146 Å²	146	146.1 Å²	146.1	75%	0.749	76%	0.755	S	S	*	*				172.4	125.6	106.5	-97.6	154.5	0	0	0	112.9
132	F	34.5	Very low	35.6	Very low	185 Å²	185	144.5 Å²	144.5	81%	0.811	76%	0.757	S	S	*	*			trans	27.5	150	154.3	-55.8	-63.6	0	0	0	122.2
133	Q	33.9	Very low	36	Very low	168 Å²	168	146.6 Å²	146.6	79%	0.785	76%	0.759	S	S	*	*			cis	-164.2	145.9	27.3	-145.1	171.9	7.6	0	0	113.8
134	L	32.3	Very low	36.2	Very low	144 Å²	144	149 Å²	149	75%	0.754	77%	0.771	S	S	*	*			trans	45.2	121.6	150.7	-116.9	72	0	0	0	123.2
135	I	32.2	Very low	36.2	Very low	160 Å²	160	148.1 Å²	148.1	82%	0.821	77%	0.77	S	S	*	*				-175.1	139.8	100.2	-91.1	161.2	0	0	0	110.4
136	D	37.8	Very low	36.4	Very low	143 Å²	143	149.9 Å²	149.9	77%	0.765	77%	0.771	S	S	*	*			trans	-107.7	179.7	-178.4	-84.9	-54.8	0	0	0	111.5
137	P	51.1	Low	36.7	Very low	113 Å²	113	152.6 Å²	152.6	73%	0.734	77%	0.772	S	S	*	*			cis	-135.5	-178.8	-42.2	38.6	-23.2	0	0	0	112.4
138	D	38	Very low	36.7	Very low	165 Å²	165	154.7 Å²	154.7	88%	0.882	78%	0.775	S	S	*	*			trans	-153.4	162.5	139.4	-144.1	-25.5	0	0	0	111.1
139	E	37.4	Very low	37.6	Very low	151 Å²	151	156.9 Å²	156.9	71%	0.706	78%	0.778	S	S	*	*			trans	-102.4	165.9	-158.8	-66.7	-159.3	150.7	0	0	118
140	N	36.5	Very low	38.4	Very low	100 Å²	100	158.3 Å²	158.3	54%	0.535	78%	0.783	S	S	.	*			trans	100.9	99.9	143.1	-71.3	-56.4	0	0	0	121.1
141	K	39.7	Very low	39.4	Very low	176 Å²	176	158.5 Å²	158.5	77%	0.765	79%	0.79	S	S	*	*				43.1	117.8	118.6	-56.8	173.1	-170.4	115.1	0	118.1
142	E	39.1	Very low	39.9	Very low	186 Å²	186	158 Å²	158	87%	0.869	79%	0.794	S	S	*	*				177.8	140.9	91.7	-172.1	160.9	110.4	0	0	111.1
143	N	40.4	Very low	40.6	Very low	156 Å²	156	160.2 Å²	160.2	83%	0.834	80%	0.797	S	S	*	*			trans	-125.9	132	166.6	-78.7	-53.2	0	0	0	107.8
144	E	36.6	Very low	41.3	Very low	203 Å²	203	158.1 Å²	158.1	95%	0.949	80%	0.798	S	S	*	*				-164.9	178.1	126.7	-115.8	179.8	-159.5	0	0	112.9
145	A	38.4	Very low	41.2	Very low	96 Å²	96	157.8 Å²	157.8	79%	0.793	80%	0.801	S	S	*	*			trans	-98.7	165.3	-157.8	0	0	0	0	0	115.2
146	F	38.1	Very low	41.6	Very low	193 Å²	193	155.2 Å²	155.2	85%	0.846	80%	0.798	S	S	*	*			trans	-141.4	136.4	164.9	-150.8	-95.3	0	0	0	112.7
147	E	38.3	Very low	41.7	Very low	162 Å²	162	160.6 Å²	160.6	76%	0.757	81%	0.807	S	S	*	*			trans	-82.4	145	-176.6	-69.6	-172.7	113.5	0	0	114	K149	E147-K149 PolarHBondContact O-N 3.32Å
148	F	35.9	Very low	40.6	Very low	200 Å²	200	158.7 Å²	158.7	88%	0.877	81%	0.808	S	S	*	*			trans	-82.5	99.4	179.8	-167.2	-91	0	0	0	112.4
149	K	51.8	Low	40.2	Very low	168 Å²	168	156.2 Å²	156.2	73%	0.73	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.9	130.9	177.9	-68.5	-178.1	179.6	175.2	0	112.2	E147	E147-K149 PolarHBondContact O-N 3.32Å
150	K	49.4	Very low	39.9	Very low	185 Å²	185	156 Å²	156	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.4	139.4	177.2	-63.3	178.8	-178.3	176.7	0	111.3
151	P	53.8	Low	39.5	Very low	128 Å²	128	159 Å²	159	83%	0.831	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.5	179	30.7	-35.1	0	0	0	112.9
152	V	43.3	Very low	39.1	Very low	137 Å²	137	154.9 Å²	154.9	83%	0.83	81%	0.809	S	S	*	*			trans	-119.1	144.5	177.6	176.9	0	0	0	0	109.6
153	R	47.8	Very low	38.6	Very low	231 Å²	231	155.4 Å²	155.4	87%	0.872	81%	0.812	S	S	*	*			trans	-76	141.7	179.7	-59.7	175.5	179.2	169.5	-2.6	112.4
154	P	48.9	Very low	38	Very low	123 Å²	123	151.4 Å²	151.4	80%	0.799	81%	0.807	S	S	*	*			trans	-94	167.8	153.6	35.1	-30.1	0	0	0	112.2
155	V	31.6	Very low	37.6	Very low	137 Å²	137	149 Å²	149	83%	0.83	80%	0.8	S	S	*	*			trans	-126.9	155.9	-176.3	171	0	0	0	0	110.8
156	S	39.8	Very low	37.2	Very low	107 Å²	107	151 Å²	151	75%	0.748	79%	0.793	S	S	*	*			trans	-60.6	139.1	-173.1	56.4	0	0	0	0	117.5
157	R	39.5	Very low	36.9	Very low	255 Å²	255	150.1 Å²	150.1	96%	0.962	79%	0.791	S	S	*	*			trans	-148.1	161.1	146.1	-66.8	-171.3	178	-178	-1.2	106.8
158	G	28.6	Very low	36.4	Very low	73 Å²	73	145.9 Å²	145.9	75%	0.753	79%	0.791	S	S	*	*			cis	172.3	140.8	-3.3	0	0	0	0	0	108.5
159	C	28.8	Very low	36.2	Very low	113 Å²	113	146.2 Å²	146.2	76%	0.764	79%	0.792	S	S	*	*			trans	-73.6	151	-170.1	-171.4	0	0	0	0	114.1
160	L	30.9	Very low	35.3	Very low	147 Å²	147	145.3 Å²	145.3	77%	0.77	80%	0.795	S	S	*	*				-178.4	153.3	121.7	-94.6	165.6	0	0	0	115.7
161	H	29	Very low	34.5	Very low	162 Å²	162	144 Å²	144	75%	0.75	80%	0.796	S	S	*	*			trans	-25.2	167.9	164.1	-65.7	-30.6	0	0	0	121.4
162	S	30.2	Very low	33.5	Very low	90 Å²	90	146.5 Å²	146.5	63%	0.629	80%	0.795	S	S	*	*			cis	178.1	157.7	-17.5	58.6	0	0	0	0	112.5
163	H	30	Very low	33	Very low	198 Å²	198	146 Å²	146	92%	0.917	79%	0.792	S	S	*	*			trans	62.3	156.2	158.2	-91.7	-95.7	0	0	0	120
164	G	27.4	Very low	32.2	Very low	71 Å²	71	143.8 Å²	143.8	73%	0.732	79%	0.791	S	S	*	*			trans	143.1	39.9	147.1	0	0	0	0	0	124
165	L	28.8	Very low	31.3	Very low	154 Å²	154	147.3 Å²	147.3	81%	0.806	79%	0.789	S	S	*	*			trans	33.7	112.5	137.6	-166.1	65.3	0	0	0	122.2
166	Q	30.1	Very low	31.7	Very low	138 Å²	138	149.4 Å²	149.4	65%	0.645	79%	0.79	S	S	*	*			trans	85.5	137.6	131.6	-165.1	168	-1.5	0	0	124.2
167	E	30.7	Very low	31.4	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	78%	0.783	S	S	*	*			trans	62.6	141.2	158.3	-81.2	165.7	-142	0	0	122.4
168	G	28.7	Very low	31.1	Very low	73 Å²	73	143.8 Å²	143.8	75%	0.753	78%	0.78	S	S	*	*			trans	-171.5	-9.2	-176.5	0	0	0	0	0	122.5
169	K	32.1	Very low	31.5	Very low	206 Å²	206	144.7 Å²	144.7	90%	0.896	78%	0.78	S	S	*	*			trans	65.9	146.3	172.5	-71.2	175.8	176.1	170.5	0	120.4
170	D	31.9	Very low	32.5	Very low	149 Å²	149	145.7 Å²	145.7	80%	0.797	79%	0.786	S	S	*	*			trans	-80.2	163.5	-178.9	-36	-102.1	0	0	0	114.8
171	L	33.2	Very low	32.5	Very low	157 Å²	157	143 Å²	143	82%	0.822	79%	0.785	S	S	*	*			trans	-142.7	114.6	142.9	-78.5	-176.3	0	0	0	112.5
172	F	31.3	Very low	32.5	Very low	182 Å²	182	147.1 Å²	147.1	80%	0.798	79%	0.794	S	S	*	*			trans	32	123.6	148.4	-67.4	-96.3	0	0	0	119.8
173	T	34.5	Very low	32.5	Very low	126 Å²	126	151 Å²	151	77%	0.773	80%	0.804	S	S	*	*				-169.4	163.7	74.3	30.6	0	0	0	0	110.1
174	Q	29.9	Very low	32.6	Very low	184 Å²	184	150.3 Å²	150.3	86%	0.86	81%	0.806	S	S	*	*			cis	-161.7	156.8	-14.9	166.8	167.5	-56.8	0	0	107.6
175	R	31.1	Very low	32.8	Very low	198 Å²	198	152.3 Å²	152.3	75%	0.747	81%	0.809	S	S	*	*			trans	-147	122.8	-174.6	-174.9	-173.1	-174.3	-73.6	-2.9	115.1	N177	R175-N177 PolarHBondContact NH1-OD1 3.27Å
176	Q	40.3	Very low	32.9	Very low	181 Å²	181	150.4 Å²	150.4	85%	0.846	81%	0.809	S	S	*	*			trans	-147.9	121.3	152.4	-73.3	-162.2	-9.7	0	0	106.3
177	N	33	Very low	33	Very low	115 Å²	115	151.3 Å²	151.3	62%	0.615	82%	0.818	S	S	*	*				95.2	149.2	60.7	-91.5	-7.1	0	0	0	112.9	R175	R175-N177 PolarHBondContact NH1-OD1 3.27Å
178	S	33.7	Very low	33.1	Very low	128 Å²	128	150.6 Å²	150.6	90%	0.895	82%	0.815	S	S	*	*			trans	78.3	130.9	173.7	77.4	0	0	0	0	120
179	A	35.5	Very low	33.3	Very low	92 Å²	92	157.8 Å²	157.8	76%	0.76	82%	0.819	S	S	*	*			trans	-119.6	164.8	151.6	0	0	0	0	0	106.7
180	P	49.9	Very low	33.2	Very low	135 Å²	135	154.9 Å²	154.9	88%	0.877	81%	0.813	S	S	*	*				-143.1	-178.9	102.6	37	-21.8	0	0	0	113.7
181	A	30.5	Very low	33.1	Very low	91 Å²	91	152.1 Å²	152.1	75%	0.752	81%	0.805	S	S	*	*			trans	-99.5	158.5	-172.5	0	0	0	0	0	114.5
182	W	30.7	Very low	33.1	Very low	247 Å²	247	149.8 Å²	149.8	94%	0.936	80%	0.802	S	S	*	*			trans	-120.4	120.3	154.5	-82	0.4	0	0	0	107.1
183	M	30	Very low	33.2	Very low	172 Å²	172	148 Å²	148	85%	0.847	80%	0.797	S	S	*	*				66.5	102.9	87.2	-86.8	-175.9	58.8	0	0	115.1
184	L	31.8	Very low	33.1	Very low	183 Å²	183	152.8 Å²	152.8	96%	0.958	80%	0.801	S	S	*	*			trans	-137.6	156.9	144.9	-80.8	-177.1	0	0	0	109.3
185	S	31.5	Very low	33.2	Very low	114 Å²	114	147.2 Å²	147.2	80%	0.797	79%	0.792	S	S	*	*			trans	-98.3	160.4	-160.3	52.1	0	0	0	0	115.3
186	S	31	Very low	33.3	Very low	114 Å²	114	144.2 Å²	144.2	80%	0.797	79%	0.791	S	S	*	*			trans	-74	157.4	174.5	47.9	0	0	0	0	114.2
187	N	30.9	Very low	32.9	Very low	156 Å²	156	144.8 Å²	144.8	83%	0.834	79%	0.791	S	S	*	*			trans	-150.7	161.9	135.8	-152	-6	0	0	0	110
188	E	32.9	Very low	33	Very low	160 Å²	160	146.7 Å²	146.7	75%	0.748	80%	0.8	S	S	*	*			trans	-105.2	170.6	-160	-59.8	-175.1	110.4	0	0	116.6
189	R	33.2	Very low	33.5	Very low	224 Å²	224	145.7 Å²	145.7	85%	0.845	79%	0.79	S	S	*	*			trans	92.7	137.5	163.8	-68.1	178	-73.4	-166.1	-6.9	117.4
190	D	30.6	Very low	33.2	Very low	144 Å²	144	147.6 Å²	147.6	77%	0.77	79%	0.787	S	S	*	*			cis	-164.3	176.7	-19.7	-152.2	-18.6	0	0	0	109.5
191	S	30.1	Very low	32.3	Very low	91 Å²	91	149.8 Å²	149.8	64%	0.636	78%	0.783	S	S	*	*			trans	74	97	164	-52.4	0	0	0	0	119
192	S	32.1	Very low	32.3	Very low	108 Å²	108	151.8 Å²	151.8	76%	0.755	79%	0.786	S	S	*	*				26.9	134.1	120	60.7	0	0	0	0	120
193	E	33.2	Very low	32.7	Very low	146 Å²	146	145.3 Å²	145.3	68%	0.682	78%	0.775	S	S	*	*			cis	-149.7	148.7	26.2	-77.9	-154.5	96.4	0	0	116
194	R	34.2	Very low	32.6	Very low	226 Å²	226	146.7 Å²	146.7	85%	0.853	78%	0.78	S	S	*	*				34.6	127.8	125.1	-150.7	-171.9	-48.7	-128.8	2.2	119.5
195	G	31.2	Very low	32.5	Very low	66 Å²	66	143.2 Å²	143.2	68%	0.68	77%	0.771	S	S	*	*			cis	171.3	168.8	-3	0	0	0	0	0	113.4
196	N	33.2	Very low	33.1	Very low	135 Å²	135	143.5 Å²	143.5	72%	0.722	77%	0.77	S	S	*	*			trans	-9.8	148.9	174	-49.1	-6.8	0	0	0	119.8
197	F	32.3	Very low	33.1	Very low	194 Å²	194	144.9 Å²	144.9	85%	0.851	77%	0.773	S	S	*	*			cis	-149.8	168.4	38.8	-77.3	-91.8	0	0	0	115.2
198	I	34.1	Very low	33.1	Very low	155 Å²	155	144.1 Å²	144.1	80%	0.795	77%	0.774	S	S	*	*			trans	-127.2	140.1	172.3	-62.3	171.5	0	0	0	104.4
199	P	43.8	Very low	32.9	Very low	107 Å²	107	141 Å²	141	70%	0.695	78%	0.776	S	S	*	*				-152.4	-167.5	63.6	48.6	-27.9	0	0	0	115
200	L	30.1	Very low	32.9	Very low	132 Å²	132	137 Å²	137	69%	0.691	78%	0.777	S	S	*	*			cis	-148.4	159.3	15.8	-110	-177.7	0	0	0	111.6
201	F	30.6	Very low	33	Very low	180 Å²	180	137.7 Å²	137.7	79%	0.789	78%	0.78	S	S	*	*			trans	60.6	135.1	160.5	-68.4	-58.8	0	0	0	122.9
202	T	31.1	Very low	33.4	Very low	133 Å²	133	137.9 Å²	137.9	82%	0.816	78%	0.781	S	S	*	*			trans	-120.9	-162.1	170.1	54.6	0	0	0	0	109.1
203	P	39	Very low	33.6	Very low	111 Å²	111	139.8 Å²	139.8	72%	0.721	78%	0.782	S	S	*	*				-119.6	170.9	-102.4	39.1	-23.2	0	0	0	114.2
204	Q	27.8	Very low	33.9	Very low	202 Å²	202	140.5 Å²	140.5	94%	0.944	79%	0.786	S	S	*	*			trans	-141.5	163.2	152.6	-76.2	-151.7	10.4	0	0	112.2
205	S	29.8	Very low	34.1	Very low	109 Å²	109	136.3 Å²	136.3	76%	0.762	78%	0.78	S	S	*	*			trans	-118.4	178.8	-166.2	67.3	0	0	0	0	111.5
206	P	44.8	Very low	34.5	Very low	121 Å²	121	140.4 Å²	140.4	79%	0.786	79%	0.787	S	S	*	*			trans	-87.6	161	-155.6	35.6	-37.3	0	0	0	115
207	V	30.1	Very low	35.5	Very low	143 Å²	143	136.9 Å²	136.9	87%	0.867	78%	0.782	S	S	*	*			trans	-127.7	131.2	162.1	177.7	0	0	0	0	109.3
208	T	30.1	Very low	36	Very low	139 Å²	139	136.6 Å²	136.6	85%	0.853	78%	0.781	S	S	*	*			trans	-76.7	134.3	172.4	44.7	0	0	0	0	111.6
209	A	28.7	Very low	36.7	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	78%	0.779	S	S	*	*			trans	-135.6	117	163.8	0	0	0	0	0	110
210	T	33.9	Very low	36.8	Very low	141 Å²	141	136.9 Å²	136.9	87%	0.865	78%	0.782	S	S	*	*			trans	-84.3	121.7	166.5	47.2	0	0	0	0	109.1
211	L	33.4	Very low	37.7	Very low	159 Å²	159	138.1 Å²	138.1	83%	0.832	79%	0.789	S	S	*	*			trans	-131.7	131.7	158.1	-74	177.3	0	0	0	109.3
212	S	37.5	Very low	38.5	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	79%	0.792	S	S	*	*			trans	-76.5	142.5	153.7	49	0	0	0	0	108.7
213	D	36.4	Very low	39	Very low	148 Å²	148	139.6 Å²	139.6	79%	0.791	80%	0.799	S	S	*	*			trans	-149.7	150.4	148.8	-98.4	-42.4	0	0	0	109.3	D215	D213-D215 PolarHBondContact O-N 3.37Å
214	E	41.1	Very low	38.9	Very low	161 Å²	161	137.5 Å²	137.5	75%	0.752	80%	0.798	S	S	*	*			trans	-83.6	98.8	-176	-20.6	-73.9	98.7	0	0	109.7	D216	E214-D216 PolarHBondContact O-N 2.69Å
215	D	37.7	Very low	39.7	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	80%	0.796	S	S	*	*			trans	-76.6	83.8	176	-179	32.1	0	0	0	111.9	D213 G217	D213-D215 PolarHBondContact O-N 3.37Å; D215-G217 PolarHBondContact O-N 2.75Å
216	D	40	Very low	40.3	Very low	152 Å²	152	137.9 Å²	137.9	81%	0.813	79%	0.792	S	S	*	*			trans	-69.4	78.5	164.7	-94.2	-29.5	0	0	0	109.7	E214 F218	E214-D216 PolarHBondContact O-N 2.69Å; D216-F218 PolarHBondContact O-N 3.35Å
217	G	54.2	Low	40.2	Very low	61 Å²	61	139.9 Å²	139.9	63%	0.629	80%	0.795	S	S	*	*			trans	-53	85.5	-169.1	0	0	0	0	0	116.2	D215	D215-G217 PolarHBondContact O-N 2.75Å
218	F	42.5	Very low	40.8	Very low	189 Å²	189	141.3 Å²	141.3	83%	0.829	79%	0.789	S	S	*	*			trans	-114.9	-12.4	178.2	-177.6	-106.5	0	0	0	113.2	D216	D216-F218 PolarHBondContact O-N 3.35Å
219	V	49.1	Very low	41	Very low	123 Å²	123	142.3 Å²	142.3	75%	0.745	79%	0.79	S	S	*	*			trans	-88.2	-6.7	-169.6	-65	0	0	0	0	115.5	L221	V219-L221 PolarHBondContact O-N 3.21Å
220	D	46.2	Very low	41.5	Very low	144 Å²	144	146.7 Å²	146.7	77%	0.77	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	33.6	-169.2	-150.4	40	0	0	0	114.5
221	L	48.9	Very low	42.1	Very low	159 Å²	159	148.8 Å²	148.8	83%	0.832	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	21	-171.2	-153.6	74.3	0	0	0	115.4	V219	V219-L221 PolarHBondContact O-N 3.21Å
222	L	46.7	Very low	42.5	Very low	162 Å²	162	150.1 Å²	150.1	85%	0.848	80%	0.796	S	S	*	*	S	Bend	trans	-129.8	-18.1	173	-76.2	174.6	0	0	0	115.5	G224	L222-G224 VanDerWaalsContact C-N 3.32Å; L222-G224 PolarHBondContact O-N 3.38Å
223	D	42	Very low	42.9	Very low	181 Å²	181	152.2 Å²	152.2	97%	0.968	81%	0.805	S	S	*	*			trans	-81.9	75.4	178.2	-73.9	-6.7	0	0	0	111.8
224	G	37.4	Very low	43	Very low	68 Å²	68	150.9 Å²	150.9	70%	0.701	81%	0.805	S	S	*	*			trans	-144.6	63.9	179	0	0	0	0	0	112.1	L222 N226	L222-G224 VanDerWaalsContact C-N 3.32Å; L222-G224 PolarHBondContact O-N 3.38Å; G224-N226 PolarHBondContact O-N 3Å
225	E	43.3	Very low	43.5	Very low	193 Å²	193	148.7 Å²	148.7	90%	0.902	81%	0.807	S	S	*	*			trans	-72.4	89.6	-172.3	-165.3	169.2	-154.8	0	0	113.5
226	N	43.3	Very low	43.8	Very low	125 Å²	125	147.2 Å²	147.2	67%	0.668	81%	0.806	S	S	*	*				48.9	106.1	127	-170.4	10.9	0	0	0	118.9	G224	G224-N226 PolarHBondContact O-N 3Å
227	L	42.5	Very low	44.2	Very low	164 Å²	164	146.4 Å²	146.4	86%	0.859	80%	0.799	S	S	*	*			trans	-137.1	111.5	146.4	-81.2	-178.6	0	0	0	111.5
228	K	42.1	Very low	44.1	Very low	172 Å²	172	146.5 Å²	146.5	75%	0.748	79%	0.794	S	S	*	*			trans	60.8	103	163	-57.6	177.8	-179	177.7	0	116.6
229	N	33.8	Very low	44.7	Very low	160 Å²	160	142 Å²	142	86%	0.856	79%	0.786	S	S	*	*				-156.6	148.4	96.1	-87	-26.2	0	0	0	110.2
230	E	40	Very low	45.1	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.874	78%	0.783	S	S	*	*			trans	-80.6	174.1	166.1	-73.4	-73.7	159.4	0	0	110.2
231	E	45.5	Very low	45.1	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	79%	0.787	S	S	*	*			trans	87.5	132.7	164.9	-152.3	149.9	-133.5	0	0	117.9
232	E	42.2	Very low	45.3	Very low	187 Å²	187	144.2 Å²	144.2	87%	0.874	78%	0.782	S	S	*	*			trans	52	88	174.6	-62.4	-159.3	132.6	0	0	121.1
233	T	46.2	Very low	45.2	Very low	139 Å²	139	140.1 Å²	140.1	85%	0.853	77%	0.771	S	S	*	*			trans	-91.5	131.9	149.8	47.5	0	0	0	0	111.1	S235	T233-S235 PolarHBondContact O-N 2.94Å
234	P	39.4	Very low	45.3	Very low	120 Å²	120	137 Å²	137	78%	0.779	76%	0.761	S	S	*	*			trans	-77	124.9	-173.7	28.3	-34.3	0	0	0	113.4	C236	P234-C236 PolarHBondContact O-N 2.85Å
235	S	49.8	Very low	45.5	Very low	114 Å²	114	142.3 Å²	142.3	80%	0.797	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	33.9	-171.9	-158.3	0	0	0	0	115.9	T233	T233-S235 PolarHBondContact O-N 2.94Å
236	C	43.9	Very low	45.5	Very low	108 Å²	108	138.6 Å²	138.6	73%	0.73	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-20.6	-168.8	-158.6	0	0	0	0	115	P234	P234-C236 PolarHBondContact O-N 2.85Å
237	M	49.4	Very low	45.4	Very low	135 Å²	135	140.9 Å²	140.9	67%	0.665	77%	0.771	S	S	*	*	S	Bend	trans	-104.9	-14.7	-175.6	-66.9	-164.5	72.4	0	0	115.6	S239	M237-S239 VanDerWaalsContact C-N 3.32Å; M237-S239 PolarHBondContact O-N 3.01Å
238	A	51.5	Low	45.1	Very low	63 Å²	63	144.1 Å²	144.1	52%	0.521	77%	0.772	S	S	.	*	G	3₁₀ helix	trans	-63.2	-36.6	-179.3	0	0	0	0	0	112.7	L240 W241	A238-L240 PolarHBondContact O-N 3.34Å; A238-L240 VanDerWaalsContact O-N 3.09Å; A238-W241 PolarHBondContact O-N 2.88Å
239	S	54.9	Low	44.9	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-63.8	-15.8	-174.9	-51.7	0	0	0	0	115.2	M237	M237-S239 VanDerWaalsContact C-N 3.32Å; M237-S239 PolarHBondContact O-N 3.01Å
240	L	58.9	Low	44.9	Very low	132 Å²	132	140.9 Å²	140.9	69%	0.691	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-81.1	-20.5	179.2	-64.9	176.7	0	0	0	113.4	A238	A238-L240 PolarHBondContact O-N 3.34Å; A238-L240 VanDerWaalsContact O-N 3.09Å
241	W	45.6	Very low	44.6	Very low	225 Å²	225	139.6 Å²	139.6	85%	0.852	77%	0.772	S	S	*	*	S	Bend	trans	-97.7	-4.8	-173.2	-65.6	94.7	0	0	0	114.2	A238	A238-W241 PolarHBondContact O-N 2.88Å
242	T	52.4	Low	44	Very low	116 Å²	116	138.2 Å²	138.2	71%	0.712	77%	0.769	S	S	*	*			trans	-121.5	16	-170.8	-30	0	0	0	0	113.2	P244	T242-P244 WeakPolarHBondContact O-CD 3.31Å
243	A	44.7	Very low	43.5	Very low	76 Å²	76	135.2 Å²	135.2	63%	0.628	76%	0.759	S	S	*	*			trans	-76.9	121.4	-176.8	0	0	0	0	0	112.5
244	P	44.3	Very low	42.9	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	76%	0.758	S	S	*	*			trans	-73.5	133.4	-179.8	-18.7	33.1	0	0	0	113.6	T242 V246	T242-P244 WeakPolarHBondContact O-CD 3.31Å; P244-V246 PolarHBondContact O-N 3.04Å
245	L	41.1	Very low	42.7	Very low	178 Å²	178	141.1 Å²	141.1	93%	0.932	76%	0.762	S	S	*	*			trans	-76.2	103.4	172.2	-69.4	173.7	0	0	0	111.1
246	V	44.4	Very low	41.9	Very low	115 Å²	115	141.2 Å²	141.2	70%	0.697	76%	0.761	S	S	*	*			trans	-93.5	107.8	175.1	179.9	0	0	0	0	110.5	P244 R248	P244-V246 PolarHBondContact O-N 3.04Å; V246-R248 HydrophobicContact CG1-CG 4.45Å
247	M	41.6	Very low	41.4	Very low	173 Å²	173	145 Å²	145	85%	0.852	77%	0.765	S	S	*	*			trans	-64.9	135.2	164.9	-67.6	173.4	65.1	0	0	110.1
248	R	34.8	Very low	40.7	Very low	233 Å²	233	144.8 Å²	144.8	88%	0.879	77%	0.766	S	S	*	*			trans	-123	124.3	164.6	-82.2	-173.3	169.9	146.5	-0.2	110.5	V246	V246-R248 HydrophobicContact CG1-CG 4.45Å
249	T	37.8	Very low	39.7	Very low	122 Å²	122	149.4 Å²	149.4	75%	0.748	78%	0.775	S	S	*	*			trans	-95.1	126.2	179.1	50.1	0	0	0	0	111
250	T	34.1	Very low	38.4	Very low	141 Å²	141	151.6 Å²	151.6	87%	0.865	78%	0.779	S	S	*	*			trans	-138.8	109.9	161.8	49.4	0	0	0	0	109.1
251	N	34.1	Very low	37.2	Very low	161 Å²	161	150.9 Å²	150.9	86%	0.861	79%	0.785	S	S	*	*			trans	-83.9	136.8	168.4	-71	-66.3	0	0	0	109.5
252	L	32.6	Very low	37.8	Very low	155 Å²	155	145.8 Å²	145.8	81%	0.812	78%	0.781	S	S	*	*				-159.6	133.7	127.4	-160.3	57.4	0	0	0	111.6
253	D	31.1	Very low	36.7	Very low	123 Å²	123	146.1 Å²	146.1	66%	0.658	79%	0.788	S	S	*	*			trans	20.7	124.2	161.6	-59.3	-32.7	0	0	0	121.8
254	N	35.3	Very low	36.2	Very low	153 Å²	153	150 Å²	150	82%	0.818	80%	0.797	S	S	*	*				-162.3	105.7	92.7	-103.4	-71.6	0	0	0	115.1
255	R	33.7	Very low	35.5	Very low	230 Å²	230	149.8 Å²	149.8	87%	0.868	80%	0.797	S	S	*	*			trans	41.7	107.2	138.5	-174.2	172.2	167.3	172.8	-5.8	120.3
256	C	33.9	Very low	35.1	Very low	117 Å²	117	147 Å²	147	79%	0.791	79%	0.793	S	S	*	*			trans	-84.2	160.4	167	-62.2	0	0	0	0	114.7
257	K	33.3	Very low	34.6	Very low	187 Å²	187	146.4 Å²	146.4	81%	0.813	79%	0.794	S	S	*	*			trans	179.5	116.8	141.3	-97.7	159.9	-175.4	-171.7	0	108.5
258	L	34.4	Very low	34.2	Very low	130 Å²	130	143 Å²	143	68%	0.681	79%	0.787	S	S	*	*				69.6	112.1	74.4	-73.6	169.1	0	0	0	114
259	F	30.3	Very low	34.2	Very low	161 Å²	161	137.3 Å²	137.3	71%	0.706	78%	0.779	S	S	*	*				171.6	144.3	97.9	-88.8	-64.3	0	0	0	114.3
260	D	27.8	Very low	34.1	Very low	140 Å²	140	142.3 Å²	142.3	75%	0.749	78%	0.784	S	S	*	*			trans	55.1	156.3	140.3	-55.2	-19.7	0	0	0	125.9
261	S	34.6	Very low	33.8	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	78%	0.775	S	S	*	*			trans	-135.4	179.9	164.8	-52.2	0	0	0	0	107
262	P	57.3	Low	33.6	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	77%	0.771	S	S	*	*			cis	-128.8	-161.9	-11.7	42	-25.1	0	0	0	111.6
263	S	30.1	Very low	33.5	Very low	123 Å²	123	137.8 Å²	137.8	86%	0.86	77%	0.766	S	S	*	*			trans	167.7	-169.6	139.5	52.1	0	0	0	0	113.5
264	L	34.1	Very low	33.5	Very low	156 Å²	156	141.6 Å²	141.6	82%	0.817	78%	0.777	S	S	*	*			trans	-136.7	143.4	-150.8	-79.7	153.8	0	0	0	116.3
265	C	28.1	Very low	33.6	Very low	112 Å²	112	145 Å²	145	76%	0.757	78%	0.779	S	S	*	*			trans	65.6	165.9	139.6	-69.4	0	0	0	0	124
266	S	33.1	Very low	33.4	Very low	120 Å²	120	139.8 Å²	139.8	84%	0.839	77%	0.774	S	S	*	*			trans	85.9	142.5	166.9	82.6	0	0	0	0	117.6
267	S	33.5	Very low	33.1	Very low	102 Å²	102	142.9 Å²	142.9	71%	0.713	78%	0.777	S	S	*	*			cis	-164.5	176.7	-15.4	61	0	0	0	0	113
268	S	34.5	Very low	32.8	Very low	102 Å²	102	144.9 Å²	144.9	71%	0.713	78%	0.78	S	S	*	*			trans	78.6	145.1	151.5	-61.5	0	0	0	0	119
269	T	33.9	Very low	32.4	Very low	114 Å²	114	142.8 Å²	142.8	70%	0.699	78%	0.776	S	S	*	*			cis	-162.7	150.5	1.5	12.6	0	0	0	0	113.2
270	R	35.5	Very low	32.1	Very low	226 Å²	226	143.1 Å²	143.1	85%	0.853	78%	0.78	S	S	*	*			trans	55.7	139.5	148.1	-64.6	-176.3	-178.7	-169.2	0.3	120.1
271	S	29.4	Very low	32	Very low	98 Å²	98	143.3 Å²	143.3	69%	0.685	78%	0.776	S	S	*	*			cis	87.8	130.3	24.3	84.8	0	0	0	0	115.1
272	V	28.7	Very low	31.6	Very low	127 Å²	127	147 Å²	147	77%	0.77	78%	0.78	S	S	*	*			cis	-174.9	174.2	2.3	58	0	0	0	0	111.8
273	L	31.4	Very low	30.2	Very low	137 Å²	137	146.2 Å²	146.2	72%	0.717	78%	0.778	S	S	*	*			trans	97.3	120.8	156	-72.2	171.9	0	0	0	123.7
274	K	30.6	Very low	31.1	Very low	204 Å²	204	145.7 Å²	145.7	89%	0.887	77%	0.771	S	S	*	*			trans	74.4	164.5	134.5	-81.6	-177.4	178.5	-174.6	0	123.2
275	R	36.7	Very low	31.4	Very low	225 Å²	225	144.3 Å²	144.3	85%	0.849	77%	0.772	S	S	*	*			trans	-139.1	146.1	-157.9	163.8	-173	-175.9	149	-0.8	110.2
276	P	30.4	Very low	31.2	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	77%	0.765	S	S	*	*			trans	-104.7	166.4	161.2	35.5	-26.6	0	0	0	113.2
277	E	27	Very low	31.1	Very low	181 Å²	181	143.1 Å²	143.1	85%	0.846	76%	0.762	S	S	*	*			trans	-108.2	172.1	-179.5	-66.3	-176.4	99.6	0	0	113.6
278	R	27.7	Very low	31.1	Very low	230 Å²	230	144.5 Å²	144.5	87%	0.868	77%	0.766	S	S	*	*			trans	-154.1	126.7	142.5	-120.6	-174.8	170	87.9	-0.1	113.1
279	S	24.9	Very low	30.9	Very low	86 Å²	86	149 Å²	149	60%	0.601	77%	0.773	S	S	*	*			trans	27.7	129.8	139.3	57.5	0	0	0	0	120.1
280	Q	25.8	Very low	31	Very low	168 Å²	168	154.5 Å²	154.5	79%	0.785	78%	0.781	S	S	*	*				57.4	139.8	70.8	-77.5	-176.8	-82.2	0	0	113.9
281	E	24	Very low	31.2	Very low	144 Å²	144	154.8 Å²	154.8	67%	0.673	78%	0.782	S	S	*	*			cis	-172.8	142.3	-5.4	164.1	174.6	172.6	0	0	110.1
282	E	26.5	Very low	31.5	Very low	195 Å²	195	158.9 Å²	158.9	91%	0.911	79%	0.788	S	S	*	*			trans	-163.3	165.3	140.4	-126.1	-176	144.5	0	0	111.1
283	S	28.7	Very low	31.7	Very low	101 Å²	101	157.1 Å²	157.1	71%	0.706	78%	0.781	S	S	*	*			trans	-146.3	-173.5	-162.1	84	0	0	0	0	113.9
284	P	49.5	Very low	31.9	Very low	112 Å²	112	158.9 Å²	158.9	73%	0.727	79%	0.788	S	S	*	*			trans	-96.2	176.2	-143.6	43	-43.7	0	0	0	115.8
285	P	39.2	Very low	31.8	Very low	127 Å²	127	154.2 Å²	154.2	83%	0.825	78%	0.78	S	S	*	*				-138.8	176.2	92.5	30.5	-12.4	0	0	0	112.8
286	G	25.2	Very low	31.5	Very low	59 Å²	59	147 Å²	147	61%	0.608	78%	0.776	S	S	*	*			cis	152	175.7	-0.6	0	0	0	0	0	111
287	N	30.4	Very low	31.5	Very low	148 Å²	148	146.4 Å²	146.4	79%	0.791	78%	0.781	S	S	*	*			trans	72.4	152	167.1	-43.3	-36.5	0	0	0	117.5
288	T	32.6	Very low	31.6	Very low	130 Å²	130	145.1 Å²	145.1	80%	0.798	78%	0.78	S	S	*	*			cis	-157.9	150.7	-28.7	24.4	0	0	0	0	111.8
289	K	31.8	Very low	32.6	Very low	197 Å²	197	138.7 Å²	138.7	86%	0.857	77%	0.769	S	S	*	*			trans	-37.5	146.9	165.4	-56.5	160.2	177.5	171.7	0	115.6
290	R	35.8	Very low	33	Very low	229 Å²	229	143.9 Å²	143.9	86%	0.864	78%	0.78	S	S	*	*				-168.8	136.4	112	-107	169.7	78.8	155.9	-2.6	116.2
291	R	39.7	Very low	33.3	Very low	233 Å²	233	144.6 Å²	144.6	88%	0.879	78%	0.783	S	S	*	*			trans	-84	155.1	153.2	-85.5	173.3	155.9	-178.5	-7	110
292	K	35.3	Very low	33.6	Very low	184 Å²	184	142.8 Å²	142.8	80%	0.8	79%	0.787	S	S	*	*			trans	167.4	134.5	131.5	-92.3	-177.1	172.5	-169.2	0	108.1
293	S	32.6	Very low	33.7	Very low	89 Å²	89	140 Å²	140	62%	0.622	78%	0.783	S	S	*	*			cis	88.6	131.9	16.3	86.3	0	0	0	0	117.7
294	M	34.9	Very low	33.7	Very low	175 Å²	175	140.2 Å²	140.2	86%	0.862	79%	0.785	S	S	*	*			trans	75.3	151.1	167.3	-46.5	-161.9	87.5	0	0	115.7
295	S	29.8	Very low	33.5	Very low	105 Å²	105	140 Å²	140	73%	0.734	78%	0.783	S	S	*	*			cis	-150.1	152.9	-0.8	-118.9	0	0	0	0	109.3
296	G	30.3	Very low	33.1	Very low	74 Å²	74	141 Å²	141	76%	0.763	78%	0.777	S	S	*	*				107.3	157.9	89.4	0	0	0	0	0	110.7
297	A	29.4	Very low	33.4	Very low	107 Å²	107	146 Å²	146	88%	0.884	78%	0.782	S	S	*	*			cis	-154.4	173.7	-3.4	0	0	0	0	0	111.5
298	N	29.6	Very low	33.2	Very low	154 Å²	154	143.7 Å²	143.7	82%	0.824	78%	0.784	S	S	*	*			trans	-87.6	-163.3	178.5	-136	3	0	0	0	110.2
299	P	49	Very low	33.3	Very low	96 Å²	96	145.9 Å²	145.9	62%	0.623	78%	0.784	S	S	*	*			cis	-138.3	174.5	1.6	42.2	-23.7	0	0	0	117.5
300	K	32.4	Very low	33.2	Very low	195 Å²	195	144.3 Å²	144.3	85%	0.848	78%	0.78	S	S	*	*				-171.5	150.5	114.5	-102	171.1	-176.7	-177.2	0	115.2
301	E	33.1	Very low	33.3	Very low	182 Å²	182	137.8 Å²	137.8	85%	0.85	77%	0.766	S	S	*	*			trans	-76.1	170.2	176.6	-71.9	156.8	111	0	0	112.6
302	S	30.3	Very low	32.8	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	76%	0.76	S	S	*	*			cis	-157	-168.2	-2.1	36.4	0	0	0	0	107.5
303	T	27.4	Very low	33	Very low	135 Å²	135	133 Å²	133	83%	0.828	76%	0.76	S	S	*	*			cis	-146.8	176.5	16.1	32.3	0	0	0	0	111.5
304	S	28.6	Very low	33.1	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	77%	0.772	S	S	*	*			trans	-121	-176.1	170	64.5	0	0	0	0	110.1
305	P	45.3	Very low	33.1	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	77%	0.766	S	S	*	*			cis	-143.3	-178.9	5.8	46.7	-29	0	0	0	117.7
306	E	31.6	Very low	33.8	Very low	147 Å²	147	137.5 Å²	137.5	69%	0.687	77%	0.773	S	S	*	*			trans	64.7	151.8	159.1	-60.4	-153.6	142.6	0	0	119.3
307	K	31.1	Very low	33.9	Very low	164 Å²	164	139 Å²	139	71%	0.713	77%	0.773	S	S	*	*			cis	-152	153.7	-4	-128.5	165.5	-172.2	141.7	0	112.1
308	A	26.9	Very low	34.9	Very low	100 Å²	100	140.5 Å²	140.5	83%	0.826	77%	0.773	S	S	*	*			trans	11	123.6	162.6	0	0	0	0	0	121.9
309	H	35	Very low	35.4	Very low	176 Å²	176	138 Å²	138	82%	0.815	77%	0.774	S	S	*	*			trans	-148	111.6	145.2	-168.8	-70	0	0	0	109.2	T311	H309-T311 PolarHBondContact CE1-OG1 2.86Å; H309-T311 VanDerWaalsContact CE1-OG1 3.29Å
310	E	28.9	Very low	35	Very low	164 Å²	164	138.1 Å²	138.1	77%	0.766	78%	0.777	S	S	*	*			trans	-125	117.5	-177.6	-167.8	162.1	-145.9	0	0	111	L312	E310-L312 HydrophobicContact CG-CD1 4.25Å; E310-L312 HydrophobicContact CG-CG 4.21Å
311	T	38	Very low	35.4	Very low	92 Å²	92	132.8 Å²	132.8	56%	0.564	76%	0.764	S	S	*	*			trans	-148.8	81.4	-179.7	-50.4	0	0	0	0	108.2	H309 H313	H309-T311 PolarHBondContact CE1-OG1 2.86Å; H309-T311 VanDerWaalsContact CE1-OG1 3.29Å; T311-H313 PolarHBondContact O-N 3.15Å
312	L	30.3	Very low	36.2	Very low	145 Å²	145	129.3 Å²	129.3	76%	0.759	76%	0.757	S	S	*	*			trans	-88.5	89.2	-171.7	-72	173	0	0	0	112.2	E310 Q314	E310-L312 HydrophobicContact CG-CD1 4.25Å; E310-L312 HydrophobicContact CG-CG 4.21Å; L312-Q314 PolarHBondContact O-N 3.48Å
313	H	39.1	Very low	36.9	Very low	172 Å²	172	132 Å²	132	80%	0.796	76%	0.755	S	S	*	*			trans	-72.7	105.4	157.5	-73.8	-96.3	0	0	0	109.4	T311 S315	T311-H313 PolarHBondContact O-N 3.15Å; H313-S315 PolarHBondContact O-N 3.44Å
314	Q	34.3	Very low	37.8	Very low	189 Å²	189	126.7 Å²	126.7	88%	0.883	73%	0.728	S	S	*	*			trans	-88.1	92.2	177.3	-159.7	168.2	30.6	0	0	111	L312	L312-Q314 PolarHBondContact O-N 3.48Å
315	S	35.6	Very low	39.3	Very low	104 Å²	104	124.7 Å²	124.7	73%	0.727	71%	0.712	S	S	*	*			trans	-76.5	124	177.5	55.3	0	0	0	0	112.2	H313	H313-S315 PolarHBondContact O-N 3.44Å
316	L	42.9	Very low	40	Very low	170 Å²	170	124.6 Å²	124.6	89%	0.89	70%	0.704	S	S	*	*			trans	-81.4	126.4	173.8	-68.1	169.5	0	0	0	111.4
317	S	33.7	Very low	41.2	Very low	107 Å²	107	123.6 Å²	123.6	75%	0.748	70%	0.699	S	S	*	*			trans	-122.5	125.9	174.2	-66.8	0	0	0	0	110.2	A319	S317-A319 PolarHBondContact O-N 3.01Å
318	P	50.6	Low	42.6	Very low	137 Å²	137	120.7 Å²	120.7	89%	0.89	69%	0.692	S	S	*	*			trans	-92.5	96.3	-168.4	34.2	-34.2	0	0	0	113.5
319	A	39.7	Very low	44.1	Very low	103 Å²	103	119 Å²	119	85%	0.851	67%	0.668	S	S	*	*			trans	-157.3	92.5	164.4	0	0	0	0	0	112	S317	S317-A319 PolarHBondContact O-N 3.01Å
320	S	40.4	Very low	45.3	Very low	98 Å²	98	117.1 Å²	117.1	69%	0.685	66%	0.663	S	S	*	*			trans	-118.3	132.3	165.3	60.8	0	0	0	0	110.9
321	S	40.4	Very low	46.7	Very low	82 Å²	82	116.2 Å²	116.2	57%	0.573	66%	0.664	S	S	*	*			trans	-74.4	154.3	168.8	65.4	0	0	0	0	109.6	K323 G324	S321-K323 PolarHBondContact O-N 2.8Å; S321-G324 PolarHBondContact O-N 2.95Å
322	P	50.8	Low	47.8	Very low	109 Å²	109	116 Å²	116	71%	0.708	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	2.5	-169.4	26.1	-35.8	0	0	0	115.7
323	K	44	Very low	49.8	Very low	163 Å²	163	111.8 Å²	111.8	71%	0.709	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-52	175.9	-68.5	-172.3	173.6	-173.4	0	112.4	S321 T325 I326 E327	S321-K323 PolarHBondContact O-N 2.8Å; K323-T325 PolarHBondContact O-N 2.88Å; K323-T325 VanDerWaalsContact O-N 3.15Å; K323-I326 PolarHBondContact O-N 2.9Å; K323-E327 PolarHBondContact O-N 3.22Å
324	G	46.8	Very low	51.1	Low	25 Å²	25	108 Å²	108	26%	0.258	63%	0.628	S	S	.	*	H	α-helix	trans	-64.3	-22	-177.6	0	0	0	0	0	113.9	S321 I326 N328	S321-G324 PolarHBondContact O-N 2.95Å; G324-I326 VanDerWaalsContact C-N 3.31Å; G324-I326 PolarHBondContact O-N 2.85Å; G324-N328 WeakPolarHBondContact O-CB 3.34Å; G324-N328 PolarHBondContact O-N 2.86Å; G324-N328 PolarHBondContact O-ND2 3.02Å
325	T	59.4	Low	52.9	Low	65 Å²	65	107 Å²	107	40%	0.399	62%	0.616	S	S	.	*	H	α-helix	trans	-64	-35.6	172.7	-46.3	0	0	0	0	112.3	K323 I329	K323-T325 PolarHBondContact O-N 2.88Å; K323-T325 VanDerWaalsContact O-N 3.15Å; T325-I329 HydrophobicContact CG2-CD1 4.19Å; T325-I329 WeakPolarHBondContact O-CD1 3.39Å; T325-I329 VanDerWaalsContact O-CG1 3.22Å; T325-I329 WeakPolarHBondContact O-CG1 3.43Å; T325-I329 PolarHBondContact O-N 2.74Å
326	I	59.9	Low	55.3	Low	105 Å²	105	105.3 Å²	105.3	54%	0.538	60%	0.599	S	S	.	*	H	α-helix	trans	-79.3	-43.4	-176.1	-59.5	174.7	0	0	0	110.4	K323 G324 N328 I329 L330	K323-I326 PolarHBondContact O-N 2.9Å; G324-I326 VanDerWaalsContact C-N 3.31Å; G324-I326 PolarHBondContact O-N 2.85Å; I326-N328 PolarHBondContact O-N 2.77Å; I326-I329 PolarHBondContact O-N 3.25Å; I326-I329 VanDerWaalsContact O-N 3.11Å; I326-L330 HydrophobicContact CG2-CD1 4.26Å; I326-L330 WeakPolarHBondContact O-CG 3.34Å; I326-L330 PolarHBondContact O-N 3.16Å; I326-L330 VanDerWaalsContact O-N 3.15Å
327	E	57.3	Low	57.6	Low	126 Å²	126	98.2 Å²	98.2	59%	0.589	56%	0.562	S	S	*	*	H	α-helix	trans	-58.6	-48.3	176.1	-68.7	165.7	168	0	0	110.5	K323 I329 L330 D331	K323-E327 PolarHBondContact O-N 3.22Å; E327-I329 VanDerWaalsContact C-N 3.28Å; E327-I329 PolarHBondContact O-N 3.44Å; E327-L330 PolarHBondContact O-N 2.93Å; E327-D331 PolarHBondContact O-N 3.34Å; E327-D331 VanDerWaalsContact O-N 3.1Å
328	N	59.9	Low	60.6	Low	103 Å²	103	93.3 Å²	93.3	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-60.1	-31.9	174.7	-72.2	-9	0	0	0	113.8	G324 I326 L330 N332	G324-N328 WeakPolarHBondContact O-CB 3.34Å; G324-N328 PolarHBondContact O-N 2.86Å; G324-N328 PolarHBondContact O-ND2 3.02Å; I326-N328 PolarHBondContact O-N 2.77Å; N328-L330 VanDerWaalsContact C-N 3.34Å; N328-N332 PolarHBondContact O-N 3.01Å; N328-N332 PolarHBondContact O-ND2 3.42Å
329	I	60	Low	62.6	Low	63 Å²	63	87.2 Å²	87.2	32%	0.323	49%	0.489	S	S	.	.	H	α-helix	trans	-72.7	-28.8	177.3	-75.2	166.9	0	0	0	111.5	T325 I326 E327 L337	T325-I329 HydrophobicContact CG2-CD1 4.19Å; T325-I329 WeakPolarHBondContact O-CD1 3.39Å; T325-I329 VanDerWaalsContact O-CG1 3.22Å; T325-I329 WeakPolarHBondContact O-CG1 3.43Å; T325-I329 PolarHBondContact O-N 2.74Å; I326-I329 PolarHBondContact O-N 3.25Å; I326-I329 VanDerWaalsContact O-N 3.11Å; E327-I329 VanDerWaalsContact C-N 3.28Å; E327-I329 PolarHBondContact O-N 3.44Å; I329-L337 HydrophobicContact CG2-CD1 4.37Å
330	L	59	Low	65.3	Low	137 Å²	137	84.2 Å²	84.2	72%	0.717	46%	0.459	S	S	*	.	H	α-helix	trans	-81.8	-28.5	178.5	-65.8	170.2	0	0	0	113	I326 E327 N328	I326-L330 HydrophobicContact CG2-CD1 4.26Å; I326-L330 WeakPolarHBondContact O-CG 3.34Å; I326-L330 PolarHBondContact O-N 3.16Å; I326-L330 VanDerWaalsContact O-N 3.15Å; E327-L330 PolarHBondContact O-N 2.93Å; N328-L330 VanDerWaalsContact C-N 3.34Å
331	D	59.7	Low	67.8	Low	145 Å²	145	83.8 Å²	83.8	78%	0.775	45%	0.445	S	S	*	.	H	α-helix	trans	-81.2	-16.4	173.7	-77.1	-19.5	0	0	0	113.6	E327	E327-D331 PolarHBondContact O-N 3.34Å; E327-D331 VanDerWaalsContact O-N 3.1Å
332	N	60.8	Low	70.2	Confident	87 Å²	87	82.5 Å²	82.5	47%	0.465	44%	0.436	S	S	.	.	S	Bend	trans	-79.4	140.4	172.8	-88.9	-91.2	0	0	0	111.2	N328	N328-N332 PolarHBondContact O-N 3.01Å; N328-N332 PolarHBondContact O-ND2 3.42Å
333	D	70.6	Confident	72.2	Confident	57 Å²	57	81.4 Å²	81.4	31%	0.305	42%	0.42	S	S	.	.			trans	-64.3	130.5	172.9	-168.8	-58.2	0	0	0	109.8	R335 D336	D333-R335 VanDerWaalsContact CG-NH2 3.29Å; D333-R335 PolarHBondContact O-N 2.81Å; D333-R335 WeakPolarHBondContact OD1-CB 3.31Å; D333-R335 WeakPolarHBondContact OD1-CG 3.47Å; D333-R335 IonicContact OD1-CZ 3.88Å; D333-R335 PolarHBondContact OD1-N 3.17Å; D333-R335 IonicContact OD1-NE 3.2Å; D333-R335 IonicContact OD1-NH1 3.04Å; D333-R335 PolarHBondContact OD1-NH1 3.49Å; D333-R335 IonicContact OD1-NH2 2.69Å; D333-R335 IonicContact OD2-CZ 3.47Å; D333-R335 IonicContact OD2-NH1 2.91Å; D333-R335 PolarHBondContact OD2-NH1 3.48Å; D333-R335 IonicContact OD2-NH2 3.43Å; D333-R335 PolarHBondContact OD2-NH2 3.28Å; D333-D336 PolarHBondContact O-N 3.11Å
334	P	66.8	Low	74.6	Confident	93 Å²	93	75.1 Å²	75.1	60%	0.604	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-61.4	-12.6	-178.3	23.8	-34.5	0	0	0	114	D336	P334-D336 PolarHBondContact O-N 3.34Å
335	R	73.1	Confident	76.9	Confident	169 Å²	169	76.3 Å²	76.3	64%	0.638	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-69.1	-13.7	169.5	-65.4	-170.1	-54.3	-66.3	-9.7	113.9	D333 K358	D333-R335 VanDerWaalsContact CG-NH2 3.29Å; D333-R335 PolarHBondContact O-N 2.81Å; D333-R335 WeakPolarHBondContact OD1-CB 3.31Å; D333-R335 WeakPolarHBondContact OD1-CG 3.47Å; D333-R335 IonicContact OD1-CZ 3.88Å; D333-R335 PolarHBondContact OD1-N 3.17Å; D333-R335 IonicContact OD1-NE 3.2Å; D333-R335 IonicContact OD1-NH1 3.04Å; D333-R335 PolarHBondContact OD1-NH1 3.49Å; D333-R335 IonicContact OD1-NH2 2.69Å; D333-R335 IonicContact OD2-CZ 3.47Å; D333-R335 IonicContact OD2-NH1 2.91Å; D333-R335 PolarHBondContact OD2-NH1 3.48Å; D333-R335 IonicContact OD2-NH2 3.43Å; D333-R335 PolarHBondContact OD2-NH2 3.28Å; R335-K358 WeakPolarHBondContact O-CE 3.28Å; R335-K358 PolarHBondContact O-NZ 2.87Å
336	D	84.7	Confident	78.6	Confident	67 Å²	67	75 Å²	75	36%	0.358	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-110.2	6.1	-175.7	-63.1	-37.4	0	0	0	114.1	D333 P334 G344 Y345 K358	D333-D336 PolarHBondContact O-N 3.11Å; P334-D336 PolarHBondContact O-N 3.34Å; D336-G344 WeakPolarHBondContact O-CA 3.17Å; D336-Y345 VanDerWaalsContact O-CD2 3.26Å; D336-Y345 WeakPolarHBondContact O-CD2 3.2Å; D336-Y345 PolarHBondContact O-N 3.44Å; D336-K358 IonicContact OD1-NZ 3.5Å; D336-K358 PolarHBondContact OD1-NZ 3.11Å
337	L	92.9	Very high	80.2	Confident	21 Å²	21	70.6 Å²	70.6	11%	0.11	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-85.2	147.3	164.8	-60.4	178	0	0	0	111.6	I329 F341 K343 Y345	I329-L337 HydrophobicContact CG2-CD1 4.37Å; L337-F341 HydrophobicContact CB-CD1 4.48Å; L337-F341 HydrophobicContact CD1-CB 4.29Å; L337-F341 HydrophobicContact CD1-CD1 4.48Å; L337-K343 WeakPolarHBondContact CA-O 3.49Å; L337-Y345 WeakPolarHBondContact O-CE2 3.22Å; L337-Y345 PolarHBondContact O-OH 3.33Å
338	I	95.2	Very high	81.9	Confident	5 Å²	5	71.6 Å²	71.6	3%	0.026	37%	0.37	C	S	.	.			trans	-69.4	168.8	173.2	72.2	178.8	0	0	0	111.2	D340 F341 K343 Y345 P461 E462	I338-D340 VanDerWaalsContact CG1-OD1 3.28Å; I338-D340 WeakPolarHBondContact CG1-OD1 3.47Å; I338-D340 PolarHBondContact O-N 3.4Å; I338-F341 WeakPolarHBondContact O-CA 3.46Å; I338-F341 PolarHBondContact O-N 2.79Å; I338-K343 HydrophobicContact CD1-CB 4.12Å; I338-K343 HydrophobicContact CG1-CB 4.48Å; I338-K343 WeakPolarHBondContact CG1-O 3.26Å; I338-K343 PolarHBondContact N-O 3.26Å; I338-Y345 HydrophobicContact CB-CE1 4.45Å; I338-Y345 HydrophobicContact CG2-CD1 3.78Å; I338-Y345 HydrophobicContact CG2-CD2 4.37Å; I338-Y345 HydrophobicContact CG2-CE1 3.97Å; I338-Y345 HydrophobicContact CG2-CG 3.96Å; I338-P461 HydrophobicContact CB-CB 4.5Å; I338-P461 HydrophobicContact CD1-CB 3.89Å; I338-P461 HydrophobicContact CD1-CG 3.96Å; I338-P461 HydrophobicContact CG1-CB 4.04Å; I338-E462 HydrophobicContact CB-CB 4.37Å; I338-E462 HydrophobicContact CD1-CB 4.39Å; I338-E462 HydrophobicContact CG2-CB 4.09Å; I338-E462 HydrophobicContact CG2-CG 4.02Å
339	G	94.1	Very high	83.6	Confident	9 Å²	9	68.5 Å²	68.5	9%	0.093	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.6	-165.3	0	0	0	0	0	117.6	R450 P461	G339-R450 PolarHBondContact O-NH2 3.01Å; G339-P461 PolarHBondContact N-O 2.89Å
340	D	94.4	Very high	85.3	Confident	40 Å²	40	67.3 Å²	67.3	21%	0.214	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	3.4	173.3	67.8	0.3	0	0	0	113.5	I338 S342 P456 P461	I338-D340 VanDerWaalsContact CG1-OD1 3.28Å; I338-D340 WeakPolarHBondContact CG1-OD1 3.47Å; I338-D340 PolarHBondContact O-N 3.4Å; D340-S342 VanDerWaalsContact CG-OG 3.24Å; D340-S342 PolarHBondContact O-N 3.36Å; D340-S342 WeakPolarHBondContact OD1-CB 3.42Å; D340-S342 PolarHBondContact OD1-N 3.26Å; D340-S342 PolarHBondContact OD1-OG 2.98Å; D340-S342 PolarHBondContact OD2-OG 3.07Å; D340-P456 WeakPolarHBondContact CA-O 3.45Å; D340-P456 WeakPolarHBondContact CB-O 3.33Å; D340-P461 HydrophobicContact CB-CB 3.9Å
341	F	93.9	Very high	87	Confident	88 Å²	88	64.1 Å²	64.1	39%	0.386	34%	0.344	S	S	.	.	S	Bend	trans	61.6	11.9	-174.9	-44.5	-78.9	0	0	0	115.4	L337 I338 Y455 P456	L337-F341 HydrophobicContact CB-CD1 4.48Å; L337-F341 HydrophobicContact CD1-CB 4.29Å; L337-F341 HydrophobicContact CD1-CD1 4.48Å; I338-F341 WeakPolarHBondContact O-CA 3.46Å; I338-F341 PolarHBondContact O-N 2.79Å; F341-Y455 HydrophobicContact CE2-CE2 4.23Å; F341-Y455 AromaticContact CE2-CZ 3.89Å; F341-Y455 VanDerWaalsContact CE2-OH 3.3Å; F341-Y455 WeakPolarHBondContact CE2-OH 3.38Å; F341-P456 HydrophobicContact CD2-CB 3.83Å; F341-P456 HydrophobicContact CE2-CB 3.97Å
342	S	91.8	Very high	88.6	Confident	56 Å²	56	58.2 Å²	58.2	39%	0.392	32%	0.317	S	S	.	.	S	Bend	trans	-77.1	-28.9	-174.1	68.2	0	0	0	0	114.7	D340	D340-S342 VanDerWaalsContact CG-OG 3.24Å; D340-S342 PolarHBondContact O-N 3.36Å; D340-S342 WeakPolarHBondContact OD1-CB 3.42Å; D340-S342 PolarHBondContact OD1-N 3.26Å; D340-S342 PolarHBondContact OD1-OG 2.98Å; D340-S342 PolarHBondContact OD2-OG 3.07Å
343	K	91.9	Very high	90.2	Very high	85 Å²	85	60.3 Å²	60.3	37%	0.37	32%	0.322	S	S	.	.	S	Bend	trans	-152.2	158.6	-170.9	-60.6	173.4	-171.6	170.2	0	110.4	L337 I338 G422	L337-K343 WeakPolarHBondContact CA-O 3.49Å; I338-K343 HydrophobicContact CD1-CB 4.12Å; I338-K343 HydrophobicContact CG1-CB 4.48Å; I338-K343 WeakPolarHBondContact CG1-O 3.26Å; I338-K343 PolarHBondContact N-O 3.26Å; K343-G422 PolarHBondContact NZ-O 2.88Å
344	G	94.1	Very high	91.4	Very high	31 Å²	31	59.1 Å²	59.1	32%	0.32	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-68.2	159	162.6	0	0	0	0	0	112.5	D336 R424	D336-G344 WeakPolarHBondContact O-CA 3.17Å; G344-R424 VanDerWaalsContact O-CZ 3.31Å; G344-R424 PolarHBondContact O-NH1 2.91Å; G344-R424 PolarHBondContact O-NH2 2.85Å
345	Y	94.8	Very high	92.6	Very high	51 Å²	51	62.5 Å²	62.5	20%	0.2	32%	0.323	C	S	.	.			trans	-57.4	141.4	170.6	-72.9	-82.6	0	0	0	111.5	D336 L337 I338 K358 E462 Y464	D336-Y345 VanDerWaalsContact O-CD2 3.26Å; D336-Y345 WeakPolarHBondContact O-CD2 3.2Å; D336-Y345 PolarHBondContact O-N 3.44Å; L337-Y345 WeakPolarHBondContact O-CE2 3.22Å; L337-Y345 PolarHBondContact O-OH 3.33Å; I338-Y345 HydrophobicContact CB-CE1 4.45Å; I338-Y345 HydrophobicContact CG2-CD1 3.78Å; I338-Y345 HydrophobicContact CG2-CD2 4.37Å; I338-Y345 HydrophobicContact CG2-CE1 3.97Å; I338-Y345 HydrophobicContact CG2-CG 3.96Å; Y345-K358 HydrophobicContact CD1-CG 4.29Å; Y345-K358 HydrophobicContact CD2-CG 4.36Å; Y345-K358 HydrophobicContact CE1-CB 4.39Å; Y345-K358 HydrophobicContact CE1-CG 3.81Å; Y345-K358 HydrophobicContact CE2-CD 4.28Å; Y345-K358 VanDerWaalsContact CE2-CE 3.44Å; Y345-K358 HydrophobicContact CE2-CG 3.91Å; Y345-E462 HydrophobicContact CD1-CG 4.21Å; Y345-Y464 WeakPolarHBondContact CB-OH 3.25Å; Y345-Y464 AromaticContact CD1-CE1 3.71Å; Y345-Y464 HydrophobicContact CD1-CE1 3.71Å; Y345-Y464 AromaticContact CD1-CZ 3.72Å; Y345-Y464 HydrophobicContact CE1-CE1 4.49Å; Y345-Y464 HydrophobicContact CG-CE1 4.39Å
346	L	95.1	Very high	93.6	Very high	38 Å²	38	59.4 Å²	59.4	20%	0.199	32%	0.319	C	S	.	.	S	Bend	trans	-74.1	-33.6	178.6	-179.7	62.6	0	0	0	113	F373 L376 I377 I426 E462 Y464	L346-F373 HydrophobicContact CD2-CD1 4.3Å; L346-F373 HydrophobicContact CG-CD1 4.49Å; L346-L376 HydrophobicContact CD1-CB 4.44Å; L346-L376 HydrophobicContact CD1-CD1 3.78Å; L346-L376 HydrophobicContact CD2-CB 4.4Å; L346-I377 HydrophobicContact CD2-CD1 3.8Å; L346-I377 HydrophobicContact CD2-CG1 3.58Å; L346-I426 HydrophobicContact CB-CD1 4.2Å; L346-I426 HydrophobicContact CD2-CD1 3.74Å; L346-E462 WeakPolarHBondContact CB-OE1 3.34Å; L346-E462 PolarHBondContact N-OE1 3.35Å; L346-Y464 PolarHBondContact N-OH 3.09Å; L346-Y464 VanDerWaalsContact N-OH 3.15Å
347	F	95.2	Very high	94.1	Very high	12 Å²	12	57.4 Å²	57.4	5%	0.053	31%	0.308	C	S	.	.	S	Bend	trans	-105.3	147.1	-175	-54.6	-44.6	0	0	0	111.9	T349 I360 I364 V368 F373 I377 F380 I426 Y464	F347-T349 PolarHBondContact O-N 3.47Å; F347-I360 HydrophobicContact CB-CG2 3.93Å; F347-I360 HydrophobicContact CD2-CG2 4.01Å; F347-I360 HydrophobicContact CG-CG2 4.38Å; F347-I364 HydrophobicContact CB-CG2 4.08Å; F347-I364 HydrophobicContact CD1-CG2 3.96Å; F347-I364 HydrophobicContact CD2-CG2 4.24Å; F347-I364 HydrophobicContact CE1-CG2 4.47Å; F347-I364 HydrophobicContact CG-CG2 3.84Å; F347-V368 HydrophobicContact CE1-CG2 3.66Å; F347-V368 HydrophobicContact CE2-CG2 4.23Å; F347-V368 HydrophobicContact CZ-CG2 3.39Å; F347-F373 HydrophobicContact CD1-CE1 4.25Å; F347-F373 HydrophobicContact CD1-CZ 4.18Å; F347-F373 HydrophobicContact CE1-CD1 4.03Å; F347-F373 HydrophobicContact CE1-CD2 4.05Å; F347-F373 HydrophobicContact CE1-CE1 4.07Å; F347-F373 HydrophobicContact CE1-CE2 4.07Å; F347-F373 HydrophobicContact CE1-CG 4.02Å; F347-F373 HydrophobicContact CE1-CZ 4.08Å; F347-I377 HydrophobicContact CE1-CD1 4.23Å; F347-I377 HydrophobicContact CZ-CD1 3.71Å; F347-F380 AromaticContact CE2-CE2 3.96Å; F347-F380 HydrophobicContact CE2-CE2 3.96Å; F347-F380 HydrophobicContact CZ-CE2 4.19Å; F347-I426 HydrophobicContact CE2-CD1 4.02Å; F347-I426 HydrophobicContact CE2-CG2 4.17Å; F347-I426 HydrophobicContact CZ-CD1 4.1Å; F347-Y464 HydrophobicContact CB-CE1 4.15Å; F347-Y464 AromaticContact CD2-CD2 3.97Å; F347-Y464 HydrophobicContact CD2-CD2 3.97Å; F347-Y464 HydrophobicContact CD2-CE1 4.18Å; F347-Y464 AromaticContact CD2-CE2 3.41Å; F347-Y464 HydrophobicContact CD2-CE2 3.41Å; F347-Y464 VanDerWaalsContact CD2-CE2 3.41Å; F347-Y464 AromaticContact CD2-CZ 3.52Å; F347-Y464 HydrophobicContact CE2-CD2 4.31Å; F347-Y464 AromaticContact CE2-CE2 3.86Å; F347-Y464 HydrophobicContact CE2-CE2 3.86Å; F347-Y464 HydrophobicContact CG-CE2 4.41Å; F347-Y464 PolarHBondContact N-OH 2.76Å; F347-Y464 VanDerWaalsContact N-OH 3.1Å
348	H	92.6	Very high	94.3	Very high	147 Å²	147	58.4 Å²	58.4	68%	0.681	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-63.1	125.4	167.4	176.6	74.4	0	0	0	110.1	I364	H348-I364 HydrophobicContact CB-CD1 4.47Å; H348-I364 WeakPolarHBondContact O-CD1 3.16Å
349	T	94.8	Very high	94.5	Very high	38 Å²	38	58.4 Å²	58.4	23%	0.233	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-99.7	130.3	-174.7	62.4	0	0	0	0	111.7	F347 K358 Y359 Y464	F347-T349 PolarHBondContact O-N 3.47Å; T349-K358 HydrophobicContact CG2-CB 3.77Å; T349-K358 HydrophobicContact CG2-CD 3.96Å; T349-K358 HydrophobicContact CG2-CG 4.1Å; T349-Y359 CarbonylContact C-O 3.51Å; T349-Y359 VanDerWaalsContact CA-O 3.23Å; T349-Y359 WeakPolarHBondContact CA-O 3.49Å; T349-Y464 HydrophobicContact CG2-CD1 4.3Å; T349-Y464 HydrophobicContact CG2-CE1 3.84Å
350	V	95.6	Very high	94.7	Very high	37 Å²	37	58 Å²	58	22%	0.224	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-96.4	154.3	178.7	-65.8	0	0	0	0	111.6	Y359 K467	V350-Y359 PolarHBondContact N-O 2.58Å; V350-Y359 WeakPolarHBondContact O-CB 3.47Å; V350-K467 HydrophobicContact CB-CD 4.39Å; V350-K467 HydrophobicContact CG2-CB 4.13Å; V350-K467 HydrophobicContact CG2-CD 3.61Å
351	A	94.8	Very high	94.9	Very high	70 Å²	70	56.7 Å²	56.7	58%	0.579	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-66.3	137.2	173.9	0	0	0	0	0	111.8	K467	A351-K467 WeakPolarHBondContact O-CE 3.27Å; A351-K467 PolarHBondContact O-NZ 3.5Å
352	G	94.1	Very high	95.1	Very high	21 Å²	21	52.5 Å²	52.5	22%	0.216	28%	0.282	C	S	.	.			trans	-135.5	-170.9	176.9	0	0	0	0	0	112.3
353	K	94.3	Very high	95.3	Very high	131 Å²	131	54.5 Å²	54.5	57%	0.57	29%	0.286	S	S	*	.	S	Bend	trans	-64.2	-41	-176.3	-177.9	178.8	179.4	179.3	0	112.9	S435 E436	K353-S435 WeakPolarHBondContact CD-OG 3.49Å; K353-S435 PolarHBondContact NZ-OG 2.83Å; K353-E436 IonicContact NZ-OE1 2.63Å; K353-E436 PolarHBondContact NZ-OE1 3.29Å
354	H	95.2	Very high	95.5	Very high	33 Å²	33	51.8 Å²	51.8	15%	0.153	28%	0.275	C	S	.	.			trans	-104	105.2	-173.9	-65	-81.3	0	0	0	110	D356 L357 Y359 S435 R443	H354-D356 PolarHBondContact O-N 2.76Å; H354-L357 HydrophobicContact CB-CB 4.38Å; H354-L357 HydrophobicContact CB-CD1 4.05Å; H354-L357 HydrophobicContact CB-CG 4.17Å; H354-L357 PolarHBondContact O-N 2.87Å; H354-L357 VanDerWaalsContact O-N 3.09Å; H354-Y359 HydrophobicContact CB-CE2 4.49Å; H354-Y359 WeakPolarHBondContact CB-OH 3.36Å; H354-Y359 PolarHBondContact CD2-OH 3.1Å; H354-Y359 VanDerWaalsContact CD2-OH 3.31Å; H354-Y359 PolarHBondContact N-OH 3.03Å; H354-Y359 WeakPolarHBondContact O-CE2 3.22Å; H354-S435 PolarHBondContact CD2-O 3.14Å; H354-S435 PolarHBondContact NE2-O 3.09Å; H354-R443 VanDerWaalsContact CG-NH2 3.34Å; H354-R443 PolarHBondContact ND1-NH1 3.13Å; H354-R443 PolarHBondContact ND1-NH2 3.34Å
355	Q	92.8	Very high	95.7	Very high	163 Å²	163	50.3 Å²	50.3	76%	0.762	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.6	-171.3	-59.6	-66.1	-10.8	0	0	114.3	L357	Q355-L357 VanDerWaalsContact C-N 3.32Å
356	D	93	Very high	95.8	Very high	104 Å²	104	48.4 Å²	48.4	56%	0.556	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-15.1	173.5	59	-55.9	0	0	0	113.6	H354 R443	H354-D356 PolarHBondContact O-N 2.76Å; D356-R443 IonicContact OD1-CZ 2.68Å; D356-R443 IonicContact OD1-NH2 3.22Å; D356-R443 PolarHBondContact OD1-NH2 3.3Å; D356-R443 IonicContact OD2-CZ 3.62Å; D356-R443 VanDerWaalsContact OD2-CZ 3.24Å; D356-R443 IonicContact OD2-NE 3.73Å; D356-R443 PolarHBondContact OD2-NE 3.41Å; D356-R443 IonicContact OD2-NH2 2.72Å; D356-R443 PolarHBondContact OD2-NH2 3.1Å
357	L	96.3	Very high	95.9	Very high	25 Å²	25	47.8 Å²	47.8	13%	0.131	25%	0.253	C	S	.	.	S	Bend	trans	-109.2	138.3	-177	-58.2	-178.1	0	0	0	111.3	H354 Q355 Y359 P439 R443 V465	H354-L357 HydrophobicContact CB-CB 4.38Å; H354-L357 HydrophobicContact CB-CD1 4.05Å; H354-L357 HydrophobicContact CB-CG 4.17Å; H354-L357 PolarHBondContact O-N 2.87Å; H354-L357 VanDerWaalsContact O-N 3.09Å; Q355-L357 VanDerWaalsContact C-N 3.32Å; L357-Y359 HydrophobicContact CB-CE2 3.98Å; L357-Y359 VanDerWaalsContact O-CD2 3.27Å; L357-Y359 WeakPolarHBondContact O-CD2 3.42Å; L357-Y359 WeakPolarHBondContact O-CE2 3.15Å; L357-P439 HydrophobicContact CD1-CB 3.69Å; L357-P439 HydrophobicContact CD1-CG 4.43Å; L357-R443 HydrophobicContact CD1-CG 4.5Å; L357-R443 HydrophobicContact CD2-CG 4.11Å; L357-V465 HydrophobicContact CB-CG2 4.41Å; L357-V465 HydrophobicContact CD1-CG2 4.1Å
358	K	97.4	Very high	95.9	Very high	42 Å²	42	47.9 Å²	47.9	18%	0.183	26%	0.255	C	S	.	.			trans	-83.4	125.2	175.1	-62.5	-57	-165.6	164	0	110.3	R335 D336 Y345 T349 Y464 V465	R335-K358 WeakPolarHBondContact O-CE 3.28Å; R335-K358 PolarHBondContact O-NZ 2.87Å; D336-K358 IonicContact OD1-NZ 3.5Å; D336-K358 PolarHBondContact OD1-NZ 3.11Å; Y345-K358 HydrophobicContact CD1-CG 4.29Å; Y345-K358 HydrophobicContact CD2-CG 4.36Å; Y345-K358 HydrophobicContact CE1-CB 4.39Å; Y345-K358 HydrophobicContact CE1-CG 3.81Å; Y345-K358 HydrophobicContact CE2-CD 4.28Å; Y345-K358 VanDerWaalsContact CE2-CE 3.44Å; Y345-K358 HydrophobicContact CE2-CG 3.91Å; T349-K358 HydrophobicContact CG2-CB 3.77Å; T349-K358 HydrophobicContact CG2-CD 3.96Å; T349-K358 HydrophobicContact CG2-CG 4.1Å; K358-Y464 HydrophobicContact CB-CD1 3.92Å; K358-Y464 HydrophobicContact CB-CE1 4.35Å; K358-Y464 CarbonylContact O-C 3.49Å; K358-Y464 WeakPolarHBondContact O-CA 3.38Å; K358-V465 PolarHBondContact O-N 3.42Å
359	Y	98.3	Very high	96.1	Very high	5 Å²	5	43.6 Å²	43.6	2%	0.02	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	148.3	176.7	-65.5	-109.1	0	0	0	111.9	T349 V350 H354 L357 V465 K467	T349-Y359 CarbonylContact C-O 3.51Å; T349-Y359 VanDerWaalsContact CA-O 3.23Å; T349-Y359 WeakPolarHBondContact CA-O 3.49Å; V350-Y359 PolarHBondContact N-O 2.58Å; V350-Y359 WeakPolarHBondContact O-CB 3.47Å; H354-Y359 HydrophobicContact CB-CE2 4.49Å; H354-Y359 WeakPolarHBondContact CB-OH 3.36Å; H354-Y359 PolarHBondContact CD2-OH 3.1Å; H354-Y359 VanDerWaalsContact CD2-OH 3.31Å; H354-Y359 PolarHBondContact N-OH 3.03Å; H354-Y359 WeakPolarHBondContact O-CE2 3.22Å; L357-Y359 HydrophobicContact CB-CE2 3.98Å; L357-Y359 VanDerWaalsContact O-CD2 3.27Å; L357-Y359 WeakPolarHBondContact O-CD2 3.42Å; L357-Y359 WeakPolarHBondContact O-CE2 3.15Å; Y359-V465 CarbonylContact C-O 3.57Å; Y359-V465 WeakPolarHBondContact CA-O 3.26Å; Y359-V465 HydrophobicContact CD1-CB 3.72Å; Y359-V465 HydrophobicContact CD1-CG1 3.73Å; Y359-V465 HydrophobicContact CE1-CB 3.73Å; Y359-V465 HydrophobicContact CE1-CG1 3.45Å; Y359-V465 VanDerWaalsContact CE1-CG1 3.45Å; Y359-V465 HydrophobicContact CG-CB 4.25Å; Y359-K467 HydrophobicContact CD1-CB 4.34Å
360	I	98.3	Very high	96.1	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	154.4	169	61.2	171.5	0	0	0	111.1	F347 I364 V428 Y464 V465 L466 K467	F347-I360 HydrophobicContact CB-CG2 3.93Å; F347-I360 HydrophobicContact CD2-CG2 4.01Å; F347-I360 HydrophobicContact CG-CG2 4.38Å; I360-I364 HydrophobicContact CB-CB 4.29Å; I360-I364 HydrophobicContact CB-CD1 4.35Å; I360-I364 HydrophobicContact CB-CG2 4.16Å; I360-I364 HydrophobicContact CD1-CG2 4.28Å; I360-I364 HydrophobicContact CG2-CG2 4.3Å; I360-V428 HydrophobicContact CD1-CG1 3.96Å; I360-V428 HydrophobicContact CD1-CG2 4.02Å; I360-V428 HydrophobicContact CG1-CG1 4.33Å; I360-Y464 HydrophobicContact CG2-CD1 3.54Å; I360-Y464 HydrophobicContact CG2-CE1 3.99Å; I360-Y464 HydrophobicContact CG2-CG 3.88Å; I360-V465 PolarHBondContact N-O 3.15Å; I360-L466 HydrophobicContact CG1-CD1 4.26Å; I360-K467 WeakPolarHBondContact O-CB 3.3Å; I360-K467 PolarHBondContact O-N 2.82Å
361	S	98	Very high	96	Very high	13 Å²	13	46.2 Å²	46.2	9%	0.091	26%	0.257	C	S	.	.			trans	-81.9	159.4	175.1	78	0	0	0	0	112.4	E363 I364 M365	S361-E363 WeakPolarHBondContact CB-OE2 3.45Å; S361-E363 PolarHBondContact O-N 3.15Å; S361-E363 PolarHBondContact OG-N 3.24Å; S361-E363 PolarHBondContact OG-OE2 3.34Å; S361-I364 PolarHBondContact O-N 2.93Å; S361-I364 VanDerWaalsContact O-N 3.13Å; S361-I364 PolarHBondContact OG-N 3.23Å; S361-M365 PolarHBondContact O-N 3.29Å; S361-M365 VanDerWaalsContact O-N 3.14Å
362	P	97.8	Very high	96	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-53.9	-32.9	169	-31.6	40	0	0	0	114.4	I364 M365 A366 E472 F473 K476	P362-I364 VanDerWaalsContact C-N 3.34Å; P362-I364 PolarHBondContact O-N 2.87Å; P362-M365 PolarHBondContact O-N 3.06Å; P362-A366 WeakPolarHBondContact O-CB 3.21Å; P362-A366 PolarHBondContact O-N 2.92Å; P362-E472 HydrophobicContact CG-CG 4.27Å; P362-F473 HydrophobicContact CB-CD2 3.91Å; P362-K476 HydrophobicContact CB-CB 4.41Å; P362-K476 HydrophobicContact CB-CD 3.86Å; P362-K476 HydrophobicContact CG-CD 4Å
363	E	96.9	Very high	96	Very high	99 Å²	99	51.1 Å²	51.1	46%	0.463	26%	0.26	S	S	.	.	H	α-helix	trans	-69	-31.9	178.5	-46.7	87	-140.3	0	0	112.5	S361 S367 K476	S361-E363 WeakPolarHBondContact CB-OE2 3.45Å; S361-E363 PolarHBondContact O-N 3.15Å; S361-E363 PolarHBondContact OG-N 3.24Å; S361-E363 PolarHBondContact OG-OE2 3.34Å; E363-S367 VanDerWaalsContact O-CB 3.22Å; E363-S367 WeakPolarHBondContact O-CB 3.45Å; E363-S367 PolarHBondContact O-N 3.11Å; E363-S367 PolarHBondContact O-OG 2.91Å; E363-K476 IonicContact OE1-NZ 3.72Å; E363-K476 PolarHBondContact OE1-NZ 2.79Å
364	I	96.9	Very high	95.9	Very high	28 Å²	28	47.6 Å²	47.6	14%	0.144	26%	0.255	C	S	.	.	H	α-helix	trans	-70	-47.4	172.3	-65.4	172.8	0	0	0	109.7	F347 H348 I360 S361 P362 A366 S367 V368	F347-I364 HydrophobicContact CB-CG2 4.08Å; F347-I364 HydrophobicContact CD1-CG2 3.96Å; F347-I364 HydrophobicContact CD2-CG2 4.24Å; F347-I364 HydrophobicContact CE1-CG2 4.47Å; F347-I364 HydrophobicContact CG-CG2 3.84Å; H348-I364 HydrophobicContact CB-CD1 4.47Å; H348-I364 WeakPolarHBondContact O-CD1 3.16Å; I360-I364 HydrophobicContact CB-CB 4.29Å; I360-I364 HydrophobicContact CB-CD1 4.35Å; I360-I364 HydrophobicContact CB-CG2 4.16Å; I360-I364 HydrophobicContact CD1-CG2 4.28Å; I360-I364 HydrophobicContact CG2-CG2 4.3Å; S361-I364 PolarHBondContact O-N 2.93Å; S361-I364 VanDerWaalsContact O-N 3.13Å; S361-I364 PolarHBondContact OG-N 3.23Å; P362-I364 VanDerWaalsContact C-N 3.34Å; P362-I364 PolarHBondContact O-N 2.87Å; I364-A366 PolarHBondContact O-N 3.37Å; I364-S367 CarbonylContact O-C 3.52Å; I364-S367 WeakPolarHBondContact O-CA 3.43Å; I364-S367 WeakPolarHBondContact O-CB 3.49Å; I364-S367 PolarHBondContact O-N 2.87Å; I364-V368 WeakPolarHBondContact O-CG2 3.47Å; I364-V368 PolarHBondContact O-N 3.01Å
365	M	97.7	Very high	95.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56.1	-50.3	177.1	-178.1	64.3	102	0	0	111.6	S361 P362 S367 V368 L369 F380 I382 I396 V428 L466 F473	S361-M365 PolarHBondContact O-N 3.29Å; S361-M365 VanDerWaalsContact O-N 3.14Å; P362-M365 PolarHBondContact O-N 3.06Å; M365-S367 VanDerWaalsContact C-N 3.27Å; M365-S367 PolarHBondContact O-N 3.23Å; M365-V368 PolarHBondContact O-N 3.16Å; M365-V368 VanDerWaalsContact O-N 3.16Å; M365-L369 HydrophobicContact CG-CD1 4.3Å; M365-L369 WeakPolarHBondContact O-CG 3.32Å; M365-L369 PolarHBondContact O-N 2.84Å; M365-F380 HydrophobicContact CE-CZ 4.48Å; M365-F380 HydrophobicContact SD-CE1 3.6Å; M365-F380 HydrophobicContact SD-CZ 3.68Å; M365-I382 HydrophobicContact CE-CB 4.49Å; M365-I382 HydrophobicContact CE-CD1 3.94Å; M365-I382 HydrophobicContact CE-CG1 3.91Å; M365-I382 HydrophobicContact CE-CG2 3.83Å; M365-I382 HydrophobicContact SD-CD1 3.66Å; M365-I382 HydrophobicContact SD-CG1 4.04Å; M365-I396 HydrophobicContact CE-CD1 4.29Å; M365-V428 HydrophobicContact CE-CB 4.05Å; M365-V428 HydrophobicContact CE-CG1 3.71Å; M365-L466 HydrophobicContact CB-CD1 3.87Å; M365-L466 HydrophobicContact CE-CB 4.5Å; M365-L466 HydrophobicContact CE-CD1 4.33Å; M365-L466 HydrophobicContact CE-CD2 3.98Å; M365-L466 HydrophobicContact CG-CD1 4.32Å; M365-F473 HydrophobicContact CB-CD2 4.18Å; M365-F473 HydrophobicContact CB-CE2 3.81Å; M365-F473 HydrophobicContact CG-CD2 3.99Å; M365-F473 HydrophobicContact CG-CE2 3.47Å; M365-F473 VanDerWaalsContact CG-CE2 3.47Å; M365-F473 HydrophobicContact CG-CZ 4.18Å
366	A	96.9	Very high	95.8	Very high	11 Å²	11	49.1 Å²	49.1	9%	0.091	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-33.9	174.6	0	0	0	0	0	112.4	P362 I364 L369 N370 Y480	P362-A366 WeakPolarHBondContact O-CB 3.21Å; P362-A366 PolarHBondContact O-N 2.92Å; I364-A366 PolarHBondContact O-N 3.37Å; A366-L369 PolarHBondContact O-N 2.68Å; A366-N370 PolarHBondContact O-N 2.65Å; A366-N370 PolarHBondContact O-ND2 2.63Å; A366-Y480 HydrophobicContact CB-CD2 4.35Å; A366-Y480 HydrophobicContact CB-CE2 4.27Å
367	S	96.5	Very high	95.8	Very high	24 Å²	24	44.7 Å²	44.7	17%	0.168	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-32.4	175.1	-70.4	0	0	0	0	113.5	E363 I364 M365 K372	E363-S367 VanDerWaalsContact O-CB 3.22Å; E363-S367 WeakPolarHBondContact O-CB 3.45Å; E363-S367 PolarHBondContact O-N 3.11Å; E363-S367 PolarHBondContact O-OG 2.91Å; I364-S367 CarbonylContact O-C 3.52Å; I364-S367 WeakPolarHBondContact O-CA 3.43Å; I364-S367 WeakPolarHBondContact O-CB 3.49Å; I364-S367 PolarHBondContact O-N 2.87Å; M365-S367 VanDerWaalsContact C-N 3.27Å; M365-S367 PolarHBondContact O-N 3.23Å; S367-K372 WeakPolarHBondContact O-CB 3.35Å; S367-K372 WeakPolarHBondContact O-CG 3.45Å; S367-K372 PolarHBondContact O-N 3.43Å; S367-K372 PolarHBondContact OG-NZ 3.1Å
368	V	96.2	Very high	95.7	Very high	15 Å²	15	47.9 Å²	47.9	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-72.8	-44.3	172.6	-178.6	0	0	0	0	111	F347 I364 M365 N370 G371 F373 I377 F380	F347-V368 HydrophobicContact CE1-CG2 3.66Å; F347-V368 HydrophobicContact CE2-CG2 4.23Å; F347-V368 HydrophobicContact CZ-CG2 3.39Å; I364-V368 WeakPolarHBondContact O-CG2 3.47Å; I364-V368 PolarHBondContact O-N 3.01Å; M365-V368 PolarHBondContact O-N 3.16Å; M365-V368 VanDerWaalsContact O-N 3.16Å; V368-N370 PolarHBondContact O-N 3.08Å; V368-G371 WeakPolarHBondContact O-CA 3.48Å; V368-G371 PolarHBondContact O-N 3.27Å; V368-F373 HydrophobicContact CB-CD2 4.43Å; V368-F373 HydrophobicContact CG2-CD2 3.69Å; V368-F373 HydrophobicContact CG2-CE2 4.09Å; V368-F373 HydrophobicContact CG2-CG 4.5Å; V368-I377 HydrophobicContact CG1-CD1 4.18Å; V368-F380 HydrophobicContact CB-CD1 4.43Å; V368-F380 HydrophobicContact CB-CE1 4.07Å; V368-F380 HydrophobicContact CB-CE2 4.45Å; V368-F380 HydrophobicContact CB-CZ 4.08Å; V368-F380 HydrophobicContact CG1-CB 4.27Å; V368-F380 HydrophobicContact CG1-CD1 3.51Å; V368-F380 HydrophobicContact CG1-CD2 3.78Å; V368-F380 HydrophobicContact CG1-CE1 3.62Å; V368-F380 HydrophobicContact CG1-CE2 3.91Å; V368-F380 HydrophobicContact CG1-CG 3.57Å; V368-F380 HydrophobicContact CG1-CZ 3.82Å; V368-F380 HydrophobicContact CG2-CE2 4.32Å; V368-F380 HydrophobicContact CG2-CZ 4.24Å
369	L	95.6	Very high	95.5	Very high	56 Å²	56	50.1 Å²	50.1	29%	0.293	27%	0.269	S	S	.	.	H	α-helix	trans	-61.4	-27.5	176.4	-68.7	170.3	0	0	0	113.2	M365 A366 G371 I382 I396 F473 Y480	M365-L369 HydrophobicContact CG-CD1 4.3Å; M365-L369 WeakPolarHBondContact O-CG 3.32Å; M365-L369 PolarHBondContact O-N 2.84Å; A366-L369 PolarHBondContact O-N 2.68Å; L369-G371 PolarHBondContact O-N 3.12Å; L369-I382 HydrophobicContact CD2-CD1 3.98Å; L369-I396 HydrophobicContact CD1-CG2 3.71Å; L369-F473 HydrophobicContact CD1-CZ 4Å; L369-Y480 HydrophobicContact CB-CD1 4.04Å; L369-Y480 HydrophobicContact CB-CE1 4.49Å; L369-Y480 HydrophobicContact CD1-CD1 4.27Å; L369-Y480 HydrophobicContact CD1-CG 4.35Å
370	N	95.1	Very high	95.4	Very high	90 Å²	90	51.5 Å²	51.5	48%	0.481	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	8.3	170	-81.3	-76.5	0	0	0	114.3	A366 V368 K372 Y480	A366-N370 PolarHBondContact O-N 2.65Å; A366-N370 PolarHBondContact O-ND2 2.63Å; V368-N370 PolarHBondContact O-N 3.08Å; N370-K372 VanDerWaalsContact C-N 3.26Å; N370-K372 HydrophobicContact CB-CG 4.46Å; N370-K372 PolarHBondContact O-N 2.67Å; N370-Y480 WeakPolarHBondContact ND2-CE1 3.36Å; N370-Y480 VanDerWaalsContact ND2-CZ 3.31Å; N370-Y480 PolarHBondContact ND2-OH 2.95Å; N370-Y480 PolarHBondContact OD1-OH 3.06Å
371	G	94	Very high	95.4	Very high	40 Å²	40	52 Å²	52	41%	0.412	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	5.1	176	0	0	0	0	0	115.8	V368 L369 F373 A374	V368-G371 WeakPolarHBondContact O-CA 3.48Å; V368-G371 PolarHBondContact O-N 3.27Å; L369-G371 PolarHBondContact O-N 3.12Å; G371-F373 PolarHBondContact O-N 3.28Å; G371-A374 VanDerWaalsContact O-CB 3.31Å; G371-A374 WeakPolarHBondContact O-CB 3.15Å; G371-A374 PolarHBondContact O-N 3.34Å
372	K	95.3	Very high	95.4	Very high	142 Å²	142	51.4 Å²	51.4	62%	0.617	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.1	-176.4	-61.1	-174.8	-165.5	166.2	0	113.8	S367 N370	S367-K372 WeakPolarHBondContact O-CB 3.35Å; S367-K372 WeakPolarHBondContact O-CG 3.45Å; S367-K372 PolarHBondContact O-N 3.43Å; S367-K372 PolarHBondContact OG-NZ 3.1Å; N370-K372 VanDerWaalsContact C-N 3.26Å; N370-K372 HydrophobicContact CB-CG 4.46Å; N370-K372 PolarHBondContact O-N 2.67Å
373	F	94.1	Very high	95.5	Very high	53 Å²	53	51.4 Å²	51.4	23%	0.232	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	8.3	-177.7	-61.9	-86.2	0	0	0	114.3	L346 F347 V368 G371 N375 L376 I377	L346-F373 HydrophobicContact CD2-CD1 4.3Å; L346-F373 HydrophobicContact CG-CD1 4.49Å; F347-F373 HydrophobicContact CD1-CE1 4.25Å; F347-F373 HydrophobicContact CD1-CZ 4.18Å; F347-F373 HydrophobicContact CE1-CD1 4.03Å; F347-F373 HydrophobicContact CE1-CD2 4.05Å; F347-F373 HydrophobicContact CE1-CE1 4.07Å; F347-F373 HydrophobicContact CE1-CE2 4.07Å; F347-F373 HydrophobicContact CE1-CG 4.02Å; F347-F373 HydrophobicContact CE1-CZ 4.08Å; V368-F373 HydrophobicContact CB-CD2 4.43Å; V368-F373 HydrophobicContact CG2-CD2 3.69Å; V368-F373 HydrophobicContact CG2-CE2 4.09Å; V368-F373 HydrophobicContact CG2-CG 4.5Å; G371-F373 PolarHBondContact O-N 3.28Å; F373-N375 PolarHBondContact O-N 2.82Å; F373-L376 PolarHBondContact O-N 2.59Å; F373-I377 HydrophobicContact CB-CD1 3.54Å; F373-I377 HydrophobicContact CB-CG1 4.05Å; F373-I377 HydrophobicContact CG-CD1 4.39Å; F373-I377 PolarHBondContact O-N 2.72Å
374	A	91.9	Very high	95.6	Very high	56 Å²	56	46.7 Å²	46.7	46%	0.463	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.7	-176.1	0	0	0	0	0	114.6	G371 K423	G371-A374 VanDerWaalsContact O-CB 3.31Å; G371-A374 WeakPolarHBondContact O-CB 3.15Å; G371-A374 PolarHBondContact O-N 3.34Å; A374-K423 PolarHBondContact O-NZ 2.72Å
375	N	92.5	Very high	95.6	Very high	140 Å²	140	45.6 Å²	45.6	75%	0.749	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-26.7	173.9	-67.1	-20.3	0	0	0	113.2	F373 K423	F373-N375 PolarHBondContact O-N 2.82Å; N375-K423 VanDerWaalsContact O-CE 3.31Å; N375-K423 WeakPolarHBondContact O-CE 3.2Å
376	L	93	Very high	95.7	Very high	89 Å²	89	45.6 Å²	45.6	47%	0.466	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-27.2	-172.8	-59.4	177.3	0	0	0	113.1	L346 F373 K423 R424	L346-L376 HydrophobicContact CD1-CB 4.44Å; L346-L376 HydrophobicContact CD1-CD1 3.78Å; L346-L376 HydrophobicContact CD2-CB 4.4Å; F373-L376 PolarHBondContact O-N 2.59Å; L376-K423 WeakPolarHBondContact O-CA 3.46Å; L376-R424 PolarHBondContact O-N 3.38Å
377	I	93.9	Very high	95.7	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.056	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.9	-179.2	-51.9	173.4	0	0	0	108.9	L346 F347 V368 F373 E379 F380 R424 I426	L346-I377 HydrophobicContact CD2-CD1 3.8Å; L346-I377 HydrophobicContact CD2-CG1 3.58Å; F347-I377 HydrophobicContact CE1-CD1 4.23Å; F347-I377 HydrophobicContact CZ-CD1 3.71Å; V368-I377 HydrophobicContact CG1-CD1 4.18Å; F373-I377 HydrophobicContact CB-CD1 3.54Å; F373-I377 HydrophobicContact CB-CG1 4.05Å; F373-I377 HydrophobicContact CG-CD1 4.39Å; F373-I377 PolarHBondContact O-N 2.72Å; I377-E379 WeakPolarHBondContact CG2-O 3.35Å; I377-F380 HydrophobicContact CD1-CD2 4.39Å; I377-F380 HydrophobicContact CG2-CB 4.09Å; I377-R424 WeakPolarHBondContact CA-O 3.28Å; I377-I426 HydrophobicContact CD1-CD1 4.09Å; I377-I426 HydrophobicContact CG1-CD1 4.1Å
378	K	92.8	Very high	95.8	Very high	91 Å²	91	46.1 Å²	46.1	40%	0.396	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-51.7	170.4	178.8	65.8	169.2	-164.8	0	109.7	D421 K423 R424	K378-D421 WeakPolarHBondContact CD-OD2 3.2Å; K378-D421 WeakPolarHBondContact CE-OD2 3.49Å; K378-D421 IonicContact NZ-OD2 3.46Å; K378-D421 PolarHBondContact NZ-OD2 2.8Å; K378-K423 HydrophobicContact CB-CB 3.83Å; K378-K423 HydrophobicContact CB-CD 4.32Å; K378-R424 PolarHBondContact N-O 2.78Å
379	E	94.4	Very high	95.9	Very high	89 Å²	89	45.6 Å²	45.6	42%	0.416	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.1	-174.6	-163	59.7	-131.8	0	0	109.7	I377 V381 I417 V425 I426	I377-E379 WeakPolarHBondContact CG2-O 3.35Å; E379-V381 HydrophobicContact CG-CG2 3.97Å; E379-I417 HydrophobicContact CB-CG2 4.06Å; E379-I417 HydrophobicContact CG-CD1 4.3Å; E379-I417 HydrophobicContact CG-CG2 4.06Å; E379-V425 HydrophobicContact CB-CG1 4.32Å; E379-V425 HydrophobicContact CB-CG2 4.18Å; E379-I426 PolarHBondContact O-N 2.87Å; E379-I426 VanDerWaalsContact O-N 3.11Å
380	F	96.5	Very high	96	Very high	34 Å²	34	43 Å²	43	15%	0.149	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	99	-178.7	-176.4	-105.7	0	0	0	109.9	F347 M365 V368 I377 I382 I426 V428	F347-F380 AromaticContact CE2-CE2 3.96Å; F347-F380 HydrophobicContact CE2-CE2 3.96Å; F347-F380 HydrophobicContact CZ-CE2 4.19Å; M365-F380 HydrophobicContact CE-CZ 4.48Å; M365-F380 HydrophobicContact SD-CE1 3.6Å; M365-F380 HydrophobicContact SD-CZ 3.68Å; V368-F380 HydrophobicContact CB-CD1 4.43Å; V368-F380 HydrophobicContact CB-CE1 4.07Å; V368-F380 HydrophobicContact CB-CE2 4.45Å; V368-F380 HydrophobicContact CB-CZ 4.08Å; V368-F380 HydrophobicContact CG1-CB 4.27Å; V368-F380 HydrophobicContact CG1-CD1 3.51Å; V368-F380 HydrophobicContact CG1-CD2 3.78Å; V368-F380 HydrophobicContact CG1-CE1 3.62Å; V368-F380 HydrophobicContact CG1-CE2 3.91Å; V368-F380 HydrophobicContact CG1-CG 3.57Å; V368-F380 HydrophobicContact CG1-CZ 3.82Å; V368-F380 HydrophobicContact CG2-CE2 4.32Å; V368-F380 HydrophobicContact CG2-CZ 4.24Å; I377-F380 HydrophobicContact CD1-CD2 4.39Å; I377-F380 HydrophobicContact CG2-CB 4.09Å; F380-I382 HydrophobicContact CD1-CD1 4.33Å; F380-I382 HydrophobicContact CD1-CG1 3.98Å; F380-I382 HydrophobicContact CE1-CD1 3.85Å; F380-I382 HydrophobicContact CE1-CG1 3.59Å; F380-I382 HydrophobicContact CZ-CG1 4.42Å; F380-I426 WeakPolarHBondContact CA-O 3.44Å; F380-I426 HydrophobicContact CD2-CB 4.1Å; F380-I426 HydrophobicContact CD2-CG2 4.13Å; F380-I426 HydrophobicContact CE2-CG2 4.08Å; F380-V428 HydrophobicContact CE2-CG2 3.5Å; F380-V428 HydrophobicContact CZ-CB 4.46Å; F380-V428 HydrophobicContact CZ-CG2 3.53Å
381	V	97.8	Very high	96.2	Very high	10 Å²	10	40.7 Å²	40.7	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.7	-171.3	-174.8	0	0	0	0	109.8	E379 I383 F411 L412 I417 I426 V427 V428	E379-V381 HydrophobicContact CG-CG2 3.97Å; V381-I383 HydrophobicContact CG1-CD1 3.44Å; V381-I383 VanDerWaalsContact CG1-CD1 3.44Å; V381-I383 HydrophobicContact CG1-CG1 4.02Å; V381-F411 HydrophobicContact CG1-CE1 4.02Å; V381-L412 HydrophobicContact CG1-CD2 4.49Å; V381-I417 HydrophobicContact CG2-CD1 3.92Å; V381-I426 PolarHBondContact N-O 3.35Å; V381-V427 HydrophobicContact CB-CB 4.5Å; V381-V427 HydrophobicContact CB-CG1 4.21Å; V381-V427 HydrophobicContact CB-CG2 4.2Å; V381-V427 HydrophobicContact CG1-CG1 4.35Å; V381-V427 CarbonylContact O-C 3.57Å; V381-V427 WeakPolarHBondContact O-CA 3.28Å; V381-V428 PolarHBondContact O-N 2.81Å
382	I	98.6	Very high	96.4	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.8	173.7	-52.9	171.7	0	0	0	108.3	M365 L369 F380 I396 A399 V400	M365-I382 HydrophobicContact CE-CB 4.49Å; M365-I382 HydrophobicContact CE-CD1 3.94Å; M365-I382 HydrophobicContact CE-CG1 3.91Å; M365-I382 HydrophobicContact CE-CG2 3.83Å; M365-I382 HydrophobicContact SD-CD1 3.66Å; M365-I382 HydrophobicContact SD-CG1 4.04Å; L369-I382 HydrophobicContact CD2-CD1 3.98Å; F380-I382 HydrophobicContact CD1-CD1 4.33Å; F380-I382 HydrophobicContact CD1-CG1 3.98Å; F380-I382 HydrophobicContact CE1-CD1 3.85Å; F380-I382 HydrophobicContact CE1-CG1 3.59Å; F380-I382 HydrophobicContact CZ-CG1 4.42Å; I382-I396 HydrophobicContact CD1-CG2 3.95Å; I382-I396 HydrophobicContact CG2-CD1 4.46Å; I382-A399 HydrophobicContact CB-CB 3.96Å; I382-A399 HydrophobicContact CG2-CB 3.77Å; I382-A399 CarbonylContact O-C 3.57Å; I382-A399 VanDerWaalsContact O-CA 3.28Å; I382-A399 WeakPolarHBondContact O-CA 3.1Å; I382-V400 PolarHBondContact O-N 3.09Å
383	I	98.7	Very high	96.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	112.1	178.5	-57.2	-53.7	0	0	0	110.1	V381 C385 V400 L402 F411 V427 V428 F429 H430	V381-I383 HydrophobicContact CG1-CD1 3.44Å; V381-I383 VanDerWaalsContact CG1-CD1 3.44Å; V381-I383 HydrophobicContact CG1-CG1 4.02Å; I383-C385 PolarHBondContact O-N 2.88Å; I383-V400 HydrophobicContact CD1-CB 4.22Å; I383-L402 HydrophobicContact CD1-CD1 3.66Å; I383-L402 HydrophobicContact CD1-CG 4.39Å; I383-L402 HydrophobicContact CG2-CB 4.08Å; I383-L402 HydrophobicContact CG2-CD1 4.39Å; I383-F411 HydrophobicContact CD1-CE1 4.35Å; I383-V427 HydrophobicContact CG1-CG1 3.83Å; I383-V428 PolarHBondContact N-O 3.41Å; I383-F429 HydrophobicContact CB-CD1 3.72Å; I383-F429 HydrophobicContact CB-CE1 3.94Å; I383-F429 HydrophobicContact CG1-CD1 4.28Å; I383-F429 HydrophobicContact CG1-CE1 4Å; I383-F429 HydrophobicContact CG2-CD1 3.87Å; I383-F429 HydrophobicContact CG2-CE1 4.02Å; I383-H430 PolarHBondContact O-N 2.9Å
384	D	98.8	Very high	96.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	106.3	172.6	-165.1	-15.2	0	0	0	109.9	R386 Y391 V400 N401 L402 H430	D384-R386 PolarHBondContact O-N 2.72Å; D384-R386 VanDerWaalsContact OD1-CB 3.25Å; D384-R386 WeakPolarHBondContact OD1-CB 3.31Å; D384-R386 WeakPolarHBondContact OD1-CG 3.48Å; D384-R386 PolarHBondContact OD1-N 2.71Å; D384-R386 VanDerWaalsContact OD1-N 3.08Å; D384-R386 IonicContact OD1-NE 3.81Å; D384-R386 PolarHBondContact OD1-NE 2.82Å; D384-R386 VanDerWaalsContact OD1-NE 3.11Å; D384-R386 IonicContact OD2-CZ 2.71Å; D384-R386 VanDerWaalsContact OD2-CZ 3.23Å; D384-R386 IonicContact OD2-NE 2.85Å; D384-R386 PolarHBondContact OD2-NE 3.44Å; D384-R386 IonicContact OD2-NH2 3.55Å; D384-R386 PolarHBondContact OD2-NH2 2.9Å; D384-Y391 HydrophobicContact CB-CD2 3.91Å; D384-Y391 HydrophobicContact CB-CE2 4.29Å; D384-V400 PolarHBondContact N-O 2.98Å; D384-N401 PolarHBondContact O-ND2 3Å; D384-L402 PolarHBondContact O-N 3.37Å; D384-H430 IonicContact OD1-CE1 2.72Å; D384-H430 PolarHBondContact OD1-CE1 2.82Å; D384-H430 IonicContact OD1-ND1 2.72Å; D384-H430 IonicContact OD2-CE1 2.63Å; D384-H430 PolarHBondContact OD2-CE1 3.38Å; D384-H430 IonicContact OD2-NE2 2.82Å
385	C	98.4	Very high	97	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.034	17%	0.168	C	C	.	.			trans	-86.4	21.6	-179.6	-50.3	0	0	0	0	112.5	I383 H430 C431 R437 M441	I383-C385 PolarHBondContact O-N 2.88Å; C385-H430 VanDerWaalsContact CB-O 3.25Å; C385-H430 WeakPolarHBondContact CB-O 3.23Å; C385-H430 PolarHBondContact N-O 2.66Å; C385-H430 PolarHBondContact SG-O 2.82Å; C385-C431 HydrophobicContact CB-CB 4.38Å; C385-R437 HydrophobicContact CB-CB 4.33Å; C385-M441 VanDerWaalsContact SG-CB 3.6Å
386	R	98.3	Very high	97.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-80.1	168.4	169.6	-72	-176.2	-61.8	150.9	3.1	111.8	D384 E390 G394 N401 H403 C431 E432	D384-R386 PolarHBondContact O-N 2.72Å; D384-R386 VanDerWaalsContact OD1-CB 3.25Å; D384-R386 WeakPolarHBondContact OD1-CB 3.31Å; D384-R386 WeakPolarHBondContact OD1-CG 3.48Å; D384-R386 PolarHBondContact OD1-N 2.71Å; D384-R386 VanDerWaalsContact OD1-N 3.08Å; D384-R386 IonicContact OD1-NE 3.81Å; D384-R386 PolarHBondContact OD1-NE 2.82Å; D384-R386 VanDerWaalsContact OD1-NE 3.11Å; D384-R386 IonicContact OD2-CZ 2.71Å; D384-R386 VanDerWaalsContact OD2-CZ 3.23Å; D384-R386 IonicContact OD2-NE 2.85Å; D384-R386 PolarHBondContact OD2-NE 3.44Å; D384-R386 IonicContact OD2-NH2 3.55Å; D384-R386 PolarHBondContact OD2-NH2 2.9Å; R386-E390 HydrophobicContact CB-CB 3.9Å; R386-E390 HydrophobicContact CB-CG 4.44Å; R386-E390 VanDerWaalsContact CD-OE1 3.32Å; R386-E390 WeakPolarHBondContact CD-OE1 3.49Å; R386-E390 HydrophobicContact CG-CB 4.38Å; R386-E390 WeakPolarHBondContact CG-OE1 3.42Å; R386-E390 PolarHBondContact NH1-O 3.43Å; R386-G394 PolarHBondContact NH1-O 3.31Å; R386-G394 PolarHBondContact NH2-O 3.36Å; R386-N401 PolarHBondContact O-ND2 2.86Å; R386-H403 VanDerWaalsContact O-CB 3.22Å; R386-H403 WeakPolarHBondContact O-CB 3.2Å; R386-C431 HydrophobicContact CG-CB 3.99Å; R386-E432 HydrophobicContact CG-CB 4.34Å
387	Y	97.9	Very high	97.5	Very high	22 Å²	22	27.6 Å²	27.6	9%	0.086	13%	0.128	C	C	.	.			trans	-73	152.1	171.1	-60.2	-50	0	0	0	111.1	Y389 E390 Y391 H403 M489 L498 F501	Y387-Y389 VanDerWaalsContact C-N 3.29Å; Y387-Y389 VanDerWaalsContact CB-CE1 3.41Å; Y387-Y389 AromaticContact CD2-CE1 3.74Å; Y387-Y389 HydrophobicContact CD2-CE1 3.74Å; Y387-Y389 AromaticContact CG-CE1 3.95Å; Y387-Y389 HydrophobicContact CG-CE1 3.95Å; Y387-Y389 PolarHBondContact O-N 3.48Å; Y387-Y389 VanDerWaalsContact O-N 3.15Å; Y387-E390 WeakPolarHBondContact CB-OE2 3.44Å; Y387-E390 WeakPolarHBondContact CD2-OE2 3.21Å; Y387-E390 PolarHBondContact N-OE2 2.96Å; Y387-E390 WeakPolarHBondContact O-CB 3.5Å; Y387-E390 PolarHBondContact O-N 2.74Å; Y387-Y391 PolarHBondContact O-N 3.23Å; Y387-H403 AromaticContact CD1-CD2 3.99Å; Y387-M489 HydrophobicContact CE2-CE 4.17Å; Y387-M489 HydrophobicContact CE2-CG 4.5Å; Y387-L498 HydrophobicContact CD2-CD1 4.26Å; Y387-L498 HydrophobicContact CE2-CD1 3.74Å; Y387-F501 HydrophobicContact CD1-CB 3.63Å; Y387-F501 HydrophobicContact CD1-CD1 4.42Å; Y387-F501 HydrophobicContact CD1-CG 4.01Å; Y387-F501 HydrophobicContact CD2-CB 4.4Å; Y387-F501 HydrophobicContact CE1-CB 3.71Å; Y387-F501 HydrophobicContact CE2-CB 4.46Å; Y387-F501 HydrophobicContact CG-CB 3.98Å; Y387-F501 HydrophobicContact CG-CD2 4.4Å; Y387-F501 HydrophobicContact CG-CG 4.21Å
388	P	97.8	Very high	97.7	Very high	24 Å²	24	30.3 Å²	30.3	16%	0.156	16%	0.158	C	C	.	.	H	α-helix	trans	-48.9	-44	-177.2	-32.5	35.9	0	0	0	114.5	E390 Y391 E392 N401 F501	P388-E390 VanDerWaalsContact C-N 3.31Å; P388-E390 PolarHBondContact O-N 3.32Å; P388-Y391 WeakPolarHBondContact O-CB 3.41Å; P388-Y391 PolarHBondContact O-N 3.19Å; P388-E392 WeakPolarHBondContact O-CB 3.48Å; P388-E392 VanDerWaalsContact O-CG 3.27Å; P388-E392 WeakPolarHBondContact O-CG 3.16Å; P388-E392 PolarHBondContact O-N 3.39Å; P388-N401 WeakPolarHBondContact CA-OD1 3.33Å; P388-F501 HydrophobicContact CB-CZ 4.1Å; P388-F501 HydrophobicContact CG-CE1 3.8Å; P388-F501 HydrophobicContact CG-CZ 3.69Å
389	Y	97.8	Very high	97.9	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-36.2	179.2	70.1	-89.4	0	0	0	113.2	Y387 G393 R487 M489 F494 D497 F501	Y387-Y389 VanDerWaalsContact C-N 3.29Å; Y387-Y389 VanDerWaalsContact CB-CE1 3.41Å; Y387-Y389 AromaticContact CD2-CE1 3.74Å; Y387-Y389 HydrophobicContact CD2-CE1 3.74Å; Y387-Y389 AromaticContact CG-CE1 3.95Å; Y387-Y389 HydrophobicContact CG-CE1 3.95Å; Y387-Y389 PolarHBondContact O-N 3.48Å; Y387-Y389 VanDerWaalsContact O-N 3.15Å; Y389-G393 PolarHBondContact O-N 2.89Å; Y389-G393 VanDerWaalsContact O-N 3.09Å; Y389-R487 WeakPolarHBondContact O-CD 3.12Å; Y389-R487 PolarHBondContact O-NH1 2.98Å; Y389-M489 PolarHBondContact OH-O 2.8Å; Y389-F494 HydrophobicContact CD2-CB 3.51Å; Y389-F494 AromaticContact CD2-CD1 3.91Å; Y389-F494 HydrophobicContact CD2-CD1 3.91Å; Y389-F494 HydrophobicContact CD2-CD2 4.41Å; Y389-F494 AromaticContact CD2-CG 3.67Å; Y389-F494 HydrophobicContact CD2-CG 3.67Å; Y389-F494 HydrophobicContact CE2-CB 3.71Å; Y389-F494 HydrophobicContact CE2-CG 4.36Å; Y389-F494 HydrophobicContact CG-CB 4.11Å; Y389-F494 AromaticContact CG-CD1 3.88Å; Y389-F494 HydrophobicContact CG-CD1 3.88Å; Y389-F494 HydrophobicContact CG-CG 4.12Å; Y389-D497 HydrophobicContact CD1-CB 4Å; Y389-D497 HydrophobicContact CE1-CB 4.38Å; Y389-F501 AromaticContact CD1-CD2 3.89Å; Y389-F501 HydrophobicContact CD1-CD2 3.89Å; Y389-F501 AromaticContact CD1-CE2 3.89Å; Y389-F501 HydrophobicContact CD1-CE2 3.89Å; Y389-F501 AromaticContact CE1-CD2 3.99Å; Y389-F501 HydrophobicContact CE1-CD2 3.99Å; Y389-F501 HydrophobicContact CE1-CE2 4.46Å
390	E	98.5	Very high	98.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-69	-37.2	176.4	-60.7	167.3	75.8	0	0	111.4	R386 Y387 P388 G393 R437	R386-E390 HydrophobicContact CB-CB 3.9Å; R386-E390 HydrophobicContact CB-CG 4.44Å; R386-E390 VanDerWaalsContact CD-OE1 3.32Å; R386-E390 WeakPolarHBondContact CD-OE1 3.49Å; R386-E390 HydrophobicContact CG-CB 4.38Å; R386-E390 WeakPolarHBondContact CG-OE1 3.42Å; R386-E390 PolarHBondContact NH1-O 3.43Å; Y387-E390 WeakPolarHBondContact CB-OE2 3.44Å; Y387-E390 WeakPolarHBondContact CD2-OE2 3.21Å; Y387-E390 PolarHBondContact N-OE2 2.96Å; Y387-E390 WeakPolarHBondContact O-CB 3.5Å; Y387-E390 PolarHBondContact O-N 2.74Å; P388-E390 VanDerWaalsContact C-N 3.31Å; P388-E390 PolarHBondContact O-N 3.32Å; E390-G393 PolarHBondContact O-N 2.96Å; E390-R437 IonicContact OE1-CZ 3.11Å; E390-R437 IonicContact OE1-NH1 3.04Å; E390-R437 PolarHBondContact OE1-NH1 2.96Å; E390-R437 IonicContact OE1-NH2 2.77Å; E390-R437 PolarHBondContact OE1-NH2 3.15Å; E390-R437 IonicContact OE2-CZ 2.96Å; E390-R437 IonicContact OE2-NH1 2.98Å; E390-R437 PolarHBondContact OE2-NH1 3.28Å; E390-R437 IonicContact OE2-NH2 3.6Å; E390-R437 PolarHBondContact OE2-NH2 2.96Å
391	Y	98.6	Very high	98.2	Very high	43 Å²	43	24.2 Å²	24.2	17%	0.169	14%	0.137	C	C	.	.	H	α-helix	trans	-71.1	-46.1	179.5	174.5	-86.6	0	0	0	111.9	D384 Y387 P388 G393 G394 H395 A399 N401	D384-Y391 HydrophobicContact CB-CD2 3.91Å; D384-Y391 HydrophobicContact CB-CE2 4.29Å; Y387-Y391 PolarHBondContact O-N 3.23Å; P388-Y391 WeakPolarHBondContact O-CB 3.41Å; P388-Y391 PolarHBondContact O-N 3.19Å; Y391-G393 PolarHBondContact O-N 3.47Å; Y391-G394 CarbonylContact O-C 3.56Å; Y391-G394 VanDerWaalsContact O-C 3.22Å; Y391-G394 WeakPolarHBondContact O-CA 3.43Å; Y391-G394 PolarHBondContact O-N 2.98Å; Y391-H395 HydrophobicContact CD1-CB 4.48Å; Y391-H395 AromaticContact CD1-ND1 3.62Å; Y391-H395 HydrophobicContact CD2-CB 3.27Å; Y391-H395 AromaticContact CD2-CG 3.59Å; Y391-H395 AromaticContact CD2-ND1 3.97Å; Y391-H395 AromaticContact CE1-CE1 3.53Å; Y391-H395 AromaticContact CE1-CG 3.81Å; Y391-H395 AromaticContact CE1-ND1 3.44Å; Y391-H395 WeakPolarHBondContact CE1-ND1 3.23Å; Y391-H395 AromaticContact CE1-NE2 3.91Å; Y391-H395 HydrophobicContact CE2-CB 3.4Å; Y391-H395 AromaticContact CE2-CD2 3.53Å; Y391-H395 AromaticContact CE2-CG 3.31Å; Y391-H395 AromaticContact CE2-ND1 3.84Å; Y391-H395 HydrophobicContact CG-CB 3.87Å; Y391-H395 AromaticContact CG-CG 3.97Å; Y391-H395 AromaticContact CG-ND1 3.87Å; Y391-H395 AromaticContact CZ-CD2 3.38Å; Y391-H395 AromaticContact CZ-CE1 3.66Å; Y391-H395 AromaticContact CZ-CG 3.41Å; Y391-H395 VanDerWaalsContact CZ-CG 3.41Å; Y391-H395 AromaticContact CZ-ND1 3.55Å; Y391-H395 AromaticContact CZ-NE2 3.56Å; Y391-H395 PolarHBondContact O-N 2.99Å; Y391-H395 PolarHBondContact O-ND1 2.92Å; Y391-H395 PolarHBondContact OH-CD2 2.88Å; Y391-H395 PolarHBondContact OH-NE2 3.04Å; Y391-A399 HydrophobicContact CE2-CB 4.35Å; Y391-A399 PolarHBondContact OH-O 2.85Å; Y391-N401 HydrophobicContact CD1-CB 3.92Å; Y391-N401 HydrophobicContact CD2-CB 3.58Å; Y391-N401 HydrophobicContact CE1-CB 4.12Å; Y391-N401 HydrophobicContact CE2-CB 3.76Å; Y391-N401 HydrophobicContact CG-CB 3.66Å
392	E	98.3	Very high	98.2	Very high	124 Å²	124	24.5 Å²	24.5	58%	0.579	14%	0.138	S	C	*	.	H	α-helix	trans	-59.2	-32.7	171.3	-69.2	160.7	-160.4	0	0	111.9	P388 G394 P483	P388-E392 WeakPolarHBondContact O-CB 3.48Å; P388-E392 VanDerWaalsContact O-CG 3.27Å; P388-E392 WeakPolarHBondContact O-CG 3.16Å; P388-E392 PolarHBondContact O-N 3.39Å; E392-G394 PolarHBondContact O-N 2.84Å; E392-P483 WeakPolarHBondContact O-CG 3.36Å
393	G	97.9	Very high	98	Very high	4 Å²	4	25.8 Å²	25.8	4%	0.041	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	4.4	172.8	0	0	0	0	0	115.3	Y389 E390 Y391 S485 R487	Y389-G393 PolarHBondContact O-N 2.89Å; Y389-G393 VanDerWaalsContact O-N 3.09Å; E390-G393 PolarHBondContact O-N 2.96Å; Y391-G393 PolarHBondContact O-N 3.47Å; G393-S485 CarbonylContact O-C 3.22Å; G393-S485 PolarHBondContact O-OG 3.19Å; G393-R487 PolarHBondContact O-N 3.12Å
394	G	98.4	Very high	97.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.15	C	C	.	.			trans	127.2	124.8	178.7	0	0	0	0	0	111.6	R386 Y391 E392 Y470 P483	R386-G394 PolarHBondContact NH1-O 3.31Å; R386-G394 PolarHBondContact NH2-O 3.36Å; Y391-G394 CarbonylContact O-C 3.56Å; Y391-G394 VanDerWaalsContact O-C 3.22Å; Y391-G394 WeakPolarHBondContact O-CA 3.43Å; Y391-G394 PolarHBondContact O-N 2.98Å; E392-G394 PolarHBondContact O-N 2.84Å; G394-Y470 VanDerWaalsContact C-CZ 3.43Å; G394-Y470 VanDerWaalsContact C-OH 3.23Å; G394-Y470 WeakPolarHBondContact O-CE1 3.33Å; G394-Y470 PolarHBondContact O-OH 2.87Å; G394-P483 WeakPolarHBondContact CA-O 3.46Å
395	H	98.8	Very high	97.5	Very high	33 Å²	33	28.6 Å²	28.6	15%	0.153	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	174.9	178.5	55.4	-88.4	0	0	0	111.7	Y391 Y470 C481 E482	Y391-H395 HydrophobicContact CD1-CB 4.48Å; Y391-H395 AromaticContact CD1-ND1 3.62Å; Y391-H395 HydrophobicContact CD2-CB 3.27Å; Y391-H395 AromaticContact CD2-CG 3.59Å; Y391-H395 AromaticContact CD2-ND1 3.97Å; Y391-H395 AromaticContact CE1-CE1 3.53Å; Y391-H395 AromaticContact CE1-CG 3.81Å; Y391-H395 AromaticContact CE1-ND1 3.44Å; Y391-H395 WeakPolarHBondContact CE1-ND1 3.23Å; Y391-H395 AromaticContact CE1-NE2 3.91Å; Y391-H395 HydrophobicContact CE2-CB 3.4Å; Y391-H395 AromaticContact CE2-CD2 3.53Å; Y391-H395 AromaticContact CE2-CG 3.31Å; Y391-H395 AromaticContact CE2-ND1 3.84Å; Y391-H395 HydrophobicContact CG-CB 3.87Å; Y391-H395 AromaticContact CG-CG 3.97Å; Y391-H395 AromaticContact CG-ND1 3.87Å; Y391-H395 AromaticContact CZ-CD2 3.38Å; Y391-H395 AromaticContact CZ-CE1 3.66Å; Y391-H395 AromaticContact CZ-CG 3.41Å; Y391-H395 VanDerWaalsContact CZ-CG 3.41Å; Y391-H395 AromaticContact CZ-ND1 3.55Å; Y391-H395 AromaticContact CZ-NE2 3.56Å; Y391-H395 PolarHBondContact O-N 2.99Å; Y391-H395 PolarHBondContact O-ND1 2.92Å; Y391-H395 PolarHBondContact OH-CD2 2.88Å; Y391-H395 PolarHBondContact OH-NE2 3.04Å; H395-Y470 PolarHBondContact N-OH 3.14Å; H395-C481 CarbonylContact O-C 3.55Å; H395-C481 WeakPolarHBondContact O-CA 3.38Å; H395-E482 PolarHBondContact CE1-O 3.27Å; H395-E482 PolarHBondContact N-O 2.87Å; H395-E482 PolarHBondContact ND1-O 3.28Å; H395-E482 PolarHBondContact O-N 3.03Å
396	I	98.6	Very high	97.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	133.7	175.9	-50.9	-175.3	0	0	0	108.9	M365 L369 I382 G398 A399 L466 Y470 F473	M365-I396 HydrophobicContact CE-CD1 4.29Å; L369-I396 HydrophobicContact CD1-CG2 3.71Å; I382-I396 HydrophobicContact CD1-CG2 3.95Å; I382-I396 HydrophobicContact CG2-CD1 4.46Å; I396-G398 PolarHBondContact O-N 3.42Å; I396-A399 HydrophobicContact CB-CB 4.28Å; I396-A399 WeakPolarHBondContact O-CB 3.5Å; I396-A399 PolarHBondContact O-N 2.8Å; I396-L466 HydrophobicContact CD1-CD2 3.58Å; I396-Y470 HydrophobicContact CD1-CD2 4.44Å; I396-Y470 HydrophobicContact CG1-CD2 3.68Å; I396-Y470 HydrophobicContact CG1-CE2 3.96Å; I396-F473 HydrophobicContact CB-CE1 4.29Å; I396-F473 HydrophobicContact CD1-CB 4.45Å; I396-F473 HydrophobicContact CD1-CD1 3.73Å; I396-F473 HydrophobicContact CD1-CD2 4.24Å; I396-F473 HydrophobicContact CD1-CE1 3.98Å; I396-F473 HydrophobicContact CD1-CE2 4.48Å; I396-F473 HydrophobicContact CD1-CG 3.86Å; I396-F473 HydrophobicContact CD1-CZ 4.35Å; I396-F473 HydrophobicContact CG1-CD1 3.71Å; I396-F473 HydrophobicContact CG1-CE1 3.81Å; I396-F473 HydrophobicContact CG1-CG 4.36Å; I396-F473 HydrophobicContact CG2-CE1 3.78Å; I396-F473 HydrophobicContact CG2-CZ 3.9Å
397	K	97.8	Very high	97.1	Very high	84 Å²	84	36 Å²	36	37%	0.365	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	127.3	177.9	-75.6	174.4	179.4	164.4	0	111.3	A399 S479 Y480 C481 E482	K397-A399 VanDerWaalsContact C-N 3.32Å; K397-S479 PolarHBondContact NZ-O 3.19Å; K397-Y480 WeakPolarHBondContact CB-O 3.47Å; K397-Y480 WeakPolarHBondContact CG-O 3.45Å; K397-Y480 PolarHBondContact N-O 3.38Å; K397-C481 VanDerWaalsContact CE-O 3.26Å; K397-C481 WeakPolarHBondContact CE-O 3.48Å; K397-E482 WeakPolarHBondContact CE-OE2 3.4Å; K397-E482 HydrophobicContact CG-CB 3.79Å
398	G	96.4	Very high	96.9	Very high	67 Å²	67	35 Å²	35	69%	0.691	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.6	5.9	-176.1	0	0	0	0	0	115	I396	I396-G398 PolarHBondContact O-N 3.42Å
399	A	98.3	Very high	96.7	Very high	9 Å²	9	36.1 Å²	36.1	7%	0.074	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	157.3	167.9	0	0	0	0	0	112.1	I382 Y391 I396 K397	I382-A399 HydrophobicContact CB-CB 3.96Å; I382-A399 HydrophobicContact CG2-CB 3.77Å; I382-A399 CarbonylContact O-C 3.57Å; I382-A399 VanDerWaalsContact O-CA 3.28Å; I382-A399 WeakPolarHBondContact O-CA 3.1Å; Y391-A399 HydrophobicContact CE2-CB 4.35Å; Y391-A399 PolarHBondContact OH-O 2.85Å; I396-A399 HydrophobicContact CB-CB 4.28Å; I396-A399 WeakPolarHBondContact O-CB 3.5Å; I396-A399 PolarHBondContact O-N 2.8Å; K397-A399 VanDerWaalsContact C-N 3.32Å
400	V	98.2	Very high	96.6	Very high	46 Å²	46	40.3 Å²	40.3	28%	0.279	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.3	172.1	-171.2	0	0	0	0	107.9	I382 I383 D384 L402 F411	I382-V400 PolarHBondContact O-N 3.09Å; I383-V400 HydrophobicContact CD1-CB 4.22Å; D384-V400 PolarHBondContact N-O 2.98Å; V400-L402 HydrophobicContact CG1-CD1 4.37Å; V400-L402 HydrophobicContact CG1-CD2 3.88Å; V400-L402 HydrophobicContact CG1-CG 3.91Å; V400-L402 PolarHBondContact O-N 3.4Å; V400-F411 HydrophobicContact CG1-CE2 4.48Å; V400-F411 HydrophobicContact CG1-CZ 4.49Å; V400-F411 HydrophobicContact CG2-CZ 4.12Å
401	N	98.4	Very high	96.4	Very high	32 Å²	32	44.5 Å²	44.5	17%	0.171	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	110.4	174	-172.4	-137.7	0	0	0	110.2	D384 R386 P388 Y391	D384-N401 PolarHBondContact O-ND2 3Å; R386-N401 PolarHBondContact O-ND2 2.86Å; P388-N401 WeakPolarHBondContact CA-OD1 3.33Å; Y391-N401 HydrophobicContact CD1-CB 3.92Å; Y391-N401 HydrophobicContact CD2-CB 3.58Å; Y391-N401 HydrophobicContact CE1-CB 4.12Å; Y391-N401 HydrophobicContact CE2-CB 3.76Å; Y391-N401 HydrophobicContact CG-CB 3.66Å
402	L	97.3	Very high	96.2	Very high	16 Å²	16	42.4 Å²	42.4	8%	0.084	22%	0.224	C	C	.	.			trans	-130.3	101.6	173	-53.4	174.6	0	0	0	106.9	I383 D384 V400 E407 V408 F411	I383-L402 HydrophobicContact CD1-CD1 3.66Å; I383-L402 HydrophobicContact CD1-CG 4.39Å; I383-L402 HydrophobicContact CG2-CB 4.08Å; I383-L402 HydrophobicContact CG2-CD1 4.39Å; D384-L402 PolarHBondContact O-N 3.37Å; V400-L402 HydrophobicContact CG1-CD1 4.37Å; V400-L402 HydrophobicContact CG1-CD2 3.88Å; V400-L402 HydrophobicContact CG1-CG 3.91Å; V400-L402 PolarHBondContact O-N 3.4Å; L402-E407 HydrophobicContact CB-CB 4.29Å; L402-E407 HydrophobicContact CD2-CB 4.04Å; L402-V408 HydrophobicContact CB-CG2 3.4Å; L402-V408 HydrophobicContact CD1-CB 4.5Å; L402-V408 HydrophobicContact CD1-CG2 4.06Å; L402-V408 HydrophobicContact CG-CG2 4.37Å; L402-F411 HydrophobicContact CD1-CB 3.73Å; L402-F411 HydrophobicContact CD1-CD1 3.63Å; L402-F411 HydrophobicContact CD1-CE1 4.42Å; L402-F411 HydrophobicContact CD1-CG 3.76Å; L402-F411 HydrophobicContact CD2-CB 4.38Å
403	H	95.1	Very high	96	Very high	29 Å²	29	37.8 Å²	37.8	13%	0.134	20%	0.203	C	C	.	.			trans	-101.5	-20.3	-168.7	76.1	-60	0	0	0	113	R386 Y387 E407 F501	R386-H403 VanDerWaalsContact O-CB 3.22Å; R386-H403 WeakPolarHBondContact O-CB 3.2Å; Y387-H403 AromaticContact CD1-CD2 3.99Å; H403-E407 IonicContact CE1-OE1 2.67Å; H403-E407 PolarHBondContact CE1-OE1 2.87Å; H403-E407 IonicContact CE1-OE2 3.42Å; H403-E407 IonicContact CG-OE2 2.68Å; H403-E407 PolarHBondContact N-OE2 2.76Å; H403-E407 VanDerWaalsContact ND1-CD 3.3Å; H403-E407 IonicContact ND1-OE1 3.5Å; H403-E407 PolarHBondContact ND1-OE1 2.75Å; H403-E407 IonicContact ND1-OE2 2.75Å; H403-E407 PolarHBondContact ND1-OE2 3.38Å; H403-F501 AromaticContact CD2-CD1 3.82Å; H403-F501 AromaticContact NE2-CD1 3.4Å; H403-F501 WeakPolarHBondContact NE2-CD1 3.39Å; H403-F501 AromaticContact NE2-CE1 3.46Å; H403-F501 WeakPolarHBondContact NE2-CE1 3.41Å
404	M	94.2	Very high	95.7	Very high	26 Å²	26	43.7 Å²	43.7	13%	0.128	23%	0.227	C	C	.	.	S	Bend	trans	-108.6	147.8	175.2	-60.3	-64.6	-174.6	0	0	111.4	E406 E407 V408 K504 S505	M404-E406 PolarHBondContact O-N 2.72Å; M404-E407 HydrophobicContact CB-CG 4.04Å; M404-E407 PolarHBondContact N-OE2 3.48Å; M404-E407 WeakPolarHBondContact O-CB 3.26Å; M404-E407 PolarHBondContact O-N 2.92Å; M404-V408 PolarHBondContact O-N 3.12Å; M404-K504 HydrophobicContact CE-CB 3.67Å; M404-S505 WeakPolarHBondContact CE-OG 3.49Å; M404-S505 PolarHBondContact SD-OG 2.88Å
405	E	93.1	Very high	95.2	Very high	33 Å²	33	49.7 Å²	49.7	15%	0.154	26%	0.26	C	S	.	.	H	α-helix	trans	-57.2	-34.7	179.5	-72.9	169.4	-176.6	0	0	113	E409 R440 M441 Y444 K512	E405-E409 WeakPolarHBondContact O-CB 3.32Å; E405-E409 PolarHBondContact O-N 3.06Å; E405-E409 VanDerWaalsContact O-N 3.08Å; E405-R440 IonicContact OE1-CZ 3.69Å; E405-R440 IonicContact OE1-NE 2.8Å; E405-R440 PolarHBondContact OE1-NE 2.88Å; E405-R440 IonicContact OE1-NH2 3.4Å; E405-R440 PolarHBondContact OE1-NH2 2.79Å; E405-M441 HydrophobicContact CG-CE 4.41Å; E405-M441 HydrophobicContact CG-SD 4.18Å; E405-Y444 HydrophobicContact CB-CD1 4.09Å; E405-Y444 HydrophobicContact CB-CD2 4.43Å; E405-Y444 HydrophobicContact CB-CE1 3.71Å; E405-Y444 HydrophobicContact CB-CE2 4.06Å; E405-Y444 HydrophobicContact CB-CG 4.45Å; E405-Y444 HydrophobicContact CG-CD1 4.1Å; E405-Y444 HydrophobicContact CG-CD2 4Å; E405-Y444 HydrophobicContact CG-CE1 4.19Å; E405-Y444 HydrophobicContact CG-CE2 4.06Å; E405-Y444 HydrophobicContact CG-CG 4.02Å; E405-Y444 WeakPolarHBondContact O-CE1 3.05Å; E405-K512 IonicContact OE2-NZ 2.76Å; E405-K512 PolarHBondContact OE2-NZ 3.21Å
406	E	92.4	Very high	94.8	Very high	90 Å²	90	50 Å²	50	42%	0.421	27%	0.265	S	S	.	.	H	α-helix	trans	-70.6	-38.9	179.8	-72	161	-166.8	0	0	112.2	M404 V408 E409 D410 W508	M404-E406 PolarHBondContact O-N 2.72Å; E406-V408 VanDerWaalsContact C-N 3.31Å; E406-V408 PolarHBondContact O-N 2.98Å; E406-E409 PolarHBondContact O-N 3.23Å; E406-D410 WeakPolarHBondContact O-CB 3.44Å; E406-D410 PolarHBondContact O-N 2.85Å; E406-W508 VanDerWaalsContact CD-CD1 3.47Å; E406-W508 PolarHBondContact OE1-NE1 3.43Å; E406-W508 VanDerWaalsContact OE2-CD1 3.32Å; E406-W508 PolarHBondContact OE2-NE1 3.01Å
407	E	94.2	Very high	94.3	Very high	70 Å²	70	52.3 Å²	52.3	33%	0.327	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-40.2	176	-62	166.6	169.8	0	0	111.1	L402 H403 M404 F411	L402-E407 HydrophobicContact CB-CB 4.29Å; L402-E407 HydrophobicContact CD2-CB 4.04Å; H403-E407 IonicContact CE1-OE1 2.67Å; H403-E407 PolarHBondContact CE1-OE1 2.87Å; H403-E407 IonicContact CE1-OE2 3.42Å; H403-E407 IonicContact CG-OE2 2.68Å; H403-E407 PolarHBondContact N-OE2 2.76Å; H403-E407 VanDerWaalsContact ND1-CD 3.3Å; H403-E407 IonicContact ND1-OE1 3.5Å; H403-E407 PolarHBondContact ND1-OE1 2.75Å; H403-E407 IonicContact ND1-OE2 2.75Å; H403-E407 PolarHBondContact ND1-OE2 3.38Å; M404-E407 HydrophobicContact CB-CG 4.04Å; M404-E407 PolarHBondContact N-OE2 3.48Å; M404-E407 WeakPolarHBondContact O-CB 3.26Å; M404-E407 PolarHBondContact O-N 2.92Å; E407-F411 WeakPolarHBondContact O-CB 3.44Å; E407-F411 PolarHBondContact O-N 3.11Å
408	V	94.9	Very high	93.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-71	-36.8	178.2	-176.3	0	0	0	0	111.9	L402 M404 E406 L412 F429 M441 V445	L402-V408 HydrophobicContact CB-CG2 3.4Å; L402-V408 HydrophobicContact CD1-CB 4.5Å; L402-V408 HydrophobicContact CD1-CG2 4.06Å; L402-V408 HydrophobicContact CG-CG2 4.37Å; M404-V408 PolarHBondContact O-N 3.12Å; E406-V408 VanDerWaalsContact C-N 3.31Å; E406-V408 PolarHBondContact O-N 2.98Å; V408-L412 HydrophobicContact CG1-CD1 3.79Å; V408-L412 HydrophobicContact CG1-CG 4.34Å; V408-L412 WeakPolarHBondContact O-CB 3.4Å; V408-L412 PolarHBondContact O-N 3.42Å; V408-F429 HydrophobicContact CG1-CE1 4.46Å; V408-M441 HydrophobicContact CB-CG 4.49Å; V408-M441 HydrophobicContact CB-SD 4.11Å; V408-M441 HydrophobicContact CG1-CG 4.31Å; V408-M441 HydrophobicContact CG1-SD 4.44Å; V408-M441 HydrophobicContact CG2-CE 3.84Å; V408-M441 HydrophobicContact CG2-CG 3.86Å; V408-M441 HydrophobicContact CG2-SD 3.68Å; V408-V445 HydrophobicContact CB-CG2 4.49Å; V408-V445 HydrophobicContact CG1-CG2 3.25Å
409	E	93.7	Very high	92.9	Very high	49 Å²	49	53.1 Å²	53.1	23%	0.229	28%	0.276	C	S	.	.	I	π-helix	trans	-69	-44.5	176.9	-171.7	164.4	149.5	0	0	112.1	E405 E406 F411 L413 K414 Y444 R448	E405-E409 WeakPolarHBondContact O-CB 3.32Å; E405-E409 PolarHBondContact O-N 3.06Å; E405-E409 VanDerWaalsContact O-N 3.08Å; E406-E409 PolarHBondContact O-N 3.23Å; E409-F411 VanDerWaalsContact C-N 3.34Å; E409-F411 PolarHBondContact O-N 3.32Å; E409-L413 HydrophobicContact CG-CB 4.39Å; E409-L413 HydrophobicContact CG-CD1 4.33Å; E409-L413 PolarHBondContact O-N 3.46Å; E409-K414 PolarHBondContact O-N 2.69Å; E409-K414 VanDerWaalsContact O-N 3.12Å; E409-Y444 PolarHBondContact OE2-OH 2.8Å; E409-R448 VanDerWaalsContact CD-NE 3.31Å; E409-R448 IonicContact OE1-CZ 3.24Å; E409-R448 IonicContact OE1-NE 2.68Å; E409-R448 PolarHBondContact OE1-NE 2.91Å; E409-R448 IonicContact OE1-NH2 2.66Å; E409-R448 PolarHBondContact OE1-NH2 3.08Å; E409-R448 IonicContact OE2-CZ 2.78Å; E409-R448 IonicContact OE2-NE 2.88Å; E409-R448 PolarHBondContact OE2-NE 2.94Å; E409-R448 IonicContact OE2-NH2 3.23Å
410	D	94.6	Very high	91.7	Very high	92 Å²	92	58 Å²	58	49%	0.492	31%	0.305	S	S	.	.	I	π-helix	trans	-64	-36.2	174.7	-96.5	10.9	0	0	0	112.4	E406 K414	E406-D410 WeakPolarHBondContact O-CB 3.44Å; E406-D410 PolarHBondContact O-N 2.85Å; D410-K414 HydrophobicContact CB-CD 4.27Å; D410-K414 WeakPolarHBondContact O-CB 3.45Å; D410-K414 WeakPolarHBondContact OD1-CD 3.36Å; D410-K414 WeakPolarHBondContact OD1-CE 3.3Å; D410-K414 IonicContact OD1-NZ 2.72Å; D410-K414 PolarHBondContact OD1-NZ 3.16Å; D410-K414 IonicContact OD2-NZ 3.19Å; D410-K414 PolarHBondContact OD2-NZ 3.24Å
411	F	95.6	Very high	90.8	Very high	87 Å²	87	60.2 Å²	60.2	38%	0.382	32%	0.315	S	S	.	.	I	π-helix	trans	-78.8	-46.8	-179.8	-174.4	-99	0	0	0	113.5	V381 I383 V400 L402 E407 E409	V381-F411 HydrophobicContact CG1-CE1 4.02Å; I383-F411 HydrophobicContact CD1-CE1 4.35Å; V400-F411 HydrophobicContact CG1-CE2 4.48Å; V400-F411 HydrophobicContact CG1-CZ 4.49Å; V400-F411 HydrophobicContact CG2-CZ 4.12Å; L402-F411 HydrophobicContact CD1-CB 3.73Å; L402-F411 HydrophobicContact CD1-CD1 3.63Å; L402-F411 HydrophobicContact CD1-CE1 4.42Å; L402-F411 HydrophobicContact CD1-CG 3.76Å; L402-F411 HydrophobicContact CD2-CB 4.38Å; E407-F411 WeakPolarHBondContact O-CB 3.44Å; E407-F411 PolarHBondContact O-N 3.11Å; E409-F411 VanDerWaalsContact C-N 3.34Å; E409-F411 PolarHBondContact O-N 3.32Å
412	L	94.9	Very high	90	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.336	C	S	.	.	I	π-helix	trans	-92.8	-41.6	-173.7	-66.8	-179.4	0	0	0	113.9	V381 V408 P416 V427 F429 V445 Y460	V381-L412 HydrophobicContact CG1-CD2 4.49Å; V408-L412 HydrophobicContact CG1-CD1 3.79Å; V408-L412 HydrophobicContact CG1-CG 4.34Å; V408-L412 WeakPolarHBondContact O-CB 3.4Å; V408-L412 PolarHBondContact O-N 3.42Å; L412-P416 WeakPolarHBondContact O-CA 3.43Å; L412-V427 HydrophobicContact CD1-CG1 4.33Å; L412-V427 HydrophobicContact CD2-CG2 4.46Å; L412-F429 HydrophobicContact CD1-CZ 4.24Å; L412-V445 HydrophobicContact CD1-CG1 3.97Å; L412-V445 HydrophobicContact CD1-CG2 4.11Å; L412-Y460 HydrophobicContact CB-CE2 3.82Å; L412-Y460 HydrophobicContact CD2-CE1 4.31Å; L412-Y460 WeakPolarHBondContact O-CE2 3.33Å; L412-Y460 PolarHBondContact O-OH 3.22Å
413	L	92.8	Very high	89.7	Confident	27 Å²	27	63.9 Å²	63.9	14%	0.141	35%	0.346	C	S	.	.	I	π-helix	trans	-104.8	-24.3	-161.5	-62	173.7	0	0	0	113.7	E409 P416 R448 D449 Y460	E409-L413 HydrophobicContact CG-CB 4.39Å; E409-L413 HydrophobicContact CG-CD1 4.33Å; E409-L413 PolarHBondContact O-N 3.46Å; L413-P416 WeakPolarHBondContact O-CG 3.22Å; L413-R448 HydrophobicContact CD1-CB 3.34Å; L413-R448 HydrophobicContact CD1-CG 4.42Å; L413-D449 HydrophobicContact CD2-CB 3.87Å; L413-Y460 HydrophobicContact CD2-CD2 4.06Å; L413-Y460 HydrophobicContact CD2-CE2 3.97Å
414	K	91.4	Very high	89.7	Confident	127 Å²	127	64.8 Å²	64.8	55%	0.552	35%	0.348	S	S	*	.	S	Bend	trans	-72.6	-36.4	177.5	-169.9	168.6	-175.5	171.5	0	113.3	E409 D410	E409-K414 PolarHBondContact O-N 2.69Å; E409-K414 VanDerWaalsContact O-N 3.12Å; D410-K414 HydrophobicContact CB-CD 4.27Å; D410-K414 WeakPolarHBondContact O-CB 3.45Å; D410-K414 WeakPolarHBondContact OD1-CD 3.36Å; D410-K414 WeakPolarHBondContact OD1-CE 3.3Å; D410-K414 IonicContact OD1-NZ 2.72Å; D410-K414 PolarHBondContact OD1-NZ 3.16Å; D410-K414 IonicContact OD2-NZ 3.19Å; D410-K414 PolarHBondContact OD2-NZ 3.24Å
415	N	88.9	Confident	89.7	Confident	127 Å²	127	64 Å²	64	68%	0.679	34%	0.344	S	S	*	.	S	Bend	trans	-131.8	79	173.6	-65.6	-63.8	0	0	0	109.4
416	P	90.4	Very high	89.9	Confident	40 Å²	40	62.4 Å²	62.4	26%	0.26	34%	0.337	S	S	.	.			trans	-59.5	139.1	-173.4	-26.6	36.1	0	0	0	114.3	L412 L413 V418 H459	L412-P416 WeakPolarHBondContact O-CA 3.43Å; L413-P416 WeakPolarHBondContact O-CG 3.22Å; P416-V418 PolarHBondContact O-N 3.14Å; P416-V418 VanDerWaalsContact O-N 3.11Å; P416-H459 HydrophobicContact CB-CB 4Å
417	I	88.3	Confident	90.2	Very high	48 Å²	48	58.1 Å²	58.1	25%	0.246	32%	0.317	C	S	.	.			trans	-76.4	98.9	178.8	-57.6	170.2	0	0	0	109.1	E379 V381 P419 V425 Y460	E379-I417 HydrophobicContact CB-CG2 4.06Å; E379-I417 HydrophobicContact CG-CD1 4.3Å; E379-I417 HydrophobicContact CG-CG2 4.06Å; V381-I417 HydrophobicContact CG2-CD1 3.92Å; I417-P419 WeakPolarHBondContact O-CD 3.38Å; I417-V425 HydrophobicContact CB-CG1 4.31Å; I417-V425 HydrophobicContact CG2-CG1 4.18Å; I417-V425 HydrophobicContact CG2-CG2 3.96Å; I417-Y460 HydrophobicContact CB-CE1 4.28Å; I417-Y460 HydrophobicContact CD1-CE1 4.44Å; I417-Y460 PolarHBondContact N-OH 3.41Å; I417-Y460 VanDerWaalsContact N-OH 3.08Å
418	V	84.3	Confident	90.4	Very high	110 Å²	110	54.8 Å²	54.8	67%	0.667	30%	0.301	S	S	*	.			trans	-83.5	122.2	-176.2	-175.8	0	0	0	0	111.9	P416 T420	P416-V418 PolarHBondContact O-N 3.14Å; P416-V418 VanDerWaalsContact O-N 3.11Å; V418-T420 PolarHBondContact O-N 3.33Å
419	P	79.6	Confident	90.6	Very high	58 Å²	58	54.8 Å²	54.8	38%	0.377	30%	0.301	S	S	.	.			trans	-72.7	108.8	174.3	26.5	-31.6	0	0	0	112.2	I417 K423 V425	I417-P419 WeakPolarHBondContact O-CD 3.38Å; P419-K423 VanDerWaalsContact CB-O 3.26Å; P419-K423 WeakPolarHBondContact CB-O 3.44Å; P419-V425 HydrophobicContact CB-CG2 4.1Å; P419-V425 HydrophobicContact CG-CG2 4.43Å
420	T	74.1	Confident	90.9	Very high	112 Å²	112	52.4 Å²	52.4	69%	0.687	29%	0.29	S	S	*	.	S	Bend	trans	-71.8	-35.4	178.6	-31.6	0	0	0	0	113.5	V418	V418-T420 PolarHBondContact O-N 3.33Å
421	D	78.7	Confident	91.1	Very high	92 Å²	92	48.2 Å²	48.2	49%	0.492	27%	0.268	S	S	.	.	S	Bend	trans	-108.4	20.2	-160	-43.4	-50.8	0	0	0	113.9	K378 K423	K378-D421 WeakPolarHBondContact CD-OD2 3.2Å; K378-D421 WeakPolarHBondContact CE-OD2 3.49Å; K378-D421 IonicContact NZ-OD2 3.46Å; K378-D421 PolarHBondContact NZ-OD2 2.8Å; D421-K423 HydrophobicContact CB-CG 4.32Å; D421-K423 PolarHBondContact O-N 2.71Å
422	G	81.2	Confident	91.2	Very high	58 Å²	58	44.5 Å²	44.5	60%	0.598	25%	0.252	S	S	*	.	S	Bend	trans	69.5	-14.6	-174.1	0	0	0	0	0	115.9	K343	K343-G422 PolarHBondContact NZ-O 2.88Å
423	K	91.4	Very high	91.4	Very high	67 Å²	67	49.7 Å²	49.7	29%	0.291	28%	0.275	S	S	.	.			trans	-54.3	156.9	166.4	-70	-171.2	177.9	-164.1	0	112.2	A374 N375 L376 K378 P419 D421	A374-K423 PolarHBondContact O-NZ 2.72Å; N375-K423 VanDerWaalsContact O-CE 3.31Å; N375-K423 WeakPolarHBondContact O-CE 3.2Å; L376-K423 WeakPolarHBondContact O-CA 3.46Å; K378-K423 HydrophobicContact CB-CB 3.83Å; K378-K423 HydrophobicContact CB-CD 4.32Å; P419-K423 VanDerWaalsContact CB-O 3.26Å; P419-K423 WeakPolarHBondContact CB-O 3.44Å; D421-K423 HydrophobicContact CB-CG 4.32Å; D421-K423 PolarHBondContact O-N 2.71Å
424	R	94.3	Very high	91.6	Very high	47 Å²	47	48.6 Å²	48.6	18%	0.177	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	147.4	-179.6	-65.6	163	-179.2	-102.7	12.5	111.9	G344 L376 I377 K378 I426 E462	G344-R424 VanDerWaalsContact O-CZ 3.31Å; G344-R424 PolarHBondContact O-NH1 2.91Å; G344-R424 PolarHBondContact O-NH2 2.85Å; L376-R424 PolarHBondContact O-N 3.38Å; I377-R424 WeakPolarHBondContact CA-O 3.28Å; K378-R424 PolarHBondContact N-O 2.78Å; R424-I426 HydrophobicContact CB-CD1 4.22Å; R424-I426 HydrophobicContact CB-CG1 4.04Å; R424-E462 VanDerWaalsContact CD-OE2 3.28Å; R424-E462 WeakPolarHBondContact CD-OE2 3.44Å; R424-E462 IonicContact CZ-OE2 3.84Å; R424-E462 IonicContact NE-OE2 2.69Å; R424-E462 IonicContact NH1-OE1 2.76Å; R424-E462 IonicContact NH1-OE2 3.83Å; R424-E462 PolarHBondContact NH1-OE2 3.31Å
425	V	95.9	Very high	91.8	Very high	9 Å²	9	44.4 Å²	44.4	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.5	158.5	173.4	0	0	0	0	106.3	E379 I417 P419 Y460	E379-V425 HydrophobicContact CB-CG1 4.32Å; E379-V425 HydrophobicContact CB-CG2 4.18Å; I417-V425 HydrophobicContact CB-CG1 4.31Å; I417-V425 HydrophobicContact CG2-CG1 4.18Å; I417-V425 HydrophobicContact CG2-CG2 3.96Å; P419-V425 HydrophobicContact CB-CG2 4.1Å; P419-V425 HydrophobicContact CG-CG2 4.43Å; V425-Y460 HydrophobicContact CG1-CD1 3.99Å; V425-Y460 HydrophobicContact CG1-CE1 3.88Å
426	I	97.3	Very high	92.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134.8	-175.7	-60.1	-179.8	0	0	0	109	L346 F347 I377 E379 F380 V381 R424 V428 E462 Y464	L346-I426 HydrophobicContact CB-CD1 4.2Å; L346-I426 HydrophobicContact CD2-CD1 3.74Å; F347-I426 HydrophobicContact CE2-CD1 4.02Å; F347-I426 HydrophobicContact CE2-CG2 4.17Å; F347-I426 HydrophobicContact CZ-CD1 4.1Å; I377-I426 HydrophobicContact CD1-CD1 4.09Å; I377-I426 HydrophobicContact CG1-CD1 4.1Å; E379-I426 PolarHBondContact O-N 2.87Å; E379-I426 VanDerWaalsContact O-N 3.11Å; F380-I426 WeakPolarHBondContact CA-O 3.44Å; F380-I426 HydrophobicContact CD2-CB 4.1Å; F380-I426 HydrophobicContact CD2-CG2 4.13Å; F380-I426 HydrophobicContact CE2-CG2 4.08Å; V381-I426 PolarHBondContact N-O 3.35Å; R424-I426 HydrophobicContact CB-CD1 4.22Å; R424-I426 HydrophobicContact CB-CG1 4.04Å; I426-V428 HydrophobicContact CG2-CG2 4.38Å; I426-E462 HydrophobicContact CD1-CG 4.23Å; I426-E462 HydrophobicContact CG1-CB 4.28Å; I426-E462 HydrophobicContact CG1-CG 3.98Å; I426-E462 HydrophobicContact CG2-CG 4.37Å; I426-Y464 HydrophobicContact CD1-CE2 4.49Å; I426-Y464 HydrophobicContact CG2-CD2 3.61Å; I426-Y464 HydrophobicContact CG2-CE2 3.61Å
427	V	98.3	Very high	92.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	132	176.2	-170.8	0	0	0	0	109.7	V381 I383 L412 F429 Y460 E462 L463 Y464	V381-V427 HydrophobicContact CB-CB 4.5Å; V381-V427 HydrophobicContact CB-CG1 4.21Å; V381-V427 HydrophobicContact CB-CG2 4.2Å; V381-V427 HydrophobicContact CG1-CG1 4.35Å; V381-V427 CarbonylContact O-C 3.57Å; V381-V427 WeakPolarHBondContact O-CA 3.28Å; I383-V427 HydrophobicContact CG1-CG1 3.83Å; L412-V427 HydrophobicContact CD1-CG1 4.33Å; L412-V427 HydrophobicContact CD2-CG2 4.46Å; V427-F429 HydrophobicContact CB-CE2 4.4Å; V427-F429 HydrophobicContact CG1-CD2 4.48Å; V427-F429 HydrophobicContact CG1-CE1 4.32Å; V427-F429 HydrophobicContact CG1-CE2 3.86Å; V427-F429 HydrophobicContact CG1-CZ 3.74Å; V427-Y460 HydrophobicContact CG2-CD1 3.55Å; V427-Y460 HydrophobicContact CG2-CE1 4.07Å; V427-Y460 HydrophobicContact CG2-CG 4.18Å; V427-E462 PolarHBondContact N-O 2.93Å; V427-L463 HydrophobicContact CB-CD2 3.74Å; V427-L463 HydrophobicContact CG2-CD2 4.2Å; V427-L463 WeakPolarHBondContact O-CA 3.2Å; V427-Y464 PolarHBondContact O-N 3.49Å
428	V	98.7	Very high	92.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.4	177.6	-172.9	0	0	0	0	109.9	I360 M365 F380 V381 I383 I426 Y464 L466	I360-V428 HydrophobicContact CD1-CG1 3.96Å; I360-V428 HydrophobicContact CD1-CG2 4.02Å; I360-V428 HydrophobicContact CG1-CG1 4.33Å; M365-V428 HydrophobicContact CE-CB 4.05Å; M365-V428 HydrophobicContact CE-CG1 3.71Å; F380-V428 HydrophobicContact CE2-CG2 3.5Å; F380-V428 HydrophobicContact CZ-CB 4.46Å; F380-V428 HydrophobicContact CZ-CG2 3.53Å; V381-V428 PolarHBondContact O-N 2.81Å; I383-V428 PolarHBondContact N-O 3.41Å; I426-V428 HydrophobicContact CG2-CG2 4.38Å; V428-Y464 WeakPolarHBondContact CA-O 3.45Å; V428-Y464 HydrophobicContact CG2-CD2 4.44Å; V428-L466 HydrophobicContact CG1-CB 4.23Å
429	F	98.8	Very high	93.6	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	142.7	175.2	-61.3	-86.1	0	0	0	110.9	I383 V408 L412 V427 M441 C442 V445 L463 Y464 V465 L466	I383-F429 HydrophobicContact CB-CD1 3.72Å; I383-F429 HydrophobicContact CB-CE1 3.94Å; I383-F429 HydrophobicContact CG1-CD1 4.28Å; I383-F429 HydrophobicContact CG1-CE1 4Å; I383-F429 HydrophobicContact CG2-CD1 3.87Å; I383-F429 HydrophobicContact CG2-CE1 4.02Å; V408-F429 HydrophobicContact CG1-CE1 4.46Å; L412-F429 HydrophobicContact CD1-CZ 4.24Å; V427-F429 HydrophobicContact CB-CE2 4.4Å; V427-F429 HydrophobicContact CG1-CD2 4.48Å; V427-F429 HydrophobicContact CG1-CE1 4.32Å; V427-F429 HydrophobicContact CG1-CE2 3.86Å; V427-F429 HydrophobicContact CG1-CZ 3.74Å; F429-M441 HydrophobicContact CD1-CB 4.13Å; F429-M441 HydrophobicContact CD1-CG 4.11Å; F429-M441 HydrophobicContact CE1-CB 4.47Å; F429-M441 HydrophobicContact CE1-CG 4.04Å; F429-C442 HydrophobicContact CB-CB 4.22Å; F429-C442 HydrophobicContact CD2-CB 3.49Å; F429-C442 VanDerWaalsContact CD2-CB 3.49Å; F429-C442 HydrophobicContact CE2-CB 4.06Å; F429-C442 HydrophobicContact CG-CB 3.92Å; F429-V445 HydrophobicContact CE1-CG2 4.03Å; F429-V445 HydrophobicContact CZ-CB 3.96Å; F429-V445 HydrophobicContact CZ-CG1 4.21Å; F429-V445 HydrophobicContact CZ-CG2 3.71Å; F429-L463 HydrophobicContact CE2-CD1 4.44Å; F429-L463 HydrophobicContact CE2-CD2 4.06Å; F429-Y464 PolarHBondContact N-O 3.5Å; F429-V465 VanDerWaalsContact O-CA 3.32Å; F429-V465 WeakPolarHBondContact O-CA 3.46Å; F429-L466 PolarHBondContact O-N 2.75Å
430	H	98.8	Very high	94.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	171.5	165.9	73.9	95.8	0	0	0	111.8	I383 D384 C385 S434 L466	I383-H430 PolarHBondContact O-N 2.9Å; D384-H430 IonicContact OD1-CE1 2.72Å; D384-H430 PolarHBondContact OD1-CE1 2.82Å; D384-H430 IonicContact OD1-ND1 2.72Å; D384-H430 IonicContact OD2-CE1 2.63Å; D384-H430 PolarHBondContact OD2-CE1 3.38Å; D384-H430 IonicContact OD2-NE2 2.82Å; C385-H430 VanDerWaalsContact CB-O 3.25Å; C385-H430 WeakPolarHBondContact CB-O 3.23Å; C385-H430 PolarHBondContact N-O 2.66Å; C385-H430 PolarHBondContact SG-O 2.82Å; H430-S434 WeakPolarHBondContact CA-OG 3.1Å; H430-L466 HydrophobicContact CB-CB 3.76Å; H430-L466 HydrophobicContact CB-CD2 4.26Å
431	C	98.6	Very high	95.5	Very high	4 Å²	4	35 Å²	35	3%	0.027	18%	0.175	C	C	.	.			trans	-139.8	-147.9	156.6	65.2	0	0	0	0	108.4	C385 R386 S434 R437 G469 Y470	C385-C431 HydrophobicContact CB-CB 4.38Å; R386-C431 HydrophobicContact CG-CB 3.99Å; C431-S434 PolarHBondContact N-OG 2.75Å; C431-S434 PolarHBondContact SG-N 3.43Å; C431-R437 HydrophobicContact CB-CB 3.82Å; C431-G469 CarbonylContact O-C 3.53Å; C431-G469 WeakPolarHBondContact O-CA 3.39Å; C431-Y470 PolarHBondContact O-N 3.49Å
432	E	98.6	Very high	96.5	Very high	8 Å²	8	30.9 Å²	30.9	4%	0.037	15%	0.154	C	C	.	.	S	Bend	trans	-59	-53	177	-174.4	179.1	-155.6	0	0	112.5	R386 R437 G469 Y470 K471 Y486 P488 M489	R386-E432 HydrophobicContact CG-CB 4.34Å; E432-R437 IonicContact OE2-NH2 3.36Å; E432-R437 PolarHBondContact OE2-NH2 2.93Å; E432-G469 CarbonylContact O-C 3.56Å; E432-G469 WeakPolarHBondContact O-CA 3.22Å; E432-Y470 PolarHBondContact O-N 2.99Å; E432-Y470 VanDerWaalsContact O-N 3.17Å; E432-K471 WeakPolarHBondContact O-CB 3.49Å; E432-K471 PolarHBondContact O-N 2.91Å; E432-Y486 HydrophobicContact CG-CE2 4.14Å; E432-Y486 WeakPolarHBondContact CG-OH 3.48Å; E432-Y486 PolarHBondContact OE1-OH 3.47Å; E432-Y486 VanDerWaalsContact OE1-OH 3.06Å; E432-P488 WeakPolarHBondContact OE1-CA 3.46Å; E432-P488 VanDerWaalsContact OE1-CB 3.24Å; E432-P488 WeakPolarHBondContact OE1-CB 3.4Å; E432-M489 PolarHBondContact OE1-N 3.38Å; E432-M489 WeakPolarHBondContact OE2-CB 3.45Å
433	F	98.1	Very high	97.2	Very high	110 Å²	110	32.1 Å²	32.1	48%	0.482	14%	0.14	S	C	.	.	S	Bend	trans	-115	-7.9	179.9	-54.3	-85.4	0	0	0	113.8	S435 G468 K471	F433-S435 PolarHBondContact O-N 2.74Å; F433-G468 CarbonylContact O-C 3.54Å; F433-K471 HydrophobicContact CD1-CD 3.91Å; F433-K471 HydrophobicContact CE1-CD 3.38Å; F433-K471 HydrophobicContact CZ-CD 4.17Å
434	S	98.1	Very high	97.5	Very high	4 Å²	4	30.4 Å²	30.4	3%	0.028	13%	0.132	C	C	.	.	S	Bend	trans	54.3	28.1	-169.6	-64.6	0	0	0	0	115.8	H430 C431 P439 L466 G469	H430-S434 WeakPolarHBondContact CA-OG 3.1Å; C431-S434 PolarHBondContact N-OG 2.75Å; C431-S434 PolarHBondContact SG-N 3.43Å; S434-P439 WeakPolarHBondContact O-CD 3.33Å; S434-P439 WeakPolarHBondContact O-CG 3.33Å; S434-L466 WeakPolarHBondContact CB-O 3.25Å; S434-L466 PolarHBondContact OG-O 3.48Å; S434-G469 WeakPolarHBondContact OG-CA 3.44Å
435	S	96.1	Very high	97.7	Very high	38 Å²	38	28.2 Å²	28.2	27%	0.266	12%	0.124	S	C	.	.	S	Bend	trans	-82.8	-47.9	175.3	-169.5	0	0	0	0	112.8	K353 H354 F433 P439	K353-S435 WeakPolarHBondContact CD-OG 3.49Å; K353-S435 PolarHBondContact NZ-OG 2.83Å; H354-S435 PolarHBondContact CD2-O 3.14Å; H354-S435 PolarHBondContact NE2-O 3.09Å; F433-S435 PolarHBondContact O-N 2.74Å; S435-P439 WeakPolarHBondContact O-CG 3.49Å
436	E	95.8	Very high	97.7	Very high	101 Å²	101	30.6 Å²	30.6	47%	0.472	13%	0.132	S	C	.	.	S	Bend	trans	-118.8	-67.1	-172.2	-50.5	-44.8	129.1	0	0	113.3	K353 G438 P439 R440	K353-E436 IonicContact NZ-OE1 2.63Å; K353-E436 PolarHBondContact NZ-OE1 3.29Å; E436-G438 PolarHBondContact O-N 3.08Å; E436-P439 WeakPolarHBondContact O-CD 3.22Å; E436-R440 WeakPolarHBondContact O-CB 3.45Å; E436-R440 PolarHBondContact O-N 3.5Å
437	R	96.8	Very high	97.7	Very high	49 Å²	49	36.2 Å²	36.2	19%	0.185	16%	0.158	C	C	.	.	H	α-helix	trans	-57.8	-50.4	-169.7	-60.6	-178.6	-86.5	165.9	1.1	113	C385 E390 C431 E432 R440 M441 M489	C385-R437 HydrophobicContact CB-CB 4.33Å; E390-R437 IonicContact OE1-CZ 3.11Å; E390-R437 IonicContact OE1-NH1 3.04Å; E390-R437 PolarHBondContact OE1-NH1 2.96Å; E390-R437 IonicContact OE1-NH2 2.77Å; E390-R437 PolarHBondContact OE1-NH2 3.15Å; E390-R437 IonicContact OE2-CZ 2.96Å; E390-R437 IonicContact OE2-NH1 2.98Å; E390-R437 PolarHBondContact OE2-NH1 3.28Å; E390-R437 IonicContact OE2-NH2 3.6Å; E390-R437 PolarHBondContact OE2-NH2 2.96Å; C431-R437 HydrophobicContact CB-CB 3.82Å; E432-R437 IonicContact OE2-NH2 3.36Å; E432-R437 PolarHBondContact OE2-NH2 2.93Å; R437-R440 PolarHBondContact O-N 2.96Å; R437-M441 PolarHBondContact O-N 3.07Å; R437-M441 VanDerWaalsContact O-N 3.08Å; R437-M489 PolarHBondContact NH2-SD 3.11Å
438	G	97.8	Very high	97.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-55.3	176	0	0	0	0	0	113.6	E436 R440 M441 C442	E436-G438 PolarHBondContact O-N 3.08Å; G438-R440 VanDerWaalsContact C-N 3.34Å; G438-R440 PolarHBondContact O-N 2.83Å; G438-M441 PolarHBondContact O-N 3.31Å; G438-M441 VanDerWaalsContact O-N 3.14Å; G438-C442 PolarHBondContact O-N 3.47Å
439	P	98.1	Very high	97.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-54.2	-40.1	173.8	-34.3	40.4	0	0	0	115.3	L357 S434 S435 E436 R443 V465	L357-P439 HydrophobicContact CD1-CB 3.69Å; L357-P439 HydrophobicContact CD1-CG 4.43Å; S434-P439 WeakPolarHBondContact O-CD 3.33Å; S434-P439 WeakPolarHBondContact O-CG 3.33Å; S435-P439 WeakPolarHBondContact O-CG 3.49Å; E436-P439 WeakPolarHBondContact O-CD 3.22Å; P439-R443 WeakPolarHBondContact O-CG 3.48Å; P439-R443 PolarHBondContact O-N 2.85Å; P439-R443 VanDerWaalsContact O-N 3.15Å; P439-V465 HydrophobicContact CG-CG1 4.24Å
440	R	97.2	Very high	97.5	Very high	136 Å²	136	43 Å²	43	51%	0.513	18%	0.184	S	C	.	.	H	α-helix	trans	-60.4	-49.5	173.4	173.8	177.8	168.5	165.8	-3	111	E405 E436 R437 G438 C442 R443 Y444	E405-R440 IonicContact OE1-CZ 3.69Å; E405-R440 IonicContact OE1-NE 2.8Å; E405-R440 PolarHBondContact OE1-NE 2.88Å; E405-R440 IonicContact OE1-NH2 3.4Å; E405-R440 PolarHBondContact OE1-NH2 2.79Å; E436-R440 WeakPolarHBondContact O-CB 3.45Å; E436-R440 PolarHBondContact O-N 3.5Å; R437-R440 PolarHBondContact O-N 2.96Å; G438-R440 VanDerWaalsContact C-N 3.34Å; G438-R440 PolarHBondContact O-N 2.83Å; R440-C442 PolarHBondContact O-N 3.18Å; R440-R443 PolarHBondContact O-N 3.44Å; R440-Y444 PolarHBondContact O-N 3.48Å
441	M	97.6	Very high	97.4	Very high	12 Å²	12	48.7 Å²	48.7	6%	0.059	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-39.1	-178	-159.9	64.4	84.4	0	0	112.1	C385 E405 V408 F429 R437 G438 R443 Y444 V445	C385-M441 VanDerWaalsContact SG-CB 3.6Å; E405-M441 HydrophobicContact CG-CE 4.41Å; E405-M441 HydrophobicContact CG-SD 4.18Å; V408-M441 HydrophobicContact CB-CG 4.49Å; V408-M441 HydrophobicContact CB-SD 4.11Å; V408-M441 HydrophobicContact CG1-CG 4.31Å; V408-M441 HydrophobicContact CG1-SD 4.44Å; V408-M441 HydrophobicContact CG2-CE 3.84Å; V408-M441 HydrophobicContact CG2-CG 3.86Å; V408-M441 HydrophobicContact CG2-SD 3.68Å; F429-M441 HydrophobicContact CD1-CB 4.13Å; F429-M441 HydrophobicContact CD1-CG 4.11Å; F429-M441 HydrophobicContact CE1-CB 4.47Å; F429-M441 HydrophobicContact CE1-CG 4.04Å; R437-M441 PolarHBondContact O-N 3.07Å; R437-M441 VanDerWaalsContact O-N 3.08Å; G438-M441 PolarHBondContact O-N 3.31Å; G438-M441 VanDerWaalsContact O-N 3.14Å; M441-R443 VanDerWaalsContact C-N 3.29Å; M441-R443 PolarHBondContact O-N 3.31Å; M441-Y444 PolarHBondContact O-N 3.31Å; M441-Y444 HydrophobicContact SD-CD1 4.31Å; M441-V445 WeakPolarHBondContact O-CG2 3.39Å; M441-V445 PolarHBondContact O-N 3.35Å
442	C	98.1	Very high	97.1	Very high	5 Å²	5	51.3 Å²	51.3	3%	0.034	24%	0.242	C	C	.	.	H	α-helix	trans	-58.5	-39.2	174	-172.9	0	0	0	0	112.5	F429 G438 R440 R446 V465	F429-C442 HydrophobicContact CB-CB 4.22Å; F429-C442 HydrophobicContact CD2-CB 3.49Å; F429-C442 VanDerWaalsContact CD2-CB 3.49Å; F429-C442 HydrophobicContact CE2-CB 4.06Å; F429-C442 HydrophobicContact CG-CB 3.92Å; G438-C442 PolarHBondContact O-N 3.47Å; R440-C442 PolarHBondContact O-N 3.18Å; C442-R446 PolarHBondContact O-N 3.33Å; C442-V465 HydrophobicContact CB-CG2 4.2Å
443	R	97.8	Very high	97	Very high	85 Å²	85	52.8 Å²	52.8	32%	0.321	25%	0.25	S	S	.	.	H	α-helix	trans	-71.5	-44.4	174.7	-69.9	-176.6	-174.5	119.7	-10.7	111.9	H354 D356 L357 P439 R440 M441 V445 R446 E447	H354-R443 VanDerWaalsContact CG-NH2 3.34Å; H354-R443 PolarHBondContact ND1-NH1 3.13Å; H354-R443 PolarHBondContact ND1-NH2 3.34Å; D356-R443 IonicContact OD1-CZ 2.68Å; D356-R443 IonicContact OD1-NH2 3.22Å; D356-R443 PolarHBondContact OD1-NH2 3.3Å; D356-R443 IonicContact OD2-CZ 3.62Å; D356-R443 VanDerWaalsContact OD2-CZ 3.24Å; D356-R443 IonicContact OD2-NE 3.73Å; D356-R443 PolarHBondContact OD2-NE 3.41Å; D356-R443 IonicContact OD2-NH2 2.72Å; D356-R443 PolarHBondContact OD2-NH2 3.1Å; L357-R443 HydrophobicContact CD1-CG 4.5Å; L357-R443 HydrophobicContact CD2-CG 4.11Å; P439-R443 WeakPolarHBondContact O-CG 3.48Å; P439-R443 PolarHBondContact O-N 2.85Å; P439-R443 VanDerWaalsContact O-N 3.15Å; R440-R443 PolarHBondContact O-N 3.44Å; M441-R443 VanDerWaalsContact C-N 3.29Å; M441-R443 PolarHBondContact O-N 3.31Å; R443-V445 PolarHBondContact O-N 2.77Å; R443-R446 PolarHBondContact O-N 3.45Å; R443-E447 WeakPolarHBondContact O-CB 3.27Å; R443-E447 PolarHBondContact O-N 2.94Å
444	Y	97.1	Very high	96.9	Very high	31 Å²	31	54 Å²	54	12%	0.122	26%	0.257	C	S	.	.	H	α-helix	trans	-54.9	-48.9	176.6	-178.7	-97.6	0	0	0	111.8	E405 E409 R440 M441 R446 E447 R448	E405-Y444 HydrophobicContact CB-CD1 4.09Å; E405-Y444 HydrophobicContact CB-CD2 4.43Å; E405-Y444 HydrophobicContact CB-CE1 3.71Å; E405-Y444 HydrophobicContact CB-CE2 4.06Å; E405-Y444 HydrophobicContact CB-CG 4.45Å; E405-Y444 HydrophobicContact CG-CD1 4.1Å; E405-Y444 HydrophobicContact CG-CD2 4Å; E405-Y444 HydrophobicContact CG-CE1 4.19Å; E405-Y444 HydrophobicContact CG-CE2 4.06Å; E405-Y444 HydrophobicContact CG-CG 4.02Å; E405-Y444 WeakPolarHBondContact O-CE1 3.05Å; E409-Y444 PolarHBondContact OE2-OH 2.8Å; R440-Y444 PolarHBondContact O-N 3.48Å; M441-Y444 PolarHBondContact O-N 3.31Å; M441-Y444 HydrophobicContact SD-CD1 4.31Å; Y444-R446 PolarHBondContact O-N 3.02Å; Y444-E447 PolarHBondContact O-N 3.23Å; Y444-R448 HydrophobicContact CD1-CG 4.06Å; Y444-R448 HydrophobicContact CD2-CG 4.33Å; Y444-R448 HydrophobicContact CE1-CG 3.59Å; Y444-R448 HydrophobicContact CE2-CG 3.92Å; Y444-R448 HydrophobicContact CG-CG 4.4Å; Y444-R448 WeakPolarHBondContact O-CG 3.03Å; Y444-R448 PolarHBondContact O-N 3.23Å
445	V	97.4	Very high	96.8	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-44.1	178.2	173.2	0	0	0	0	111.5	V408 L412 F429 M441 R443 E447 R448 D449	V408-V445 HydrophobicContact CB-CG2 4.49Å; V408-V445 HydrophobicContact CG1-CG2 3.25Å; L412-V445 HydrophobicContact CD1-CG1 3.97Å; L412-V445 HydrophobicContact CD1-CG2 4.11Å; F429-V445 HydrophobicContact CE1-CG2 4.03Å; F429-V445 HydrophobicContact CZ-CB 3.96Å; F429-V445 HydrophobicContact CZ-CG1 4.21Å; F429-V445 HydrophobicContact CZ-CG2 3.71Å; M441-V445 WeakPolarHBondContact O-CG2 3.39Å; M441-V445 PolarHBondContact O-N 3.35Å; R443-V445 PolarHBondContact O-N 2.77Å; V445-E447 VanDerWaalsContact C-N 3.34Å; V445-E447 PolarHBondContact O-N 2.94Å; V445-R448 PolarHBondContact O-N 2.98Å; V445-D449 WeakPolarHBondContact O-CB 3.16Å; V445-D449 PolarHBondContact O-N 3.04Å
446	R	97.7	Very high	96.8	Very high	58 Å²	58	61.8 Å²	61.8	22%	0.219	29%	0.288	C	S	.	.	H	α-helix	trans	-64.7	-37.1	177.6	179.8	52.3	57.6	81.2	-11.2	112.6	C442 R443 Y444 R450 Y460 P461 L463	C442-R446 PolarHBondContact O-N 3.33Å; R443-R446 PolarHBondContact O-N 3.45Å; Y444-R446 PolarHBondContact O-N 3.02Å; R446-R450 WeakPolarHBondContact O-CB 3.36Å; R446-R450 VanDerWaalsContact O-CG 3.29Å; R446-R450 WeakPolarHBondContact O-CG 3.32Å; R446-R450 PolarHBondContact O-N 3.33Å; R446-Y460 PolarHBondContact NH2-O 3.4Å; R446-P461 PolarHBondContact NH2-O 3.4Å; R446-L463 HydrophobicContact CB-CD1 4.09Å
447	E	97.1	Very high	96.7	Very high	119 Å²	119	62.3 Å²	62.3	56%	0.556	29%	0.288	S	S	*	.	H	α-helix	trans	-65.9	-48.1	174.8	-177.7	177.8	-174.5	0	0	111.3	R443 Y444 V445 R450 L451	R443-E447 WeakPolarHBondContact O-CB 3.27Å; R443-E447 PolarHBondContact O-N 2.94Å; Y444-E447 PolarHBondContact O-N 3.23Å; V445-E447 VanDerWaalsContact C-N 3.34Å; V445-E447 PolarHBondContact O-N 2.94Å; E447-R450 PolarHBondContact O-N 3.31Å; E447-L451 HydrophobicContact CG-CD1 4.1Å; E447-L451 VanDerWaalsContact O-CG 3.32Å; E447-L451 WeakPolarHBondContact O-CG 3.43Å; E447-L451 PolarHBondContact O-N 3.19Å
448	R	96.6	Very high	96.7	Very high	73 Å²	73	60.8 Å²	60.8	28%	0.275	28%	0.284	S	S	.	.	H	α-helix	trans	-66.9	-39.7	179.1	-65.2	-63.5	-62.1	106.4	4.2	112.8	E409 L413 Y444 V445 L451 G452	E409-R448 VanDerWaalsContact CD-NE 3.31Å; E409-R448 IonicContact OE1-CZ 3.24Å; E409-R448 IonicContact OE1-NE 2.68Å; E409-R448 PolarHBondContact OE1-NE 2.91Å; E409-R448 IonicContact OE1-NH2 2.66Å; E409-R448 PolarHBondContact OE1-NH2 3.08Å; E409-R448 IonicContact OE2-CZ 2.78Å; E409-R448 IonicContact OE2-NE 2.88Å; E409-R448 PolarHBondContact OE2-NE 2.94Å; E409-R448 IonicContact OE2-NH2 3.23Å; L413-R448 HydrophobicContact CD1-CB 3.34Å; L413-R448 HydrophobicContact CD1-CG 4.42Å; Y444-R448 HydrophobicContact CD1-CG 4.06Å; Y444-R448 HydrophobicContact CD2-CG 4.33Å; Y444-R448 HydrophobicContact CE1-CG 3.59Å; Y444-R448 HydrophobicContact CE2-CG 3.92Å; Y444-R448 HydrophobicContact CG-CG 4.4Å; Y444-R448 WeakPolarHBondContact O-CG 3.03Å; Y444-R448 PolarHBondContact O-N 3.23Å; V445-R448 PolarHBondContact O-N 2.98Å; R448-L451 PolarHBondContact O-N 3.09Å; R448-G452 PolarHBondContact O-N 3.22Å
449	D	97.2	Very high	96.6	Very high	1 Å²	1	64 Å²	64	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-41.1	173.8	-169.3	8	0	0	0	111.3	L413 V445 G452 N453 L458 H459 Y460	L413-D449 HydrophobicContact CD2-CB 3.87Å; V445-D449 WeakPolarHBondContact O-CB 3.16Å; V445-D449 PolarHBondContact O-N 3.04Å; D449-G452 PolarHBondContact O-N 3.31Å; D449-N453 WeakPolarHBondContact O-CB 3.32Å; D449-N453 PolarHBondContact O-N 3.46Å; D449-N453 PolarHBondContact O-ND2 2.85Å; D449-N453 VanDerWaalsContact O-ND2 3.09Å; D449-N453 PolarHBondContact OD1-ND2 3.38Å; D449-L458 HydrophobicContact CB-CD2 4.07Å; D449-L458 WeakPolarHBondContact OD2-CB 3.43Å; D449-H459 IonicContact OD1-CD2 3.59Å; D449-H459 PolarHBondContact OD1-CD2 3.06Å; D449-H459 IonicContact OD1-CG 3.61Å; D449-H459 PolarHBondContact OD1-N 3.47Å; D449-H459 PolarHBondContact OD2-N 3.22Å; D449-Y460 PolarHBondContact OD2-N 3.17Å
450	R	96.9	Very high	96.5	Very high	67 Å²	67	64.1 Å²	64.1	25%	0.253	30%	0.299	S	S	.	.	H	α-helix	trans	-64.8	-38.5	171.5	-81.1	-66.2	-167.8	-134.2	-0.8	113.6	G339 R446 E447 G452 N453 P456 K457 L458	G339-R450 PolarHBondContact O-NH2 3.01Å; R446-R450 WeakPolarHBondContact O-CB 3.36Å; R446-R450 VanDerWaalsContact O-CG 3.29Å; R446-R450 WeakPolarHBondContact O-CG 3.32Å; R446-R450 PolarHBondContact O-N 3.33Å; E447-R450 PolarHBondContact O-N 3.31Å; R450-G452 VanDerWaalsContact C-N 3.26Å; R450-G452 PolarHBondContact O-N 2.89Å; R450-N453 PolarHBondContact O-N 2.94Å; R450-N453 VanDerWaalsContact O-O 3.1Å; R450-P456 PolarHBondContact NH1-O 2.8Å; R450-K457 PolarHBondContact NH1-O 3.31Å; R450-K457 VanDerWaalsContact NH1-O 3.11Å; R450-L458 HydrophobicContact CG-CD2 3.92Å; R450-L458 VanDerWaalsContact NH1-CG 3.31Å
451	L	96.1	Very high	96.5	Very high	120 Å²	120	58.5 Å²	58.5	63%	0.628	28%	0.281	S	S	*	.	H	α-helix	trans	-71.5	-21.1	177	-72.9	166.9	0	0	0	112.8	E447 R448	E447-L451 HydrophobicContact CG-CD1 4.1Å; E447-L451 VanDerWaalsContact O-CG 3.32Å; E447-L451 WeakPolarHBondContact O-CG 3.43Å; E447-L451 PolarHBondContact O-N 3.19Å; R448-L451 PolarHBondContact O-N 3.09Å
452	G	93.5	Very high	96.5	Very high	60 Å²	60	58 Å²	58	62%	0.619	28%	0.278	S	S	*	.	H	α-helix	trans	-89.3	-13.8	175	0	0	0	0	0	115.2	R448 D449 R450	R448-G452 PolarHBondContact O-N 3.22Å; D449-G452 PolarHBondContact O-N 3.31Å; R450-G452 VanDerWaalsContact C-N 3.26Å; R450-G452 PolarHBondContact O-N 2.89Å
453	N	95.5	Very high	96.5	Very high	39 Å²	39	58.3 Å²	58.3	21%	0.209	28%	0.28	C	S	.	.	S	Bend	trans	-125.9	148	-169.8	-80.2	-81.1	0	0	0	114.3	D449 R450 Y455 K457 H459	D449-N453 WeakPolarHBondContact O-CB 3.32Å; D449-N453 PolarHBondContact O-N 3.46Å; D449-N453 PolarHBondContact O-ND2 2.85Å; D449-N453 VanDerWaalsContact O-ND2 3.09Å; D449-N453 PolarHBondContact OD1-ND2 3.38Å; R450-N453 PolarHBondContact O-N 2.94Å; R450-N453 VanDerWaalsContact O-O 3.1Å; N453-Y455 PolarHBondContact O-N 2.68Å; N453-K457 HydrophobicContact CB-CB 4.39Å; N453-K457 WeakPolarHBondContact CB-O 3.45Å; N453-H459 PolarHBondContact ND2-CD2 3.06Å; N453-H459 PolarHBondContact ND2-NE2 3.24Å
454	E	96.8	Very high	96.5	Very high	134 Å²	134	54.3 Å²	54.3	63%	0.626	26%	0.264	S	S	*	.			trans	-69	120.2	167.4	-179.2	-171.6	-139.5	0	0	110.3	K457	E454-K457 HydrophobicContact CB-CD 4.45Å; E454-K457 WeakPolarHBondContact O-CB 3.1Å; E454-K457 WeakPolarHBondContact O-CG 3.44Å; E454-K457 PolarHBondContact O-N 2.66Å; E454-K457 IonicContact OE2-NZ 3.57Å; E454-K457 PolarHBondContact OE2-NZ 3.01Å
455	Y	95.8	Very high	96.6	Very high	154 Å²	154	52.8 Å²	52.8	60%	0.604	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	135.3	177.9	179.6	-86.5	0	0	0	111.9	F341 N453	F341-Y455 HydrophobicContact CE2-CE2 4.23Å; F341-Y455 AromaticContact CE2-CZ 3.89Å; F341-Y455 VanDerWaalsContact CE2-OH 3.3Å; F341-Y455 WeakPolarHBondContact CE2-OH 3.38Å; N453-Y455 PolarHBondContact O-N 2.68Å
456	P	95.1	Very high	96.6	Very high	52 Å²	52	52.8 Å²	52.8	34%	0.338	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	cis	-94.3	11.7	8.5	37.7	-37	0	0	0	115	D340 F341 R450	D340-P456 WeakPolarHBondContact CA-O 3.45Å; D340-P456 WeakPolarHBondContact CB-O 3.33Å; F341-P456 HydrophobicContact CD2-CB 3.83Å; F341-P456 HydrophobicContact CE2-CB 3.97Å; R450-P456 PolarHBondContact NH1-O 2.8Å
457	K	95.6	Very high	96.7	Very high	112 Å²	112	53.8 Å²	53.8	49%	0.487	26%	0.264	S	S	.	.			trans	-63.2	154.2	-175.7	-55.8	162.8	-174.9	165.4	0	111.7	R450 N453 E454	R450-K457 PolarHBondContact NH1-O 3.31Å; R450-K457 VanDerWaalsContact NH1-O 3.11Å; N453-K457 HydrophobicContact CB-CB 4.39Å; N453-K457 WeakPolarHBondContact CB-O 3.45Å; E454-K457 HydrophobicContact CB-CD 4.45Å; E454-K457 WeakPolarHBondContact O-CB 3.1Å; E454-K457 WeakPolarHBondContact O-CG 3.44Å; E454-K457 PolarHBondContact O-N 2.66Å; E454-K457 IonicContact OE2-NZ 3.57Å; E454-K457 PolarHBondContact OE2-NZ 3.01Å
458	L	96.1	Very high	96.7	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.094	25%	0.248	C	C	.	.			trans	-152.5	152.5	177	-70.4	174.5	0	0	0	108.6	D449 R450 P461	D449-L458 HydrophobicContact CB-CD2 4.07Å; D449-L458 WeakPolarHBondContact OD2-CB 3.43Å; R450-L458 HydrophobicContact CG-CD2 3.92Å; R450-L458 VanDerWaalsContact NH1-CG 3.31Å; L458-P461 HydrophobicContact CB-CB 4.22Å; L458-P461 HydrophobicContact CD1-CB 4.18Å
459	H	95.2	Very high	96.8	Very high	68 Å²	68	45.7 Å²	45.7	32%	0.315	24%	0.235	S	C	.	.	S	Bend	trans	-77.3	-36.4	163.2	-59.7	-49.3	0	0	0	111.5	P416 D449 N453 P461	P416-H459 HydrophobicContact CB-CB 4Å; D449-H459 IonicContact OD1-CD2 3.59Å; D449-H459 PolarHBondContact OD1-CD2 3.06Å; D449-H459 IonicContact OD1-CG 3.61Å; D449-H459 PolarHBondContact OD1-N 3.47Å; D449-H459 PolarHBondContact OD2-N 3.22Å; N453-H459 PolarHBondContact ND2-CD2 3.06Å; N453-H459 PolarHBondContact ND2-NE2 3.24Å; H459-P461 VanDerWaalsContact C-CD 3.46Å; H459-P461 VanDerWaalsContact O-CD 3.31Å; H459-P461 WeakPolarHBondContact O-CD 3.44Å
460	Y	96.9	Very high	96.9	Very high	1 Å²	1	45.6 Å²	45.6	0%	0.004	24%	0.235	C	C	.	.			trans	-123.1	73.4	-177.9	-54	-77.6	0	0	0	110.7	L412 L413 I417 V425 V427 R446 D449 E462	L412-Y460 HydrophobicContact CB-CE2 3.82Å; L412-Y460 HydrophobicContact CD2-CE1 4.31Å; L412-Y460 WeakPolarHBondContact O-CE2 3.33Å; L412-Y460 PolarHBondContact O-OH 3.22Å; L413-Y460 HydrophobicContact CD2-CD2 4.06Å; L413-Y460 HydrophobicContact CD2-CE2 3.97Å; I417-Y460 HydrophobicContact CB-CE1 4.28Å; I417-Y460 HydrophobicContact CD1-CE1 4.44Å; I417-Y460 PolarHBondContact N-OH 3.41Å; I417-Y460 VanDerWaalsContact N-OH 3.08Å; V425-Y460 HydrophobicContact CG1-CD1 3.99Å; V425-Y460 HydrophobicContact CG1-CE1 3.88Å; V427-Y460 HydrophobicContact CG2-CD1 3.55Å; V427-Y460 HydrophobicContact CG2-CE1 4.07Å; V427-Y460 HydrophobicContact CG2-CG 4.18Å; R446-Y460 PolarHBondContact NH2-O 3.4Å; D449-Y460 PolarHBondContact OD2-N 3.17Å; Y460-E462 VanDerWaalsContact C-N 3.28Å; Y460-E462 PolarHBondContact O-N 3.46Å
461	P	96.3	Very high	96.9	Very high	19 Å²	19	46.4 Å²	46.4	12%	0.123	24%	0.24	C	C	.	.			trans	-67.5	-28.3	179.2	28.2	-35.3	0	0	0	113.1	I338 G339 D340 R446 L458 H459	I338-P461 HydrophobicContact CB-CB 4.5Å; I338-P461 HydrophobicContact CD1-CB 3.89Å; I338-P461 HydrophobicContact CD1-CG 3.96Å; I338-P461 HydrophobicContact CG1-CB 4.04Å; G339-P461 PolarHBondContact N-O 2.89Å; D340-P461 HydrophobicContact CB-CB 3.9Å; R446-P461 PolarHBondContact NH2-O 3.4Å; L458-P461 HydrophobicContact CB-CB 4.22Å; L458-P461 HydrophobicContact CD1-CB 4.18Å; H459-P461 VanDerWaalsContact C-CD 3.46Å; H459-P461 VanDerWaalsContact O-CD 3.31Å; H459-P461 WeakPolarHBondContact O-CD 3.44Å
462	E	97.1	Very high	97	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	23%	0.225	C	C	.	.			trans	-109.3	101.4	-176.5	-170.6	166.2	-172.7	0	0	111.5	I338 Y345 L346 R424 I426 V427 Y460 Y464	I338-E462 HydrophobicContact CB-CB 4.37Å; I338-E462 HydrophobicContact CD1-CB 4.39Å; I338-E462 HydrophobicContact CG2-CB 4.09Å; I338-E462 HydrophobicContact CG2-CG 4.02Å; Y345-E462 HydrophobicContact CD1-CG 4.21Å; L346-E462 WeakPolarHBondContact CB-OE1 3.34Å; L346-E462 PolarHBondContact N-OE1 3.35Å; R424-E462 VanDerWaalsContact CD-OE2 3.28Å; R424-E462 WeakPolarHBondContact CD-OE2 3.44Å; R424-E462 IonicContact CZ-OE2 3.84Å; R424-E462 IonicContact NE-OE2 2.69Å; R424-E462 IonicContact NH1-OE1 2.76Å; R424-E462 IonicContact NH1-OE2 3.83Å; R424-E462 PolarHBondContact NH1-OE2 3.31Å; I426-E462 HydrophobicContact CD1-CG 4.23Å; I426-E462 HydrophobicContact CG1-CB 4.28Å; I426-E462 HydrophobicContact CG1-CG 3.98Å; I426-E462 HydrophobicContact CG2-CG 4.37Å; V427-E462 PolarHBondContact N-O 2.93Å; Y460-E462 VanDerWaalsContact C-N 3.28Å; Y460-E462 PolarHBondContact O-N 3.46Å; E462-Y464 HydrophobicContact CG-CD2 4.42Å; E462-Y464 HydrophobicContact CG-CE2 3.54Å; E462-Y464 PolarHBondContact OE1-OH 3.24Å
463	L	98.2	Very high	97.3	Very high	11 Å²	11	40.9 Å²	40.9	6%	0.058	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143	-179.5	-58.4	-179.4	0	0	0	110	V427 F429 R446	V427-L463 HydrophobicContact CB-CD2 3.74Å; V427-L463 HydrophobicContact CG2-CD2 4.2Å; V427-L463 WeakPolarHBondContact O-CA 3.2Å; F429-L463 HydrophobicContact CE2-CD1 4.44Å; F429-L463 HydrophobicContact CE2-CD2 4.06Å; R446-L463 HydrophobicContact CB-CD1 4.09Å
464	Y	98.6	Very high	97.4	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	163.9	174.1	-57.7	-89.1	0	0	0	112.4	Y345 L346 F347 T349 K358 I360 I426 V427 V428 F429 E462	Y345-Y464 WeakPolarHBondContact CB-OH 3.25Å; Y345-Y464 AromaticContact CD1-CE1 3.71Å; Y345-Y464 HydrophobicContact CD1-CE1 3.71Å; Y345-Y464 AromaticContact CD1-CZ 3.72Å; Y345-Y464 HydrophobicContact CE1-CE1 4.49Å; Y345-Y464 HydrophobicContact CG-CE1 4.39Å; L346-Y464 PolarHBondContact N-OH 3.09Å; L346-Y464 VanDerWaalsContact N-OH 3.15Å; F347-Y464 HydrophobicContact CB-CE1 4.15Å; F347-Y464 AromaticContact CD2-CD2 3.97Å; F347-Y464 HydrophobicContact CD2-CD2 3.97Å; F347-Y464 HydrophobicContact CD2-CE1 4.18Å; F347-Y464 AromaticContact CD2-CE2 3.41Å; F347-Y464 HydrophobicContact CD2-CE2 3.41Å; F347-Y464 VanDerWaalsContact CD2-CE2 3.41Å; F347-Y464 AromaticContact CD2-CZ 3.52Å; F347-Y464 HydrophobicContact CE2-CD2 4.31Å; F347-Y464 AromaticContact CE2-CE2 3.86Å; F347-Y464 HydrophobicContact CE2-CE2 3.86Å; F347-Y464 HydrophobicContact CG-CE2 4.41Å; F347-Y464 PolarHBondContact N-OH 2.76Å; F347-Y464 VanDerWaalsContact N-OH 3.1Å; T349-Y464 HydrophobicContact CG2-CD1 4.3Å; T349-Y464 HydrophobicContact CG2-CE1 3.84Å; K358-Y464 HydrophobicContact CB-CD1 3.92Å; K358-Y464 HydrophobicContact CB-CE1 4.35Å; K358-Y464 CarbonylContact O-C 3.49Å; K358-Y464 WeakPolarHBondContact O-CA 3.38Å; I360-Y464 HydrophobicContact CG2-CD1 3.54Å; I360-Y464 HydrophobicContact CG2-CE1 3.99Å; I360-Y464 HydrophobicContact CG2-CG 3.88Å; I426-Y464 HydrophobicContact CD1-CE2 4.49Å; I426-Y464 HydrophobicContact CG2-CD2 3.61Å; I426-Y464 HydrophobicContact CG2-CE2 3.61Å; V427-Y464 PolarHBondContact O-N 3.49Å; V428-Y464 WeakPolarHBondContact CA-O 3.45Å; V428-Y464 HydrophobicContact CG2-CD2 4.44Å; F429-Y464 PolarHBondContact N-O 3.5Å; E462-Y464 HydrophobicContact CG-CD2 4.42Å; E462-Y464 HydrophobicContact CG-CE2 3.54Å; E462-Y464 PolarHBondContact OE1-OH 3.24Å
465	V	98.7	Very high	97.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.6	167.1	-178.3	0	0	0	0	110.3	L357 K358 Y359 I360 F429 P439 C442 K467	L357-V465 HydrophobicContact CB-CG2 4.41Å; L357-V465 HydrophobicContact CD1-CG2 4.1Å; K358-V465 PolarHBondContact O-N 3.42Å; Y359-V465 CarbonylContact C-O 3.57Å; Y359-V465 WeakPolarHBondContact CA-O 3.26Å; Y359-V465 HydrophobicContact CD1-CB 3.72Å; Y359-V465 HydrophobicContact CD1-CG1 3.73Å; Y359-V465 HydrophobicContact CE1-CB 3.73Å; Y359-V465 HydrophobicContact CE1-CG1 3.45Å; Y359-V465 VanDerWaalsContact CE1-CG1 3.45Å; Y359-V465 HydrophobicContact CG-CB 4.25Å; I360-V465 PolarHBondContact N-O 3.15Å; F429-V465 VanDerWaalsContact O-CA 3.32Å; F429-V465 WeakPolarHBondContact O-CA 3.46Å; P439-V465 HydrophobicContact CG-CG1 4.24Å; C442-V465 HydrophobicContact CB-CG2 4.2Å; V465-K467 PolarHBondContact O-N 2.67Å
466	L	98.6	Very high	97.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	117	174.8	-176.6	59	0	0	0	110.5	I360 M365 I396 V428 F429 H430 S434 G469 F473	I360-L466 HydrophobicContact CG1-CD1 4.26Å; M365-L466 HydrophobicContact CB-CD1 3.87Å; M365-L466 HydrophobicContact CE-CB 4.5Å; M365-L466 HydrophobicContact CE-CD1 4.33Å; M365-L466 HydrophobicContact CE-CD2 3.98Å; M365-L466 HydrophobicContact CG-CD1 4.32Å; I396-L466 HydrophobicContact CD1-CD2 3.58Å; V428-L466 HydrophobicContact CG1-CB 4.23Å; F429-L466 PolarHBondContact O-N 2.75Å; H430-L466 HydrophobicContact CB-CB 3.76Å; H430-L466 HydrophobicContact CB-CD2 4.26Å; S434-L466 WeakPolarHBondContact CB-O 3.25Å; S434-L466 PolarHBondContact OG-O 3.48Å; L466-G469 PolarHBondContact O-N 2.85Å; L466-F473 HydrophobicContact CD2-CB 4.02Å; L466-F473 HydrophobicContact CD2-CD2 4.17Å; L466-F473 HydrophobicContact CD2-CG 4.25Å
467	K	98.4	Very high	97.5	Very high	79 Å²	79	35.7 Å²	35.7	34%	0.343	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	135.9	177.9	-175.7	167.6	177.7	167.1	0	111.2	V350 A351 Y359 I360 V465 G469	V350-K467 HydrophobicContact CB-CD 4.39Å; V350-K467 HydrophobicContact CG2-CB 4.13Å; V350-K467 HydrophobicContact CG2-CD 3.61Å; A351-K467 WeakPolarHBondContact O-CE 3.27Å; A351-K467 PolarHBondContact O-NZ 3.5Å; Y359-K467 HydrophobicContact CD1-CB 4.34Å; I360-K467 WeakPolarHBondContact O-CB 3.3Å; I360-K467 PolarHBondContact O-N 2.82Å; V465-K467 PolarHBondContact O-N 2.67Å; K467-G469 PolarHBondContact O-N 3.35Å; K467-G469 VanDerWaalsContact O-N 3.14Å
468	G	97.6	Very high	97.5	Very high	22 Å²	22	35.1 Å²	35.1	23%	0.227	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	-2.3	-178.8	0	0	0	0	0	115.1	F433 E472	F433-G468 CarbonylContact O-C 3.54Å; G468-E472 WeakPolarHBondContact CA-OE2 3.44Å; G468-E472 PolarHBondContact O-N 3.08Å; G468-E472 VanDerWaalsContact O-N 3.16Å
469	G	98.5	Very high	97.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	60.8	-161.1	178.7	0	0	0	0	0	114.1	C431 E432 S434 L466 K467 K471 E472 F473	C431-G469 CarbonylContact O-C 3.53Å; C431-G469 WeakPolarHBondContact O-CA 3.39Å; E432-G469 CarbonylContact O-C 3.56Å; E432-G469 WeakPolarHBondContact O-CA 3.22Å; S434-G469 WeakPolarHBondContact OG-CA 3.44Å; L466-G469 PolarHBondContact O-N 2.85Å; K467-G469 PolarHBondContact O-N 3.35Å; K467-G469 VanDerWaalsContact O-N 3.14Å; G469-K471 PolarHBondContact O-N 3.41Å; G469-E472 PolarHBondContact O-N 3.15Å; G469-F473 WeakPolarHBondContact O-CB 3.47Å; G469-F473 PolarHBondContact O-N 2.78Å; G469-F473 VanDerWaalsContact O-N 3.09Å
470	Y	98.8	Very high	97.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-32.2	178.1	-174.3	-107.6	0	0	0	112	G394 H395 I396 C431 E432 F473 F474 C481 S485 Y486	G394-Y470 VanDerWaalsContact C-CZ 3.43Å; G394-Y470 VanDerWaalsContact C-OH 3.23Å; G394-Y470 WeakPolarHBondContact O-CE1 3.33Å; G394-Y470 PolarHBondContact O-OH 2.87Å; H395-Y470 PolarHBondContact N-OH 3.14Å; I396-Y470 HydrophobicContact CD1-CD2 4.44Å; I396-Y470 HydrophobicContact CG1-CD2 3.68Å; I396-Y470 HydrophobicContact CG1-CE2 3.96Å; C431-Y470 PolarHBondContact O-N 3.49Å; E432-Y470 PolarHBondContact O-N 2.99Å; E432-Y470 VanDerWaalsContact O-N 3.17Å; Y470-F473 PolarHBondContact O-N 2.88Å; Y470-F474 HydrophobicContact CE1-CB 4.18Å; Y470-F474 HydrophobicContact CE1-CD2 4.31Å; Y470-F474 HydrophobicContact CE1-CG 4.48Å; Y470-F474 WeakPolarHBondContact O-CB 3.16Å; Y470-F474 PolarHBondContact O-N 2.68Å; Y470-F474 WeakPolarHBondContact OH-CD2 3.29Å; Y470-C481 HydrophobicContact CE2-CB 4.39Å; Y470-C481 VanDerWaalsContact CE2-SG 3.57Å; Y470-C481 VanDerWaalsContact OH-CB 3.32Å; Y470-C481 WeakPolarHBondContact OH-CB 3.41Å; Y470-C481 PolarHBondContact OH-SG 3.37Å; Y470-C481 VanDerWaalsContact OH-SG 3.35Å; Y470-S485 PolarHBondContact OH-O 2.92Å; Y470-Y486 AromaticContact CD1-CD2 3.72Å; Y470-Y486 HydrophobicContact CD1-CD2 3.72Å; Y470-Y486 HydrophobicContact CD1-CE2 4.38Å; Y470-Y486 AromaticContact CE1-CD2 3.9Å; Y470-Y486 HydrophobicContact CE1-CD2 3.9Å; Y470-Y486 HydrophobicContact CE1-CG 4.45Å
471	K	98.4	Very high	97.7	Very high	83 Å²	83	38.1 Å²	38.1	36%	0.361	19%	0.192	S	C	.	.	H	α-helix	trans	-64.3	-45.1	179.5	-174	-178.2	-177.2	-69.3	0	112.7	E432 F433 G469 M475 Y486	E432-K471 WeakPolarHBondContact O-CB 3.49Å; E432-K471 PolarHBondContact O-N 2.91Å; F433-K471 HydrophobicContact CD1-CD 3.91Å; F433-K471 HydrophobicContact CE1-CD 3.38Å; F433-K471 HydrophobicContact CZ-CD 4.17Å; G469-K471 PolarHBondContact O-N 3.41Å; K471-M475 VanDerWaalsContact O-CG 3.23Å; K471-M475 WeakPolarHBondContact O-CG 3.24Å; K471-Y486 HydrophobicContact CB-CE2 4.27Å; K471-Y486 HydrophobicContact CD-CE1 4.34Å; K471-Y486 HydrophobicContact CG-CE1 3.99Å
472	E	98.3	Very high	97.8	Very high	64 Å²	64	42.3 Å²	42.3	30%	0.299	21%	0.21	S	C	.	.	H	α-helix	trans	-72.7	-39.4	175.6	-165.1	-170.4	139.3	0	0	111.3	P362 G468 G469 M475 K476	P362-E472 HydrophobicContact CG-CG 4.27Å; G468-E472 WeakPolarHBondContact CA-OE2 3.44Å; G468-E472 PolarHBondContact O-N 3.08Å; G468-E472 VanDerWaalsContact O-N 3.16Å; G469-E472 PolarHBondContact O-N 3.15Å; E472-M475 PolarHBondContact O-N 2.88Å; E472-K476 HydrophobicContact CG-CD 4.3Å; E472-K476 PolarHBondContact O-N 3.48Å; E472-K476 WeakPolarHBondContact OE1-CE 3.14Å; E472-K476 IonicContact OE1-NZ 2.68Å; E472-K476 PolarHBondContact OE1-NZ 3.3Å
473	F	98.4	Very high	97.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-49.6	178.3	-176.4	-92.1	0	0	0	112.2	P362 M365 L369 I396 L466 G469 Y470 M475 K476 C477	P362-F473 HydrophobicContact CB-CD2 3.91Å; M365-F473 HydrophobicContact CB-CD2 4.18Å; M365-F473 HydrophobicContact CB-CE2 3.81Å; M365-F473 HydrophobicContact CG-CD2 3.99Å; M365-F473 HydrophobicContact CG-CE2 3.47Å; M365-F473 VanDerWaalsContact CG-CE2 3.47Å; M365-F473 HydrophobicContact CG-CZ 4.18Å; L369-F473 HydrophobicContact CD1-CZ 4Å; I396-F473 HydrophobicContact CB-CE1 4.29Å; I396-F473 HydrophobicContact CD1-CB 4.45Å; I396-F473 HydrophobicContact CD1-CD1 3.73Å; I396-F473 HydrophobicContact CD1-CD2 4.24Å; I396-F473 HydrophobicContact CD1-CE1 3.98Å; I396-F473 HydrophobicContact CD1-CE2 4.48Å; I396-F473 HydrophobicContact CD1-CG 3.86Å; I396-F473 HydrophobicContact CD1-CZ 4.35Å; I396-F473 HydrophobicContact CG1-CD1 3.71Å; I396-F473 HydrophobicContact CG1-CE1 3.81Å; I396-F473 HydrophobicContact CG1-CG 4.36Å; I396-F473 HydrophobicContact CG2-CE1 3.78Å; I396-F473 HydrophobicContact CG2-CZ 3.9Å; L466-F473 HydrophobicContact CD2-CB 4.02Å; L466-F473 HydrophobicContact CD2-CD2 4.17Å; L466-F473 HydrophobicContact CD2-CG 4.25Å; G469-F473 WeakPolarHBondContact O-CB 3.47Å; G469-F473 PolarHBondContact O-N 2.78Å; G469-F473 VanDerWaalsContact O-N 3.09Å; Y470-F473 PolarHBondContact O-N 2.88Å; F473-M475 VanDerWaalsContact C-N 3.33Å; F473-M475 PolarHBondContact O-N 3.21Å; F473-K476 PolarHBondContact O-N 3.25Å; F473-K476 VanDerWaalsContact O-N 3.12Å; F473-C477 HydrophobicContact CD1-CB 4.26Å; F473-C477 HydrophobicContact CD2-CB 4.16Å; F473-C477 HydrophobicContact CE1-CB 3.92Å; F473-C477 HydrophobicContact CE2-CB 3.81Å; F473-C477 HydrophobicContact CG-CB 4.37Å; F473-C477 HydrophobicContact CZ-CB 3.69Å; F473-C477 WeakPolarHBondContact O-CA 3.17Å; F473-C477 VanDerWaalsContact O-CB 3.3Å; F473-C477 WeakPolarHBondContact O-CB 3.35Å; F473-C477 PolarHBondContact O-N 3.5Å
474	F	98.4	Very high	97.7	Very high	22 Å²	22	48.2 Å²	48.2	10%	0.096	25%	0.249	C	C	.	.	H	α-helix	trans	-53.9	-48	178.6	177.1	-97.9	0	0	0	112.1	Y470 K476 C477 Q478 C481 P484 S485	Y470-F474 HydrophobicContact CE1-CB 4.18Å; Y470-F474 HydrophobicContact CE1-CD2 4.31Å; Y470-F474 HydrophobicContact CE1-CG 4.48Å; Y470-F474 WeakPolarHBondContact O-CB 3.16Å; Y470-F474 PolarHBondContact O-N 2.68Å; Y470-F474 WeakPolarHBondContact OH-CD2 3.29Å; F474-K476 PolarHBondContact O-N 2.92Å; F474-C477 PolarHBondContact O-N 3.41Å; F474-Q478 HydrophobicContact CD2-CG 4.3Å; F474-Q478 HydrophobicContact CE2-CB 4.47Å; F474-Q478 HydrophobicContact CE2-CG 3.69Å; F474-Q478 HydrophobicContact CZ-CG 4Å; F474-Q478 WeakPolarHBondContact O-CA 3.43Å; F474-Q478 WeakPolarHBondContact O-CB 3.44Å; F474-Q478 PolarHBondContact O-N 2.93Å; F474-Q478 VanDerWaalsContact O-N 3.1Å; F474-C481 HydrophobicContact CD2-CB 4.2Å; F474-P484 WeakPolarHBondContact CE2-O 3.42Å; F474-S485 WeakPolarHBondContact CD2-O 3.35Å; F474-S485 WeakPolarHBondContact CE2-O 3.48Å
475	M	97.6	Very high	97.7	Very high	125 Å²	125	50.6 Å²	50.6	62%	0.616	27%	0.265	S	S	*	.	H	α-helix	trans	-67.2	-22.2	-178	-62.6	-66.5	169.6	0	0	113.6	K471 E472 F473 Y486	K471-M475 VanDerWaalsContact O-CG 3.23Å; K471-M475 WeakPolarHBondContact O-CG 3.24Å; E472-M475 PolarHBondContact O-N 2.88Å; F473-M475 VanDerWaalsContact C-N 3.33Å; F473-M475 PolarHBondContact O-N 3.21Å; M475-Y486 HydrophobicContact CE-CD1 4.45Å
476	K	96.7	Very high	97.7	Very high	107 Å²	107	53 Å²	53	47%	0.465	28%	0.275	S	S	.	.	H	α-helix	trans	-99.7	-25.6	177.3	-73.2	178.8	168.6	-178.6	0	114	P362 E363 E472 F473 F474	P362-K476 HydrophobicContact CB-CB 4.41Å; P362-K476 HydrophobicContact CB-CD 3.86Å; P362-K476 HydrophobicContact CG-CD 4Å; E363-K476 IonicContact OE1-NZ 3.72Å; E363-K476 PolarHBondContact OE1-NZ 2.79Å; E472-K476 HydrophobicContact CG-CD 4.3Å; E472-K476 PolarHBondContact O-N 3.48Å; E472-K476 WeakPolarHBondContact OE1-CE 3.14Å; E472-K476 IonicContact OE1-NZ 2.68Å; E472-K476 PolarHBondContact OE1-NZ 3.3Å; F473-K476 PolarHBondContact O-N 3.25Å; F473-K476 VanDerWaalsContact O-N 3.12Å; F474-K476 PolarHBondContact O-N 2.92Å
477	C	95.3	Very high	97.7	Very high	16 Å²	16	55.9 Å²	55.9	11%	0.108	29%	0.286	C	S	.	.	H	α-helix	trans	-143.9	31.4	-159.5	-68	0	0	0	0	113.1	F473 F474 S479 Y480	F473-C477 HydrophobicContact CD1-CB 4.26Å; F473-C477 HydrophobicContact CD2-CB 4.16Å; F473-C477 HydrophobicContact CE1-CB 3.92Å; F473-C477 HydrophobicContact CE2-CB 3.81Å; F473-C477 HydrophobicContact CG-CB 4.37Å; F473-C477 HydrophobicContact CZ-CB 3.69Å; F473-C477 WeakPolarHBondContact O-CA 3.17Å; F473-C477 VanDerWaalsContact O-CB 3.3Å; F473-C477 WeakPolarHBondContact O-CB 3.35Å; F473-C477 PolarHBondContact O-N 3.5Å; F474-C477 PolarHBondContact O-N 3.41Å; C477-S479 PolarHBondContact O-N 2.65Å; C477-Y480 HydrophobicContact CB-CD2 3.98Å; C477-Y480 WeakPolarHBondContact O-CD2 3.46Å; C477-Y480 PolarHBondContact O-N 2.83Å
478	Q	95.9	Very high	97.6	Very high	101 Å²	101	54 Å²	54	47%	0.472	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-48.4	-30	-177.1	-170.8	176.9	16.9	0	0	115.6	F474 Y480 C481 P484	F474-Q478 HydrophobicContact CD2-CG 4.3Å; F474-Q478 HydrophobicContact CE2-CB 4.47Å; F474-Q478 HydrophobicContact CE2-CG 3.69Å; F474-Q478 HydrophobicContact CZ-CG 4Å; F474-Q478 WeakPolarHBondContact O-CA 3.43Å; F474-Q478 WeakPolarHBondContact O-CB 3.44Å; F474-Q478 PolarHBondContact O-N 2.93Å; F474-Q478 VanDerWaalsContact O-N 3.1Å; Q478-Y480 PolarHBondContact O-N 3.08Å; Q478-C481 WeakPolarHBondContact O-CB 3.13Å; Q478-C481 PolarHBondContact O-N 3.43Å; Q478-C481 VanDerWaalsContact O-N 3.07Å; Q478-P484 HydrophobicContact CG-CB 4.13Å; Q478-P484 PolarHBondContact NE2-O 2.92Å
479	S	96.9	Very high	97.6	Very high	83 Å²	83	53.9 Å²	53.9	58%	0.58	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-64.5	-21.5	176.1	50.5	0	0	0	0	114.1	K397 C477	K397-S479 PolarHBondContact NZ-O 3.19Å; C477-S479 PolarHBondContact O-N 2.65Å
480	Y	97.4	Very high	97.5	Very high	64 Å²	64	59.6 Å²	59.6	25%	0.251	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-94.9	10.3	175.4	-54.8	-85	0	0	0	112.7	A366 L369 N370 K397 C477 Q478	A366-Y480 HydrophobicContact CB-CD2 4.35Å; A366-Y480 HydrophobicContact CB-CE2 4.27Å; L369-Y480 HydrophobicContact CB-CD1 4.04Å; L369-Y480 HydrophobicContact CB-CE1 4.49Å; L369-Y480 HydrophobicContact CD1-CD1 4.27Å; L369-Y480 HydrophobicContact CD1-CG 4.35Å; N370-Y480 WeakPolarHBondContact ND2-CE1 3.36Å; N370-Y480 VanDerWaalsContact ND2-CZ 3.31Å; N370-Y480 PolarHBondContact ND2-OH 2.95Å; N370-Y480 PolarHBondContact OD1-OH 3.06Å; K397-Y480 WeakPolarHBondContact CB-O 3.47Å; K397-Y480 WeakPolarHBondContact CG-O 3.45Å; K397-Y480 PolarHBondContact N-O 3.38Å; C477-Y480 HydrophobicContact CB-CD2 3.98Å; C477-Y480 WeakPolarHBondContact O-CD2 3.46Å; C477-Y480 PolarHBondContact O-N 2.83Å; Q478-Y480 PolarHBondContact O-N 3.08Å
481	C	98.1	Very high	97.4	Very high	2 Å²	2	62.3 Å²	62.3	1%	0.014	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	150.3	176.5	-64.1	0	0	0	0	112.2	H395 K397 Y470 F474 Q478	H395-C481 CarbonylContact O-C 3.55Å; H395-C481 WeakPolarHBondContact O-CA 3.38Å; K397-C481 VanDerWaalsContact CE-O 3.26Å; K397-C481 WeakPolarHBondContact CE-O 3.48Å; Y470-C481 HydrophobicContact CE2-CB 4.39Å; Y470-C481 VanDerWaalsContact CE2-SG 3.57Å; Y470-C481 VanDerWaalsContact OH-CB 3.32Å; Y470-C481 WeakPolarHBondContact OH-CB 3.41Å; Y470-C481 PolarHBondContact OH-SG 3.37Å; Y470-C481 VanDerWaalsContact OH-SG 3.35Å; F474-C481 HydrophobicContact CD2-CB 4.2Å; Q478-C481 WeakPolarHBondContact O-CB 3.13Å; Q478-C481 PolarHBondContact O-N 3.43Å; Q478-C481 VanDerWaalsContact O-N 3.07Å
482	E	97.1	Very high	97.3	Very high	108 Å²	108	64.3 Å²	64.3	51%	0.505	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	127.5	177.7	-165.7	156.5	161.9	0	0	111.3	H395 K397	H395-E482 PolarHBondContact CE1-O 3.27Å; H395-E482 PolarHBondContact N-O 2.87Å; H395-E482 PolarHBondContact ND1-O 3.28Å; H395-E482 PolarHBondContact O-N 3.03Å; K397-E482 WeakPolarHBondContact CE-OE2 3.4Å; K397-E482 HydrophobicContact CG-CB 3.79Å
483	P	97.9	Very high	97.2	Very high	54 Å²	54	67.4 Å²	67.4	35%	0.351	34%	0.344	S	S	.	.	S	Bend	cis	-47.7	159.1	-28.6	25.3	-35.9	0	0	0	112	E392 G394 S485	E392-P483 WeakPolarHBondContact O-CG 3.36Å; G394-P483 WeakPolarHBondContact CA-O 3.46Å; P483-S485 WeakPolarHBondContact CG-OG 3.1Å; P483-S485 PolarHBondContact O-N 2.66Å
484	P	97	Very high	97.1	Very high	82 Å²	82	69.1 Å²	69.1	53%	0.532	35%	0.351	S	S	.	.	S	Bend	trans	-75.7	47.1	-179.3	33.6	-37.3	0	0	0	112.6	F474 Q478	F474-P484 WeakPolarHBondContact CE2-O 3.42Å; Q478-P484 HydrophobicContact CG-CB 4.13Å; Q478-P484 PolarHBondContact NE2-O 2.92Å
485	S	97.9	Very high	97	Very high	50 Å²	50	73 Å²	73	35%	0.35	37%	0.368	S	S	.	.			trans	-125.4	173.7	177.2	53.1	0	0	0	0	111.6	G393 Y470 F474 P483	G393-S485 CarbonylContact O-C 3.22Å; G393-S485 PolarHBondContact O-OG 3.19Å; Y470-S485 PolarHBondContact OH-O 2.92Å; F474-S485 WeakPolarHBondContact CD2-O 3.35Å; F474-S485 WeakPolarHBondContact CE2-O 3.48Å; P483-S485 WeakPolarHBondContact CG-OG 3.1Å; P483-S485 PolarHBondContact O-N 2.66Å
486	Y	98.3	Very high	96.9	Very high	52 Å²	52	75 Å²	75	20%	0.204	38%	0.376	C	S	.	.			trans	-136.8	117.4	173.6	161.7	-122.3	0	0	0	109.6	E432 Y470 K471 M475 P488	E432-Y486 HydrophobicContact CG-CE2 4.14Å; E432-Y486 WeakPolarHBondContact CG-OH 3.48Å; E432-Y486 PolarHBondContact OE1-OH 3.47Å; E432-Y486 VanDerWaalsContact OE1-OH 3.06Å; Y470-Y486 AromaticContact CD1-CD2 3.72Å; Y470-Y486 HydrophobicContact CD1-CD2 3.72Å; Y470-Y486 HydrophobicContact CD1-CE2 4.38Å; Y470-Y486 AromaticContact CE1-CD2 3.9Å; Y470-Y486 HydrophobicContact CE1-CD2 3.9Å; Y470-Y486 HydrophobicContact CE1-CG 4.45Å; K471-Y486 HydrophobicContact CB-CE2 4.27Å; K471-Y486 HydrophobicContact CD-CE1 4.34Å; K471-Y486 HydrophobicContact CG-CE1 3.99Å; M475-Y486 HydrophobicContact CE-CD1 4.45Å; Y486-P488 HydrophobicContact CE1-CB 4.44Å
487	R	98.1	Very high	96.8	Very high	59 Å²	59	71.9 Å²	71.9	22%	0.223	36%	0.364	C	S	.	.			trans	-103.2	117.6	170.3	-170.2	-178.6	-68.9	154.1	-11.4	109.3	Y389 G393 H491 F494	Y389-R487 WeakPolarHBondContact O-CD 3.12Å; Y389-R487 PolarHBondContact O-NH1 2.98Å; G393-R487 PolarHBondContact O-N 3.12Å; R487-H491 HydrophobicContact CG-CB 3.98Å; R487-F494 VanDerWaalsContact CZ-CE2 3.41Å; R487-F494 VanDerWaalsContact NE-CE2 3.34Å
488	P	98.1	Very high	96.7	Very high	39 Å²	39	71.8 Å²	71.8	25%	0.253	36%	0.363	S	S	.	.			trans	-70.6	163.8	174.8	29.8	-36.8	0	0	0	112.4	E432 Y486 H490 H491	E432-P488 WeakPolarHBondContact OE1-CA 3.46Å; E432-P488 VanDerWaalsContact OE1-CB 3.24Å; E432-P488 WeakPolarHBondContact OE1-CB 3.4Å; Y486-P488 HydrophobicContact CE1-CB 4.44Å; P488-H490 VanDerWaalsContact C-N 3.3Å; P488-H490 PolarHBondContact O-N 3.18Å; P488-H491 HydrophobicContact CG-CB 4.42Å
489	M	97.3	Very high	96.6	Very high	21 Å²	21	73.7 Å²	73.7	10%	0.103	37%	0.369	C	S	.	.	S	Bend	trans	-60.6	-39.1	176.3	179.9	177.7	155.5	0	0	112.3	Y387 Y389 E432 R437 H491 L498	Y387-M489 HydrophobicContact CE2-CE 4.17Å; Y387-M489 HydrophobicContact CE2-CG 4.5Å; Y389-M489 PolarHBondContact OH-O 2.8Å; E432-M489 PolarHBondContact OE1-N 3.38Å; E432-M489 WeakPolarHBondContact OE2-CB 3.45Å; R437-M489 PolarHBondContact NH2-SD 3.11Å; M489-H491 PolarHBondContact O-N 3.22Å; M489-L498 HydrophobicContact CE-CD1 3.61Å; M489-L498 HydrophobicContact CG-CD1 4.12Å
490	H	96.4	Very high	96.4	Very high	120 Å²	120	75.1 Å²	75.1	56%	0.556	37%	0.365	S	S	*	.	S	Bend	trans	-99.8	64.2	178.4	-57.1	95.5	0	0	0	110.2	P488	P488-H490 VanDerWaalsContact C-N 3.3Å; P488-H490 PolarHBondContact O-N 3.18Å
491	H	96.6	Very high	96.1	Very high	57 Å²	57	73 Å²	73	26%	0.264	36%	0.357	S	S	.	.			trans	-89.5	137.6	171.3	-166.4	-77.9	0	0	0	110.1	R487 P488 M489 D493 F494	R487-H491 HydrophobicContact CG-CB 3.98Å; P488-H491 HydrophobicContact CG-CB 4.42Å; M489-H491 PolarHBondContact O-N 3.22Å; H491-D493 IonicContact CE1-OD1 3.64Å; H491-D493 IonicContact CE1-OD2 3.66Å; H491-D493 PolarHBondContact CE1-OD2 2.88Å; H491-D493 VanDerWaalsContact CE1-OD2 3.22Å; H491-D493 PolarHBondContact ND1-N 3.22Å; H491-D493 IonicContact ND1-OD2 2.65Å; H491-D493 PolarHBondContact O-N 3.45Å; H491-F494 HydrophobicContact CB-CB 4.45Å; H491-F494 HydrophobicContact CB-CD2 4.13Å; H491-F494 AromaticContact ND1-CD2 3.66Å; H491-F494 PolarHBondContact O-N 3.49Å; H491-F494 VanDerWaalsContact O-N 3.08Å
492	E	96.1	Very high	95.6	Very high	125 Å²	125	78.6 Å²	78.6	58%	0.584	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-52.9	-55.4	-175.1	-69.1	-62.9	102.9	0	0	112.4	F494 K495	E492-F494 PolarHBondContact O-N 3.23Å; E492-K495 WeakPolarHBondContact O-CG 3.41Å; E492-K495 PolarHBondContact O-N 3.02Å; E492-K495 WeakPolarHBondContact OE1-CE 3.21Å; E492-K495 IonicContact OE1-NZ 3.71Å; E492-K495 PolarHBondContact OE1-NZ 3.33Å; E492-K495 IonicContact OE2-NZ 3.97Å; E492-K495 PolarHBondContact OE2-NZ 3.44Å
493	D	95.9	Very high	95	Very high	129 Å²	129	77.5 Å²	77.5	69%	0.69	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-61.2	-15.3	-179	-43	-11.9	0	0	0	114.7	H491	H491-D493 IonicContact CE1-OD1 3.64Å; H491-D493 IonicContact CE1-OD2 3.66Å; H491-D493 PolarHBondContact CE1-OD2 2.88Å; H491-D493 VanDerWaalsContact CE1-OD2 3.22Å; H491-D493 PolarHBondContact ND1-N 3.22Å; H491-D493 IonicContact ND1-OD2 2.65Å; H491-D493 PolarHBondContact O-N 3.45Å
494	F	95.8	Very high	94	Very high	35 Å²	35	80.2 Å²	80.2	15%	0.154	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-115.1	16.4	-172.3	-66.3	-86.3	0	0	0	113.6	Y389 R487 H491 E492 E496 D497 L498	Y389-F494 HydrophobicContact CD2-CB 3.51Å; Y389-F494 AromaticContact CD2-CD1 3.91Å; Y389-F494 HydrophobicContact CD2-CD1 3.91Å; Y389-F494 HydrophobicContact CD2-CD2 4.41Å; Y389-F494 AromaticContact CD2-CG 3.67Å; Y389-F494 HydrophobicContact CD2-CG 3.67Å; Y389-F494 HydrophobicContact CE2-CB 3.71Å; Y389-F494 HydrophobicContact CE2-CG 4.36Å; Y389-F494 HydrophobicContact CG-CB 4.11Å; Y389-F494 AromaticContact CG-CD1 3.88Å; Y389-F494 HydrophobicContact CG-CD1 3.88Å; Y389-F494 HydrophobicContact CG-CG 4.12Å; R487-F494 VanDerWaalsContact CZ-CE2 3.41Å; R487-F494 VanDerWaalsContact NE-CE2 3.34Å; H491-F494 HydrophobicContact CB-CB 4.45Å; H491-F494 HydrophobicContact CB-CD2 4.13Å; H491-F494 AromaticContact ND1-CD2 3.66Å; H491-F494 PolarHBondContact O-N 3.49Å; H491-F494 VanDerWaalsContact O-N 3.08Å; E492-F494 PolarHBondContact O-N 3.23Å; F494-E496 PolarHBondContact O-N 3.45Å; F494-D497 PolarHBondContact O-N 3.48Å; F494-L498 WeakPolarHBondContact O-CB 3.35Å; F494-L498 PolarHBondContact O-N 3.16Å
495	K	95.7	Very high	92.9	Very high	104 Å²	104	77.9 Å²	77.9	45%	0.452	37%	0.371	S	S	.	.	H	α-helix	trans	-55.8	-35.6	175.6	-77.3	170.1	174.7	171.5	0	113.3	E492 K499	E492-K495 WeakPolarHBondContact O-CG 3.41Å; E492-K495 PolarHBondContact O-N 3.02Å; E492-K495 WeakPolarHBondContact OE1-CE 3.21Å; E492-K495 IonicContact OE1-NZ 3.71Å; E492-K495 PolarHBondContact OE1-NZ 3.33Å; E492-K495 IonicContact OE2-NZ 3.97Å; E492-K495 PolarHBondContact OE2-NZ 3.44Å; K495-K499 WeakPolarHBondContact O-CG 3.32Å; K495-K499 PolarHBondContact O-N 3.25Å
496	E	95.6	Very high	91.1	Very high	167 Å²	167	84.9 Å²	84.9	78%	0.78	39%	0.39	S	S	*	.	H	α-helix	trans	-72.5	-45.4	178	-62.8	-169.5	176.7	0	0	112.4	F494 L498 K499 K500	F494-E496 PolarHBondContact O-N 3.45Å; E496-L498 VanDerWaalsContact C-N 3.34Å; E496-L498 PolarHBondContact O-N 2.68Å; E496-K499 PolarHBondContact O-N 2.72Å; E496-K500 WeakPolarHBondContact O-CB 3.35Å; E496-K500 PolarHBondContact O-N 2.68Å
497	D	94.6	Very high	89.1	Confident	41 Å²	41	85.6 Å²	85.6	22%	0.219	40%	0.399	C	S	.	.	H	α-helix	trans	-62.6	-40.6	175	-85.7	-53.1	0	0	0	111.6	Y389 F494 K499 K500 F501	Y389-D497 HydrophobicContact CD1-CB 4Å; Y389-D497 HydrophobicContact CE1-CB 4.38Å; F494-D497 PolarHBondContact O-N 3.48Å; D497-K499 VanDerWaalsContact C-N 3.33Å; D497-K499 PolarHBondContact O-N 2.63Å; D497-K500 WeakPolarHBondContact O-CB 3.46Å; D497-K500 PolarHBondContact O-N 2.76Å; D497-K500 WeakPolarHBondContact OD1-CD 3.33Å; D497-K500 WeakPolarHBondContact OD1-CE 3.39Å; D497-K500 IonicContact OD1-NZ 2.68Å; D497-K500 PolarHBondContact OD1-NZ 2.92Å; D497-F501 HydrophobicContact CB-CD2 4.12Å; D497-F501 HydrophobicContact CB-CE2 4.02Å; D497-F501 WeakPolarHBondContact O-CD2 3.04Å; D497-F501 PolarHBondContact O-N 3.21Å
498	L	94.1	Very high	86.8	Confident	15 Å²	15	88.4 Å²	88.4	8%	0.079	41%	0.41	C	S	.	.	H	α-helix	trans	-55.5	-45.9	172.3	174.5	56.8	0	0	0	112.1	Y387 M489 F494 E496 R502	Y387-L498 HydrophobicContact CD2-CD1 4.26Å; Y387-L498 HydrophobicContact CE2-CD1 3.74Å; M489-L498 HydrophobicContact CE-CD1 3.61Å; M489-L498 HydrophobicContact CG-CD1 4.12Å; F494-L498 WeakPolarHBondContact O-CB 3.35Å; F494-L498 PolarHBondContact O-N 3.16Å; E496-L498 VanDerWaalsContact C-N 3.34Å; E496-L498 PolarHBondContact O-N 2.68Å; L498-R502 HydrophobicContact CD1-CG 4.04Å; L498-R502 VanDerWaalsContact O-CB 3.26Å; L498-R502 WeakPolarHBondContact O-CB 3.26Å; L498-R502 WeakPolarHBondContact O-CG 3.47Å; L498-R502 PolarHBondContact O-N 2.95Å
499	K	93.7	Very high	84.6	Confident	141 Å²	141	88.3 Å²	88.3	61%	0.613	41%	0.413	S	S	*	.	H	α-helix	trans	-62.7	-45.1	175.6	-73.3	177.4	177.7	-172.5	0	111.4	K495 E496 D497 T503	K495-K499 WeakPolarHBondContact O-CG 3.32Å; K495-K499 PolarHBondContact O-N 3.25Å; E496-K499 PolarHBondContact O-N 2.72Å; D497-K499 VanDerWaalsContact C-N 3.33Å; D497-K499 PolarHBondContact O-N 2.63Å; K499-T503 WeakPolarHBondContact O-CB 3.46Å; K499-T503 PolarHBondContact O-N 3.14Å; K499-T503 PolarHBondContact O-OG1 2.89Å
500	K	92.2	Very high	82.5	Confident	113 Å²	113	88.8 Å²	88.8	49%	0.491	42%	0.423	S	S	.	.	H	α-helix	trans	-62.5	-46.7	178.9	170.7	177.9	157.4	-157.2	0	113	E496 D497 T503 K504	E496-K500 WeakPolarHBondContact O-CB 3.35Å; E496-K500 PolarHBondContact O-N 2.68Å; D497-K500 WeakPolarHBondContact O-CB 3.46Å; D497-K500 PolarHBondContact O-N 2.76Å; D497-K500 WeakPolarHBondContact OD1-CD 3.33Å; D497-K500 WeakPolarHBondContact OD1-CE 3.39Å; D497-K500 IonicContact OD1-NZ 2.68Å; D497-K500 PolarHBondContact OD1-NZ 2.92Å; K500-T503 PolarHBondContact O-N 3.19Å; K500-K504 PolarHBondContact O-N 2.9Å
501	F	90.8	Very high	80.2	Confident	20 Å²	20	87.4 Å²	87.4	9%	0.088	42%	0.417	C	S	.	.	H	α-helix	trans	-69.2	-44.5	176	-73.3	-67.3	0	0	0	112	Y387 P388 Y389 H403 D497 T503 K504 S505	Y387-F501 HydrophobicContact CD1-CB 3.63Å; Y387-F501 HydrophobicContact CD1-CD1 4.42Å; Y387-F501 HydrophobicContact CD1-CG 4.01Å; Y387-F501 HydrophobicContact CD2-CB 4.4Å; Y387-F501 HydrophobicContact CE1-CB 3.71Å; Y387-F501 HydrophobicContact CE2-CB 4.46Å; Y387-F501 HydrophobicContact CG-CB 3.98Å; Y387-F501 HydrophobicContact CG-CD2 4.4Å; Y387-F501 HydrophobicContact CG-CG 4.21Å; P388-F501 HydrophobicContact CB-CZ 4.1Å; P388-F501 HydrophobicContact CG-CE1 3.8Å; P388-F501 HydrophobicContact CG-CZ 3.69Å; Y389-F501 AromaticContact CD1-CD2 3.89Å; Y389-F501 HydrophobicContact CD1-CD2 3.89Å; Y389-F501 AromaticContact CD1-CE2 3.89Å; Y389-F501 HydrophobicContact CD1-CE2 3.89Å; Y389-F501 AromaticContact CE1-CD2 3.99Å; Y389-F501 HydrophobicContact CE1-CD2 3.99Å; Y389-F501 HydrophobicContact CE1-CE2 4.46Å; H403-F501 AromaticContact CD2-CD1 3.82Å; H403-F501 AromaticContact NE2-CD1 3.4Å; H403-F501 WeakPolarHBondContact NE2-CD1 3.39Å; H403-F501 AromaticContact NE2-CE1 3.46Å; H403-F501 WeakPolarHBondContact NE2-CE1 3.41Å; D497-F501 HydrophobicContact CB-CD2 4.12Å; D497-F501 HydrophobicContact CB-CE2 4.02Å; D497-F501 WeakPolarHBondContact O-CD2 3.04Å; D497-F501 PolarHBondContact O-N 3.21Å; F501-T503 VanDerWaalsContact C-N 3.28Å; F501-T503 PolarHBondContact O-N 2.9Å; F501-K504 PolarHBondContact O-N 3.42Å; F501-S505 PolarHBondContact O-N 2.92Å; F501-S505 PolarHBondContact O-OG 2.85Å
502	R	87.6	Confident	78.1	Confident	119 Å²	119	88.4 Å²	88.4	45%	0.449	42%	0.42	S	S	.	.	H	α-helix	trans	-56.4	-41.5	173.5	-83.5	-179.2	162.2	-174.8	-2.7	112.1	L498 S505 R506	L498-R502 HydrophobicContact CD1-CG 4.04Å; L498-R502 VanDerWaalsContact O-CB 3.26Å; L498-R502 WeakPolarHBondContact O-CB 3.26Å; L498-R502 WeakPolarHBondContact O-CG 3.47Å; L498-R502 PolarHBondContact O-N 2.95Å; R502-S505 PolarHBondContact O-N 3.42Å; R502-R506 WeakPolarHBondContact O-CB 3.48Å; R502-R506 VanDerWaalsContact O-CG 3.32Å; R502-R506 WeakPolarHBondContact O-CG 3.42Å; R502-R506 PolarHBondContact O-N 3.5Å
503	T	84.8	Confident	76.2	Confident	85 Å²	85	86 Å²	86	52%	0.521	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-49	177.5	-64.2	0	0	0	0	111.6	K499 K500 F501 S505 R506 T507	K499-T503 WeakPolarHBondContact O-CB 3.46Å; K499-T503 PolarHBondContact O-N 3.14Å; K499-T503 PolarHBondContact O-OG1 2.89Å; K500-T503 PolarHBondContact O-N 3.19Å; F501-T503 VanDerWaalsContact C-N 3.28Å; F501-T503 PolarHBondContact O-N 2.9Å; T503-S505 PolarHBondContact O-N 2.65Å; T503-R506 PolarHBondContact O-N 3.03Å; T503-T507 PolarHBondContact O-N 3.08Å; T503-T507 PolarHBondContact O-OG1 2.8Å; T503-T507 VanDerWaalsContact O-OG1 3.14Å
504	K	77.5	Confident	74.4	Confident	110 Å²	110	86.2 Å²	86.2	48%	0.478	41%	0.412	S	S	.	.	H	α-helix	trans	-58	-45.8	176.3	-71	-179.1	175	-171.8	0	112.7	M404 K500 F501 R506 T507 W508	M404-K504 HydrophobicContact CE-CB 3.67Å; K500-K504 PolarHBondContact O-N 2.9Å; F501-K504 PolarHBondContact O-N 3.42Å; K504-R506 VanDerWaalsContact C-N 3.35Å; K504-R506 PolarHBondContact O-N 3.4Å; K504-T507 WeakPolarHBondContact CA-OG1 3.35Å; K504-T507 PolarHBondContact O-N 2.91Å; K504-T507 PolarHBondContact O-OG1 3.34Å; K504-W508 PolarHBondContact O-N 2.77Å; K504-W508 VanDerWaalsContact O-N 3.16Å
505	S	74.4	Confident	72.7	Confident	34 Å²	34	92 Å²	92	24%	0.238	43%	0.433	C	S	.	.	H	α-helix	trans	-65.8	-36.2	177.4	-54.4	0	0	0	0	112.3	M404 F501 R502 T503 A509	M404-S505 WeakPolarHBondContact CE-OG 3.49Å; M404-S505 PolarHBondContact SD-OG 2.88Å; F501-S505 PolarHBondContact O-N 2.92Å; F501-S505 PolarHBondContact O-OG 2.85Å; R502-S505 PolarHBondContact O-N 3.42Å; T503-S505 PolarHBondContact O-N 2.65Å; S505-A509 WeakPolarHBondContact O-CB 3.32Å; S505-A509 PolarHBondContact O-N 2.68Å
506	R	60.3	Low	71.2	Confident	197 Å²	197	91.8 Å²	91.8	74%	0.743	43%	0.433	S	S	*	.	H	α-helix	trans	-68.9	-41.2	176	-79.2	-179.5	72.8	176	5.1	112.4	R502 T503 K504 G510	R502-R506 WeakPolarHBondContact O-CB 3.48Å; R502-R506 VanDerWaalsContact O-CG 3.32Å; R502-R506 WeakPolarHBondContact O-CG 3.42Å; R502-R506 PolarHBondContact O-N 3.5Å; T503-R506 PolarHBondContact O-N 3.03Å; K504-R506 VanDerWaalsContact C-N 3.35Å; K504-R506 PolarHBondContact O-N 3.4Å; R506-G510 WeakPolarHBondContact O-CA 3.35Å; R506-G510 PolarHBondContact O-N 2.9Å
507	T	56.6	Low	69.8	Low	66 Å²	66	89.2 Å²	89.2	41%	0.405	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-45	175.8	43.5	0	0	0	0	110.5	T503 K504 E511	T503-T507 PolarHBondContact O-N 3.08Å; T503-T507 PolarHBondContact O-OG1 2.8Å; T503-T507 VanDerWaalsContact O-OG1 3.14Å; K504-T507 WeakPolarHBondContact CA-OG1 3.35Å; K504-T507 PolarHBondContact O-N 2.91Å; K504-T507 PolarHBondContact O-OG1 3.34Å; T507-E511 WeakPolarHBondContact O-CB 3.15Å; T507-E511 PolarHBondContact O-N 2.9Å
508	W	49.1	Very low	68.6	Low	119 Å²	119	94.6 Å²	94.6	45%	0.451	44%	0.441	S	S	.	.	H	α-helix	trans	-70.1	-46.3	-178	-88.1	-143.3	0	0	0	112.7	E406 K504 G510 E511 K512	E406-W508 VanDerWaalsContact CD-CD1 3.47Å; E406-W508 PolarHBondContact OE1-NE1 3.43Å; E406-W508 VanDerWaalsContact OE2-CD1 3.32Å; E406-W508 PolarHBondContact OE2-NE1 3.01Å; K504-W508 PolarHBondContact O-N 2.77Å; K504-W508 VanDerWaalsContact O-N 3.16Å; W508-G510 PolarHBondContact O-N 2.9Å; W508-E511 PolarHBondContact O-N 2.9Å; W508-K512 WeakPolarHBondContact O-CB 3.11Å; W508-K512 WeakPolarHBondContact O-CG 3.43Å; W508-K512 PolarHBondContact O-N 3.08Å
509	A	52.3	Low	67.4	Low	37 Å²	37	96.7 Å²	96.7	31%	0.306	46%	0.457	S	S	.	.	H	α-helix	trans	-64.8	-41.3	177.2	0	0	0	0	0	112.1	S505 S513	S505-A509 WeakPolarHBondContact O-CB 3.32Å; S505-A509 PolarHBondContact O-N 2.68Å; A509-S513 WeakPolarHBondContact O-CB 3.43Å; A509-S513 PolarHBondContact O-N 3.43Å; A509-S513 VanDerWaalsContact O-N 3.08Å
510	G	51.6	Low	66.5	Low	31 Å²	31	97.9 Å²	97.9	32%	0.32	46%	0.458	S	S	.	.	H	α-helix	trans	-69.4	-35.4	177	0	0	0	0	0	113.3	R506 W508 K514	R506-G510 WeakPolarHBondContact O-CA 3.35Å; R506-G510 PolarHBondContact O-N 2.9Å; W508-G510 PolarHBondContact O-N 2.9Å; G510-K514 WeakPolarHBondContact O-CB 3.25Å; G510-K514 WeakPolarHBondContact O-CG 3.33Å; G510-K514 PolarHBondContact O-N 2.81Å
511	E	48.4	Very low	65.7	Low	91 Å²	91	96.9 Å²	96.9	43%	0.425	46%	0.457	S	S	.	.	H	α-helix	trans	-74.2	-41.2	176	-164.7	-173.8	142.6	0	0	111.7	T507 W508 S513 K514 R515	T507-E511 WeakPolarHBondContact O-CB 3.15Å; T507-E511 PolarHBondContact O-N 2.9Å; W508-E511 PolarHBondContact O-N 2.9Å; E511-S513 VanDerWaalsContact C-N 3.3Å; E511-S513 PolarHBondContact O-N 2.93Å; E511-K514 PolarHBondContact O-N 3.38Å; E511-R515 WeakPolarHBondContact O-CB 3.46Å; E511-R515 PolarHBondContact O-N 3.44Å; E511-R515 IonicContact OE1-CZ 3.31Å; E511-R515 IonicContact OE1-NE 3.8Å; E511-R515 IonicContact OE1-NH2 3.22Å; E511-R515 PolarHBondContact OE1-NH2 3.12Å
512	K	53.3	Low	64.6	Low	77 Å²	77	104.9 Å²	104.9	34%	0.335	49%	0.492	S	S	.	.	H	α-helix	trans	-53.8	-49.5	170	-75.2	-177.3	-176.2	-176.3	0	110.3	E405 W508 R515 E516	E405-K512 IonicContact OE2-NZ 2.76Å; E405-K512 PolarHBondContact OE2-NZ 3.21Å; W508-K512 WeakPolarHBondContact O-CB 3.11Å; W508-K512 WeakPolarHBondContact O-CG 3.43Å; W508-K512 PolarHBondContact O-N 3.08Å; K512-R515 PolarHBondContact O-N 3.44Å; K512-E516 WeakPolarHBondContact O-CB 3.4Å; K512-E516 PolarHBondContact O-N 2.85Å
513	S	56.6	Low	63.6	Low	76 Å²	76	107.9 Å²	107.9	53%	0.531	51%	0.508	S	S	.	.	H	α-helix	trans	-61.2	-48.1	177.9	-179.4	0	0	0	0	113.3	A509 E511 E516 M517	A509-S513 WeakPolarHBondContact O-CB 3.43Å; A509-S513 PolarHBondContact O-N 3.43Å; A509-S513 VanDerWaalsContact O-N 3.08Å; E511-S513 VanDerWaalsContact C-N 3.3Å; E511-S513 PolarHBondContact O-N 2.93Å; S513-E516 PolarHBondContact O-N 3.29Å; S513-M517 WeakPolarHBondContact O-CB 3.48Å; S513-M517 PolarHBondContact O-N 3.23Å
514	K	57.6	Low	62.2	Low	132 Å²	132	113.5 Å²	113.5	57%	0.574	53%	0.534	S	S	*	.	H	α-helix	trans	-63.2	-44.5	176.3	-76.2	179	179.8	-176.6	0	112.2	G510 E511 E516 M517 Y518	G510-K514 WeakPolarHBondContact O-CB 3.25Å; G510-K514 WeakPolarHBondContact O-CG 3.33Å; G510-K514 PolarHBondContact O-N 2.81Å; E511-K514 PolarHBondContact O-N 3.38Å; K514-E516 VanDerWaalsContact C-N 3.3Å; K514-E516 PolarHBondContact O-N 3.4Å; K514-M517 WeakPolarHBondContact O-CB 3.05Å; K514-M517 PolarHBondContact O-N 3.33Å; K514-Y518 HydrophobicContact CB-CD2 4.4Å; K514-Y518 HydrophobicContact CB-CE2 4.26Å; K514-Y518 WeakPolarHBondContact O-CD2 3.34Å; K514-Y518 PolarHBondContact O-N 2.75Å
515	R	60.2	Low	61.4	Low	156 Å²	156	113.7 Å²	113.7	59%	0.589	54%	0.537	S	S	*	.	H	α-helix	trans	-61.5	-39.4	178.3	-170.6	-176	-64.9	-169.3	1.3	110.9	E511 K512 S519	E511-R515 WeakPolarHBondContact O-CB 3.46Å; E511-R515 PolarHBondContact O-N 3.44Å; E511-R515 IonicContact OE1-CZ 3.31Å; E511-R515 IonicContact OE1-NE 3.8Å; E511-R515 IonicContact OE1-NH2 3.22Å; E511-R515 PolarHBondContact OE1-NH2 3.12Å; K512-R515 PolarHBondContact O-N 3.44Å; R515-S519 VanDerWaalsContact O-CB 3.25Å; R515-S519 WeakPolarHBondContact O-CB 3.33Å; R515-S519 PolarHBondContact O-N 3.42Å; R515-S519 PolarHBondContact O-OG 2.82Å
516	E	63.1	Low	60.8	Low	100 Å²	100	117.8 Å²	117.8	47%	0.467	55%	0.552	S	S	.	*	H	α-helix	trans	-67.7	-45.2	173.5	-155.8	-160.4	154.7	0	0	112	K512 S513 K514 Y518 S519 R520	K512-E516 WeakPolarHBondContact O-CB 3.4Å; K512-E516 PolarHBondContact O-N 2.85Å; S513-E516 PolarHBondContact O-N 3.29Å; K514-E516 VanDerWaalsContact C-N 3.3Å; K514-E516 PolarHBondContact O-N 3.4Å; E516-Y518 PolarHBondContact O-N 2.95Å; E516-S519 CarbonylContact O-C 3.4Å; E516-S519 PolarHBondContact O-N 3.28Å; E516-S519 VanDerWaalsContact O-N 3.08Å; E516-R520 WeakPolarHBondContact O-CG 3.46Å; E516-R520 PolarHBondContact O-N 2.9Å; E516-R520 IonicContact OE1-CZ 3.15Å; E516-R520 IonicContact OE1-NE 2.85Å; E516-R520 PolarHBondContact OE1-NE 3.45Å; E516-R520 IonicContact OE1-NH2 3.93Å; E516-R520 PolarHBondContact OE1-NH2 3.38Å; E516-R520 IonicContact OE2-NH2 2.65Å
517	M	66.2	Low	60.8	Low	113 Å²	113	113.4 Å²	113.4	56%	0.557	54%	0.542	S	S	*	.	H	α-helix	trans	-55.7	-49	174	177	-177.8	170.6	0	0	111.5	S513 K514 S519 R520 L521	S513-M517 WeakPolarHBondContact O-CB 3.48Å; S513-M517 PolarHBondContact O-N 3.23Å; K514-M517 WeakPolarHBondContact O-CB 3.05Å; K514-M517 PolarHBondContact O-N 3.33Å; M517-S519 VanDerWaalsContact C-N 3.32Å; M517-S519 PolarHBondContact O-N 3.47Å; M517-R520 PolarHBondContact O-N 2.98Å; M517-L521 HydrophobicContact CE-CD1 4.09Å; M517-L521 HydrophobicContact CG-CD1 4.07Å; M517-L521 WeakPolarHBondContact O-CB 3.36Å; M517-L521 WeakPolarHBondContact O-CG 3.49Å; M517-L521 PolarHBondContact O-N 2.88Å
518	Y	70	Confident	61	Low	155 Å²	155	116.2 Å²	116.2	61%	0.608	55%	0.55	S	S	*	.	H	α-helix	trans	-64.2	-34.5	174.9	-70.9	-59.4	0	0	0	112.6	K514 E516 L521 K522	K514-Y518 HydrophobicContact CB-CD2 4.4Å; K514-Y518 HydrophobicContact CB-CE2 4.26Å; K514-Y518 WeakPolarHBondContact O-CD2 3.34Å; K514-Y518 PolarHBondContact O-N 2.75Å; E516-Y518 PolarHBondContact O-N 2.95Å; Y518-L521 HydrophobicContact CD1-CD1 4.42Å; Y518-L521 PolarHBondContact O-N 3.24Å; Y518-K522 WeakPolarHBondContact O-CB 3.36Å; Y518-K522 PolarHBondContact O-N 2.89Å
519	S	68.8	Low	61.8	Low	58 Å²	58	116.1 Å²	116.1	41%	0.406	56%	0.556	S	S	.	*	H	α-helix	trans	-72	-28.8	176.3	-60.8	0	0	0	0	113.5	R515 E516 M517 K523	R515-S519 VanDerWaalsContact O-CB 3.25Å; R515-S519 WeakPolarHBondContact O-CB 3.33Å; R515-S519 PolarHBondContact O-N 3.42Å; R515-S519 PolarHBondContact O-OG 2.82Å; E516-S519 CarbonylContact O-C 3.4Å; E516-S519 PolarHBondContact O-N 3.28Å; E516-S519 VanDerWaalsContact O-N 3.08Å; M517-S519 VanDerWaalsContact C-N 3.32Å; M517-S519 PolarHBondContact O-N 3.47Å; S519-K523 WeakPolarHBondContact O-CG 3.39Å
520	R	75.9	Confident	62.4	Low	166 Å²	166	121.3 Å²	121.3	63%	0.626	57%	0.573	S	S	*	*	H	α-helix	trans	-72.9	-44.9	169.5	-69	172.2	180	-148.6	6.3	110.4	E516 M517 K522 K523	E516-R520 WeakPolarHBondContact O-CG 3.46Å; E516-R520 PolarHBondContact O-N 2.9Å; E516-R520 IonicContact OE1-CZ 3.15Å; E516-R520 IonicContact OE1-NE 2.85Å; E516-R520 PolarHBondContact OE1-NE 3.45Å; E516-R520 IonicContact OE1-NH2 3.93Å; E516-R520 PolarHBondContact OE1-NH2 3.38Å; E516-R520 IonicContact OE2-NH2 2.65Å; M517-R520 PolarHBondContact O-N 2.98Å; R520-K522 VanDerWaalsContact C-N 3.31Å; R520-K522 PolarHBondContact O-N 3.09Å; R520-K523 PolarHBondContact O-N 3.2Å; R520-K523 VanDerWaalsContact O-N 3.12Å
521	L	74.6	Confident	63.2	Low	93 Å²	93	127.8 Å²	127.8	49%	0.487	59%	0.591	S	S	.	*	H	α-helix	trans	-63	-31.8	175.9	-73.8	165.9	0	0	0	113.5	M517 Y518 K523	M517-L521 HydrophobicContact CE-CD1 4.09Å; M517-L521 HydrophobicContact CG-CD1 4.07Å; M517-L521 WeakPolarHBondContact O-CB 3.36Å; M517-L521 WeakPolarHBondContact O-CG 3.49Å; M517-L521 PolarHBondContact O-N 2.88Å; Y518-L521 HydrophobicContact CD1-CD1 4.42Å; Y518-L521 PolarHBondContact O-N 3.24Å; L521-K523 VanDerWaalsContact C-N 3.26Å; L521-K523 PolarHBondContact O-N 2.75Å
522	K	68.8	Low	64.3	Low	188 Å²	188	130.6 Å²	130.6	82%	0.817	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	6.1	175.6	-160	179	175.4	-179.5	0	113.8	Y518 R520	Y518-K522 WeakPolarHBondContact O-CB 3.36Å; Y518-K522 PolarHBondContact O-N 2.89Å; R520-K522 VanDerWaalsContact C-N 3.31Å; R520-K522 PolarHBondContact O-N 3.09Å
523	K	66.5	Low	65.2	Low	181 Å²	181	135.1 Å²	135.1	79%	0.787	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	8.5	174.3	-74.5	179.1	176.7	-176.6	0	112.6	S519 R520 L521	S519-K523 WeakPolarHBondContact O-CG 3.39Å; R520-K523 PolarHBondContact O-N 3.2Å; R520-K523 VanDerWaalsContact O-N 3.12Å; L521-K523 VanDerWaalsContact C-N 3.26Å; L521-K523 PolarHBondContact O-N 2.75Å
524	L	54.7	Low	66	Low	203 Å²	203	140.5 Å²	140.5	100%	1.063	64%	0.635	S	S	*	*			trans	-105.9	0	168	-66.5	170.1	0	0	0	108.8

Retrieved 524 of 524 residues in 136.6 ms (Link to these results)

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