X2JFM3_DROME Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession X2JFM3, Species DROME (Drosophila melanogaster, Fruit fly), Gene mnb, Length 743 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	33	Very low	28.8	Very low	245 Å²	245	160.2 Å²	160.2	100%	1.207	85%	0.845	S	S	*	*				0	97.4	0	-68.4	168.7	171.7	0	0	108.3
2	S	24.8	Very low	29.1	Very low	119 Å²	119	160.5 Å²	160.5	83%	0.832	85%	0.848	S	S	*	*			trans	-158.7	22.7	175.7	-162.1	0	0	0	0	113.3
3	T	28.2	Very low	29	Very low	133 Å²	133	154.1 Å²	154.1	82%	0.816	84%	0.844	S	S	*	*			trans	-109.9	3.4	-169.3	8.1	0	0	0	0	113.8
4	A	28	Very low	28.8	Very low	98 Å²	98	148.4 Å²	148.4	81%	0.81	84%	0.839	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	14.7	-173.2	0	0	0	0	0	114.4
5	L	27.1	Very low	28.9	Very low	149 Å²	149	148.4 Å²	148.4	78%	0.78	84%	0.836	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	9.4	-172.9	-139.2	87.6	0	0	0	115
6	V	32.3	Very low	29.1	Very low	122 Å²	122	147 Å²	147	74%	0.739	84%	0.835	S	S	*	*	S	Bend	trans	-106	-13.5	178.4	-175.8	0	0	0	0	111.6	W8	V6-W8 PolarHBondContact O-N 3.48Å
7	Y	29.9	Very low	29.2	Very low	200 Å²	200	145.2 Å²	145.2	78%	0.784	83%	0.827	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	26.9	-168.3	-127.5	-83.1	0	0	0	115
8	W	26.3	Very low	29.1	Very low	238 Å²	238	146.2 Å²	146.2	90%	0.902	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	13	178.5	-157	68.3	0	0	0	114.3	V6	V6-W8 PolarHBondContact O-N 3.48Å
9	Q	27.1	Very low	29	Very low	186 Å²	186	148.4 Å²	148.4	87%	0.869	83%	0.829	S	S	*	*	S	Bend	trans	-119.2	10.4	174.2	-82.5	-174.8	-63.3	0	0	113.8
10	S	30	Very low	28.9	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	83%	0.825	S	S	*	*	S	Bend	trans	-119.1	18.2	-177	-170.6	0	0	0	0	113.5
11	M	30.1	Very low	28.7	Very low	165 Å²	165	145.1 Å²	145.1	81%	0.813	83%	0.826	S	S	*	*	S	Bend	trans	-129.8	-10.7	-178.2	-89.1	179.1	156.3	0	0	115.3
12	N	32.9	Very low	28.5	Very low	164 Å²	164	137.3 Å²	137.3	88%	0.877	80%	0.8	S	S	*	*			trans	-116.2	106.7	168.9	-80.7	17.5	0	0	0	109.2
13	G	27.8	Very low	28.5	Very low	77 Å²	77	138.1 Å²	138.1	79%	0.794	80%	0.795	S	S	*	*			trans	-172	73.3	177.8	0	0	0	0	0	107.9
14	G	26.2	Very low	28.3	Very low	75 Å²	75	143.1 Å²	143.1	77%	0.773	80%	0.799	S	S	*	*			trans	-83.7	150.4	-178.8	0	0	0	0	0	112.2
15	D	30.6	Very low	28	Very low	148 Å²	148	142.8 Å²	142.8	79%	0.791	80%	0.796	S	S	*	*			trans	-71.4	137	177.1	-53.2	-74	0	0	0	111.8	V17	D15-V17 PolarHBondContact O-N 2.9Å
16	P	32.1	Very low	28.6	Very low	126 Å²	126	141.1 Å²	141.1	82%	0.818	79%	0.794	S	S	*	*			trans	-76.4	111.1	156.4	30.8	-28.7	0	0	0	108.8
17	V	29.6	Very low	28.2	Very low	116 Å²	116	145.3 Å²	145.3	70%	0.703	80%	0.803	S	S	*	*			trans	-90	112.8	173.2	175.9	0	0	0	0	109.4	D15 K19	D15-V17 PolarHBondContact O-N 2.9Å; V17-K19 HydrophobicContact CG1-CG 4.42Å
18	D	28.7	Very low	27.9	Very low	164 Å²	164	141.5 Å²	141.5	88%	0.877	80%	0.8	S	S	*	*			trans	-98	150.9	160.2	-101.5	-45.9	0	0	0	111.2
19	K	26.4	Very low	27.9	Very low	188 Å²	188	137.2 Å²	137.2	82%	0.817	80%	0.8	S	S	*	*			trans	-125.7	167.6	-174.9	-86.6	-176.8	177.6	174.8	0	111.5	V17	V17-K19 HydrophobicContact CG1-CG 4.42Å
20	A	26.3	Very low	27.8	Very low	90 Å²	90	132.1 Å²	132.1	74%	0.744	80%	0.797	S	S	*	*			trans	78.3	138.1	179.2	0	0	0	0	0	113.5
21	T	25.7	Very low	27.5	Very low	138 Å²	138	131.9 Å²	131.9	85%	0.847	80%	0.802	S	S	*	*			cis	-147.6	170.1	1.2	-15	0	0	0	0	110.9
22	A	27.6	Very low	27.3	Very low	80 Å²	80	128.8 Å²	128.8	66%	0.661	80%	0.802	S	S	*	*			trans	-69.6	178	165.8	0	0	0	0	0	110.3
23	D	25.2	Very low	27	Very low	136 Å²	136	126 Å²	126	73%	0.727	80%	0.802	S	S	*	*			cis	-167.2	176.4	24.7	-146.1	-17.3	0	0	0	112.5
24	W	23.7	Very low	26.9	Very low	239 Å²	239	126.4 Å²	126.4	91%	0.905	81%	0.806	S	S	*	*			trans	74.3	165	164.1	-74.1	42.6	0	0	0	119.8
25	A	22.9	Very low	27	Very low	90 Å²	90	126.8 Å²	126.8	74%	0.744	81%	0.81	S	S	*	*			trans	-130.5	-146.3	-169	0	0	0	0	0	111.9
26	P	39.7	Very low	26.8	Very low	114 Å²	114	125.3 Å²	125.3	74%	0.74	81%	0.811	S	S	*	*				-109.9	162	-95.6	37.8	-27.8	0	0	0	113.7
27	F	23.7	Very low	26.5	Very low	211 Å²	211	129.5 Å²	129.5	93%	0.925	82%	0.817	S	S	*	*			trans	-145.2	166.9	162	-122.5	-87.6	0	0	0	114
28	V	23.7	Very low	26.3	Very low	120 Å²	120	129 Å²	129	73%	0.727	82%	0.818	S	S	*	*			trans	-130	168.4	-166.2	-173.4	0	0	0	0	110.1
29	V	25.2	Very low	26.3	Very low	148 Å²	148	126.2 Å²	126.2	90%	0.897	81%	0.812	S	S	*	*			trans	88	132.5	168.1	-168.8	0	0	0	0	115.7
30	G	25	Very low	26.3	Very low	78 Å²	78	122 Å²	122	80%	0.804	81%	0.806	S	S	*	*			trans	158.2	96.4	170.5	0	0	0	0	0	112.4
31	A	24.4	Very low	26.3	Very low	103 Å²	103	124.5 Å²	124.5	85%	0.851	81%	0.805	S	S	*	*			trans	-117.3	149.7	179.2	0	0	0	0	0	111.5
32	A	25.6	Very low	26.4	Very low	100 Å²	100	125.8 Å²	125.8	83%	0.826	81%	0.806	S	S	*	*			trans	-169.2	127.5	142.9	0	0	0	0	0	114.2
33	A	27.1	Very low	26.3	Very low	105 Å²	105	127.8 Å²	127.8	87%	0.868	81%	0.809	S	S	*	*			trans	21	130.5	141.9	0	0	0	0	0	123
34	G	25.1	Very low	26.4	Very low	86 Å²	86	127 Å²	127	89%	0.887	82%	0.815	S	S	*	*				109.3	120.3	102.9	0	0	0	0	0	118
35	G	28.3	Very low	26.5	Very low	82 Å²	82	120.7 Å²	120.7	85%	0.845	81%	0.807	S	S	*	*			trans	171.8	48.8	175.7	0	0	0	0	0	116.6
36	S	26.6	Very low	26.7	Very low	117 Å²	117	121.5 Å²	121.5	82%	0.818	81%	0.808	S	S	*	*			trans	-79.5	129.5	174.4	-63	0	0	0	0	112.1
37	F	27.1	Very low	26	Very low	215 Å²	215	121.9 Å²	121.9	94%	0.943	81%	0.813	S	S	*	*			trans	-138.9	149.8	150.7	-97.6	-79.7	0	0	0	110.2
38	S	25.4	Very low	26.1	Very low	104 Å²	104	116.9 Å²	116.9	73%	0.727	80%	0.804	S	S	*	*			trans	-150.5	171.8	-173.5	-172.2	0	0	0	0	109.6
39	S	28.2	Very low	26.3	Very low	106 Å²	106	118.6 Å²	118.6	74%	0.741	81%	0.808	S	S	*	*			trans	72.7	144.1	173.9	-53.2	0	0	0	0	115.5
40	S	26.4	Very low	26.4	Very low	100 Å²	100	117.4 Å²	117.4	70%	0.699	80%	0.797	S	S	*	*			cis	-157	160.5	-5.8	-116.5	0	0	0	0	115
41	I	26.4	Very low	26.5	Very low	142 Å²	142	121.7 Å²	121.7	73%	0.728	80%	0.796	S	S	*	*			trans	-29.6	138.8	160.8	-59.1	156.2	0	0	0	115	T43	I41-T43 HydrophobicContact CG2-CG2 4.09Å
42	I	26.7	Very low	26.6	Very low	166 Å²	166	125.2 Å²	125.2	85%	0.851	79%	0.794	S	S	*	*			trans	-130.9	140.3	146	-65.7	-176.5	0	0	0	108.8
43	T	25.8	Very low	27.6	Very low	121 Å²	121	125.2 Å²	125.2	74%	0.742	79%	0.785	S	S	*	*			trans	-114.9	148.8	176	46.7	0	0	0	0	111.4	I41	I41-T43 HydrophobicContact CG2-CG2 4.09Å
44	S	27.6	Very low	27.6	Very low	120 Å²	120	129.4 Å²	129.4	84%	0.839	79%	0.787	S	S	*	*			trans	-160.1	163.8	160	57.8	0	0	0	0	110.3
45	S	25.9	Very low	27.7	Very low	106 Å²	106	131.2 Å²	131.2	74%	0.741	78%	0.776	S	S	*	*			trans	-139.7	148.7	-152.7	-53.3	0	0	0	0	115.3
46	S	26.8	Very low	27.6	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	77%	0.769	S	S	*	*			trans	54.3	113	141.4	61	0	0	0	0	121.6
47	S	25.5	Very low	27.5	Very low	122 Å²	122	132.8 Å²	132.8	85%	0.853	77%	0.766	S	S	*	*				167.8	166.7	129.2	44.1	0	0	0	0	111.4
48	S	25.8	Very low	27.6	Very low	106 Å²	106	131.2 Å²	131.2	74%	0.741	76%	0.762	S	S	*	*				-173.9	145.5	-51.9	-97.7	0	0	0	0	110.6
49	L	27.3	Very low	27.6	Very low	155 Å²	155	132.8 Å²	132.8	81%	0.812	76%	0.762	S	S	*	*			trans	78.8	142.9	155.8	-68.5	161.3	0	0	0	122.9
50	N	27.2	Very low	27.5	Very low	124 Å²	124	135.6 Å²	135.6	66%	0.663	76%	0.763	S	S	*	*			trans	69.4	144.1	156.7	-63.7	-10	0	0	0	119.2
51	H	28.2	Very low	27.5	Very low	168 Å²	168	139.1 Å²	139.1	78%	0.778	77%	0.768	S	S	*	*			cis	-146.2	175.3	1	-113.4	-34.6	0	0	0	112.6
52	H	26.7	Very low	27.5	Very low	177 Å²	177	140.1 Å²	140.1	82%	0.819	77%	0.769	S	S	*	*			trans	-134.5	173.2	176.3	-122	26	0	0	0	107.4
53	P	45.3	Very low	27.6	Very low	99 Å²	99	137.3 Å²	137.3	64%	0.643	76%	0.762	S	S	*	*			cis	-132.5	-167.6	-12	41.7	-25.5	0	0	0	112.2
54	H	28.2	Very low	28	Very low	193 Å²	193	137.1 Å²	137.1	89%	0.894	76%	0.763	S	S	*	*			trans	-149.4	142	137.5	-121.5	-80.7	0	0	0	111.2
55	N	27.1	Very low	28	Very low	124 Å²	124	139.7 Å²	139.7	66%	0.663	76%	0.761	S	S	*	*			trans	-107	152.6	-173.9	-170.4	13.8	0	0	0	111.5
56	G	25.2	Very low	28	Very low	68 Å²	68	144.1 Å²	144.1	70%	0.701	76%	0.763	S	S	*	*			trans	-156.1	85.7	-177.2	0	0	0	0	0	113
57	H	25.6	Very low	28.1	Very low	164 Å²	164	146.9 Å²	146.9	76%	0.759	77%	0.767	S	S	*	*			trans	-75	122.4	174.4	-73.4	-70.3	0	0	0	111.8
58	H	28.3	Very low	28.7	Very low	183 Å²	183	145.9 Å²	145.9	85%	0.847	75%	0.753	S	S	*	*			trans	-121.7	123.4	155.4	-89.5	-63.2	0	0	0	110.8
59	N	25.2	Very low	28.9	Very low	137 Å²	137	150.3 Å²	150.3	73%	0.733	76%	0.755	S	S	*	*			trans	-107	109.9	-174.2	-169.6	0.6	0	0	0	109.2
60	H	27	Very low	28.9	Very low	164 Å²	164	150.1 Å²	150.1	76%	0.759	75%	0.754	S	S	*	*			trans	-132.4	127.2	179.9	-81.7	-10.9	0	0	0	111.4
61	H	26.6	Very low	29	Very low	174 Å²	174	146.9 Å²	146.9	81%	0.806	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-72.3	146	179.8	-71.2	-3.9	0	0	0	112.3
62	H	26.2	Very low	29.2	Very low	164 Å²	164	142.2 Å²	142.2	76%	0.759	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-80.4	132.5	172.7	-77.5	-102.5	0	0	0	112.5
63	P	28.9	Very low	29.2	Very low	106 Å²	106	140.3 Å²	140.3	69%	0.688	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-82.2	157.2	149.1	-7.7	26.8	0	0	0	110.9
64	P	32.6	Very low	28.3	Very low	118 Å²	118	139 Å²	139	77%	0.766	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-72.2	148.3	-173	28	-35	0	0	0	114.6	Y66	P64-Y66 PolarHBondContact O-N 2.94Å
65	H	29.2	Very low	28.2	Very low	174 Å²	174	133 Å²	133	81%	0.806	70%	0.7	S	S	*	*			trans	-72	104	-175.5	-69	-100.9	0	0	0	113.1
66	Y	25.5	Very low	28.3	Very low	199 Å²	199	136.1 Å²	136.1	78%	0.78	71%	0.711	S	S	*	*			trans	-93.1	-4.2	177.8	-130.6	-94.9	0	0	0	114.9	P64 N68	P64-Y66 PolarHBondContact O-N 2.94Å; Y66-N68 PolarHBondContact O-N 2.9Å
67	I	29.3	Very low	28.3	Very low	165 Å²	165	141.6 Å²	141.6	85%	0.846	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	71.2	-170.5	-47	-179.6	0	0	0	111.5
68	N	37.9	Very low	28.5	Very low	101 Å²	101	142.5 Å²	142.5	54%	0.54	71%	0.714	S	S	.	*	T	Hydrogen-bonded Turn	trans	-146.3	2.9	159.9	-112.5	-17.3	0	0	0	114.1	Y66 L70 A71	Y66-N68 PolarHBondContact O-N 2.9Å; N68-L70 PolarHBondContact O-N 3.43Å; N68-A71 PolarHBondContact O-N 3.32Å
69	Y	30.4	Very low	28.3	Very low	200 Å²	200	139.7 Å²	139.7	78%	0.784	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-6.1	-172.8	-149.4	-97.4	0	0	0	115.1
70	L	25.5	Very low	28.3	Very low	151 Å²	151	142.8 Å²	142.8	79%	0.791	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-11.4	-178.2	-63.5	175.4	0	0	0	113.9	N68 Q72	N68-L70 PolarHBondContact O-N 3.43Å; L70-Q72 VanDerWaalsContact C-N 3.26Å; L70-Q72 PolarHBondContact O-N 3.14Å; L70-Q72 VanDerWaalsContact O-N 3.1Å
71	A	30.8	Very low	28.3	Very low	56 Å²	56	142.2 Å²	142.2	46%	0.463	71%	0.714	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	1.5	-166.6	0	0	0	0	0	116.2	N68	N68-A71 PolarHBondContact O-N 3.32Å
72	Q	32.5	Very low	28.2	Very low	69 Å²	69	145.2 Å²	145.2	32%	0.322	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.1	24.6	-175.9	-69.4	-176.6	12.5	0	0	114.8	L70 G74 Y465	L70-Q72 VanDerWaalsContact C-N 3.26Å; L70-Q72 PolarHBondContact O-N 3.14Å; L70-Q72 VanDerWaalsContact O-N 3.1Å; Q72-G74 PolarHBondContact O-N 3.49Å; Q72-Y465 HydrophobicContact CB-CE1 4.06Å; Q72-Y465 VanDerWaalsContact CD-CE1 3.47Å; Q72-Y465 HydrophobicContact CG-CE1 4.23Å; Q72-Y465 PolarHBondContact NE2-O 2.92Å
73	I	26.6	Very low	28.2	Very low	138 Å²	138	143 Å²	143	71%	0.708	72%	0.718	S	S	*	*			trans	-100.1	64.3	171.3	-50.4	-173.6	0	0	0	109.6
74	G	26	Very low	28.1	Very low	71 Å²	71	144.4 Å²	144.4	73%	0.732	73%	0.725	S	S	*	*			trans	-104	28.9	-178.5	0	0	0	0	0	115	Q72 Q76	Q72-G74 PolarHBondContact O-N 3.49Å; G74-Q76 PolarHBondContact O-N 2.94Å
75	C	26.2	Very low	27.8	Very low	66 Å²	66	146.6 Å²	146.6	45%	0.446	73%	0.731	S	S	.	*			trans	-81.6	102	-178.3	-62.9	0	0	0	0	111.6	R469	C75-R469 PolarHBondContact SG-NH1 3.17Å
76	Q	29.4	Very low	27.6	Very low	190 Å²	190	141.7 Å²	141.7	89%	0.888	73%	0.727	S	S	*	*			trans	-64.3	145.4	172.4	-63.2	-168.5	5.8	0	0	111.5	G74	G74-Q76 PolarHBondContact O-N 2.94Å
77	H	25	Very low	27.6	Very low	183 Å²	183	139.6 Å²	139.6	85%	0.847	73%	0.73	S	S	*	*			trans	-85.1	127.8	-176.6	-78.9	43.4	0	0	0	111.9	V79	H77-V79 PolarHBondContact O-N 3.17Å
78	R	28.8	Very low	27.4	Very low	183 Å²	183	140.6 Å²	140.6	69%	0.691	73%	0.731	S	S	*	*			trans	-76.4	112.4	177.3	-174.2	177.9	-173	167.6	4.5	110.9	E502	R78-E502 IonicContact CZ-OE1 2.72Å; R78-E502 IonicContact NH1-OE1 3.83Å; R78-E502 PolarHBondContact NH1-OE1 3.29Å; R78-E502 IonicContact NH2-OE1 3.43Å; R78-E502 PolarHBondContact NH2-OE1 2.86Å
79	V	23.7	Very low	27	Very low	124 Å²	124	143.4 Å²	143.4	75%	0.752	75%	0.745	S	S	*	*			trans	-91.9	139.9	162.4	-178.8	0	0	0	0	108.5	H77	H77-V79 PolarHBondContact O-N 3.17Å
80	R	25.8	Very low	26.7	Very low	202 Å²	202	142.6 Å²	142.6	76%	0.762	75%	0.749	S	S	*	*			trans	-104.6	128.4	173.4	-73.2	175.7	169.2	167.3	-6.8	109
81	N	26.6	Very low	26.8	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	75%	0.75	S	S	*	*			trans	-113.3	151.4	163.4	-80.3	10.1	0	0	0	110.1
82	W	24.5	Very low	26.6	Very low	237 Å²	237	143.8 Å²	143.8	90%	0.898	76%	0.762	S	S	*	*			trans	-94.6	158.6	171.4	-77.2	76.2	0	0	0	110
83	P	26.1	Very low	26.4	Very low	117 Å²	117	147.6 Å²	147.6	76%	0.76	78%	0.784	S	S	*	*			trans	-75.6	144.8	-179.4	31.6	-35.4	0	0	0	112.1
84	T	28.2	Very low	26.4	Very low	137 Å²	137	148.1 Å²	148.1	84%	0.84	79%	0.789	S	S	*	*			trans	-116.4	121.9	164.7	48.6	0	0	0	0	108.2
85	N	26.6	Very low	26.4	Very low	164 Å²	164	152.4 Å²	152.4	88%	0.877	80%	0.795	S	S	*	*			trans	-63.2	139.7	167.9	-78.4	3.6	0	0	0	109.3
86	G	24.2	Very low	26.4	Very low	71 Å²	71	153.4 Å²	153.4	73%	0.732	81%	0.808	S	S	*	*			trans	-104.1	127.3	159.8	0	0	0	0	0	109
87	N	25.8	Very low	26.1	Very low	155 Å²	155	147.6 Å²	147.6	83%	0.829	80%	0.799	S	S	*	*			trans	-103	141.3	145.1	-98.1	32.4	0	0	0	106.5
88	Q	25.2	Very low	26.2	Very low	186 Å²	186	147.3 Å²	147.3	87%	0.869	80%	0.798	S	S	*	*			trans	-96.5	142.5	166.5	-63.4	167.1	-88.9	0	0	107.6
89	D	28.4	Very low	26	Very low	159 Å²	159	146.4 Å²	146.4	85%	0.85	80%	0.801	S	S	*	*			trans	-138.7	148.6	156.4	-83.4	-58.2	0	0	0	107.3
90	Q	24.1	Very low	26.1	Very low	183 Å²	183	147.7 Å²	147.7	86%	0.855	80%	0.802	S	S	*	*			trans	-106	150.1	-169.4	-67.2	165.1	-116.6	0	0	112
91	A	28.2	Very low	26	Very low	99 Å²	99	146 Å²	146	82%	0.818	81%	0.806	S	S	*	*			trans	-160.9	153.6	155.9	0	0	0	0	0	108.9
92	D	26.7	Very low	25.8	Very low	133 Å²	133	143.4 Å²	143.4	71%	0.711	80%	0.801	S	S	*	*			trans	-114.1	164.8	-160.2	-48.9	-81.5	0	0	0	114.6
93	D	27.9	Very low	25.8	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	80%	0.801	S	S	*	*			trans	67.2	153.2	148.6	-63.6	-23.3	0	0	0	125.7
94	D	27.6	Very low	25.7	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	81%	0.806	S	S	*	*			trans	66.6	92.8	155.8	-66.3	-11.2	0	0	0	124.2
95	D	25.7	Very low	25.5	Very low	161 Å²	161	147 Å²	147	86%	0.861	81%	0.806	S	S	*	*				41.1	156.8	121.7	-153.6	27	0	0	0	124.6
96	A	26.1	Very low	25.8	Very low	87 Å²	87	144 Å²	144	72%	0.719	80%	0.796	S	S	*	*			trans	74.4	117.9	156.7	0	0	0	0	0	121.2
97	G	23.6	Very low	25.9	Very low	67 Å²	67	149.7 Å²	149.7	69%	0.691	80%	0.8	S	S	*	*				112.2	101.6	126.8	0	0	0	0	0	120.6
98	H	26.3	Very low	25.9	Very low	178 Å²	178	147.9 Å²	147.9	82%	0.824	80%	0.8	S	S	*	*			trans	54.9	116.9	141.3	-73	-88.5	0	0	0	123.8
99	Q	25	Very low	26	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.762	79%	0.786	S	S	*	*			trans	36.3	114.6	136.2	-61.7	-172.2	8.6	0	0	122.8
100	I	25.3	Very low	25.8	Very low	152 Å²	152	146.4 Å²	146.4	78%	0.779	79%	0.79	S	S	*	*				40.3	107.7	129.1	-39.7	174.3	0	0	0	118.6
101	I	23.1	Very low	25.9	Very low	165 Å²	165	144.1 Å²	144.1	85%	0.846	78%	0.783	S	S	*	*				-167.9	151.9	119.9	-103	160.8	0	0	0	110.5
102	S	24.1	Very low	25.9	Very low	99 Å²	99	144.6 Å²	144.6	69%	0.692	78%	0.776	S	S	*	*			trans	-90.4	145.9	179.5	58.1	0	0	0	0	113.5
103	K	24.3	Very low	25.9	Very low	210 Å²	210	144.5 Å²	144.5	91%	0.913	78%	0.78	S	S	*	*			trans	-160.3	155.6	136.9	-108.7	155	-172.3	178.3	0	112.4
104	F	23.3	Very low	25.8	Very low	195 Å²	195	144.4 Å²	144.4	86%	0.855	78%	0.779	S	S	*	*			trans	-88.6	163	-177.1	-85.7	-115.9	0	0	0	112.2
105	L	23.7	Very low	26	Very low	160 Å²	160	145 Å²	145	84%	0.838	78%	0.781	S	S	*	*				153.8	159.6	119.7	-78	169.3	0	0	0	110.1
106	P	34.1	Very low	26	Very low	103 Å²	103	145 Å²	145	67%	0.669	78%	0.781	S	S	*	*				-137.7	172.2	-51.4	38.3	-22	0	0	0	114.4
107	K	25.7	Very low	26.1	Very low	190 Å²	190	146.4 Å²	146.4	83%	0.826	78%	0.78	S	S	*	*			trans	30.6	138	150.1	-64.5	-176.4	174.2	-171.4	0	120.1
108	S	26.2	Very low	26.2	Very low	117 Å²	117	152.3 Å²	152.3	82%	0.818	79%	0.787	S	S	*	*			cis	-144.7	175.4	34.2	64.3	0	0	0	0	111.8
109	A	26	Very low	26.2	Very low	71 Å²	71	153.9 Å²	153.9	59%	0.587	79%	0.786	S	S	*	*	S	Bend	cis	-146.4	-172	12.1	0	0	0	0	0	112.3
110	W	25.3	Very low	26.4	Very low	243 Å²	243	151.8 Å²	151.8	92%	0.92	78%	0.78	S	S	*	*			trans	77.7	72.2	171.2	-46.7	115	0	0	0	117.8
111	D	25.8	Very low	26.6	Very low	134 Å²	134	150.3 Å²	150.3	72%	0.717	78%	0.777	S	S	*	*			trans	-78.6	131.4	150.7	-92.7	-54.6	0	0	0	109.3
112	T	27.5	Very low	27	Very low	109 Å²	109	149.2 Å²	149.2	67%	0.669	77%	0.774	S	S	*	*				78.6	86	73.2	-53.6	0	0	0	0	110.8
113	V	27.1	Very low	27.4	Very low	131 Å²	131	153.1 Å²	153.1	79%	0.794	78%	0.781	S	S	*	*				98.2	120	78	155.7	0	0	0	0	113.3
114	L	26.6	Very low	27.7	Very low	148 Å²	148	150.5 Å²	150.5	78%	0.775	78%	0.777	S	S	*	*			trans	49.7	108.6	145.7	-148	81.3	0	0	0	121.2
115	L	30.2	Very low	27.9	Very low	161 Å²	161	144.1 Å²	144.1	84%	0.843	77%	0.766	S	S	*	*			trans	34.4	125.2	139.7	-58.8	168.8	0	0	0	121.1
116	D	26.5	Very low	28.2	Very low	161 Å²	161	142 Å²	142	86%	0.861	76%	0.755	S	S	*	*			trans	-150.2	178.8	138.7	-148.8	-14.1	0	0	0	112.1
117	V	28.8	Very low	28.3	Very low	117 Å²	117	146.2 Å²	146.2	71%	0.709	76%	0.758	S	S	*	*			trans	-114.4	127.1	-151.1	176.1	0	0	0	0	116.2
118	K	25.8	Very low	28.6	Very low	192 Å²	192	142 Å²	142	84%	0.835	75%	0.745	S	S	*	*			trans	-178.5	137.2	134.9	-97.7	154.1	-179.4	177.1	0	109.1
119	R	26.8	Very low	28.9	Very low	211 Å²	211	145.1 Å²	145.1	80%	0.796	74%	0.738	S	S	*	*			cis	89.6	129.2	45.3	-109.6	-163.8	179.3	-176.2	2.8	114.9
120	D	27.3	Very low	29.1	Very low	118 Å²	118	146.9 Å²	146.9	63%	0.631	74%	0.738	S	S	*	*			trans	73.4	96.5	153.5	-51.5	-19.7	0	0	0	116.7
121	V	30.9	Very low	29.3	Very low	121 Å²	121	144.7 Å²	144.7	73%	0.733	73%	0.729	S	S	*	*				77.6	154.1	92	-77.5	0	0	0	0	116.2
122	D	30.2	Very low	29.4	Very low	143 Å²	143	143.5 Å²	143.5	77%	0.765	73%	0.727	S	S	*	*			cis	-101.3	-141.3	-9.5	-69.3	-78.9	0	0	0	109.7
123	E	33.2	Very low	29.4	Very low	181 Å²	181	145.9 Å²	145.9	85%	0.846	74%	0.735	S	S	*	*			cis	-161.5	158.5	-4.7	-133.2	-176.5	-162.6	0	0	104.3
124	D	29.9	Very low	29.3	Very low	155 Å²	155	142.8 Å²	142.8	83%	0.829	73%	0.73	S	S	*	*			cis	-152.7	165.7	-1.8	-179.3	33.9	0	0	0	109.3
125	G	28.5	Very low	29.2	Very low	60 Å²	60	143.4 Å²	143.4	62%	0.619	73%	0.734	S	S	*	*			trans	82.9	135.9	152.5	0	0	0	0	0	119.1
126	D	30.7	Very low	28.9	Very low	116 Å²	116	141.5 Å²	141.5	62%	0.62	73%	0.729	S	S	*	*			cis	-162.9	149	-9.1	-170.6	10	0	0	0	109.8
127	R	34.8	Very low	28.8	Very low	192 Å²	192	141.2 Å²	141.2	73%	0.725	73%	0.727	S	S	*	*			trans	27	142.8	162.9	-79.7	170	-78	-173	-1.5	120.5
128	D	32.8	Very low	28.6	Very low	102 Å²	102	144.1 Å²	144.1	55%	0.545	73%	0.734	S	S	.	*			cis	-175.5	163.8	20.3	-113.9	-27.8	0	0	0	107.5
129	R	32.2	Very low	28.5	Very low	182 Å²	182	141.1 Å²	141.1	69%	0.687	73%	0.732	S	S	*	*			cis	-169.4	150.7	-14.7	-149.9	-173.2	-68.3	156.4	6	109.8
130	D	30.8	Very low	28.3	Very low	107 Å²	107	139.5 Å²	139.5	57%	0.572	73%	0.733	S	S	*	*			trans	59.8	156.5	149.2	-74.8	-2.9	0	0	0	121.6
131	R	28.8	Very low	28.2	Very low	197 Å²	197	136.8 Å²	136.8	74%	0.743	73%	0.733	S	S	*	*			cis	-163.2	134.1	-11.8	-112.2	173.5	156.3	94.3	3.7	108
132	V	28	Very low	28	Very low	110 Å²	110	136.8 Å²	136.8	67%	0.667	74%	0.739	S	S	*	*				93	137.8	79.1	161.1	0	0	0	0	115.9
133	D	26.8	Very low	28	Very low	159 Å²	159	135.2 Å²	135.2	85%	0.85	74%	0.739	S	S	*	*			trans	48.5	150.6	163.9	-60.8	-13.3	0	0	0	120
134	G	24.9	Very low	27.8	Very low	66 Å²	66	131 Å²	131	68%	0.68	73%	0.729	S	S	*	*			cis	134.7	156	27	0	0	0	0	0	109
135	N	24.8	Very low	27.8	Very low	160 Å²	160	128.6 Å²	128.6	86%	0.856	73%	0.725	S	S	*	*			trans	65.2	140.8	174.6	-71.6	-19.9	0	0	0	117.4
136	V	25.1	Very low	27.7	Very low	121 Å²	121	130.5 Å²	130.5	73%	0.733	73%	0.729	S	S	*	*			cis	90.4	141.5	45	174.5	0	0	0	0	112.8
137	L	23.3	Very low	27.7	Very low	156 Å²	156	129.3 Å²	129.3	82%	0.817	73%	0.729	S	S	*	*			trans	77.8	130.1	-165.2	-50.6	178.6	0	0	0	112.8
138	M	24	Very low	27.5	Very low	177 Å²	177	130.3 Å²	130.3	87%	0.872	73%	0.733	S	S	*	*			cis	61.7	114	49.4	-74.1	-144.6	-173.2	0	0	114.9
139	V	24.3	Very low	27.3	Very low	130 Å²	130	132.3 Å²	132.3	79%	0.788	74%	0.741	S	S	*	*				-176.3	166.6	121.8	141.7	0	0	0	0	111
140	Q	23.1	Very low	27.1	Very low	176 Å²	176	132.4 Å²	132.4	82%	0.822	75%	0.746	S	S	*	*			trans	-53.3	162.5	-178.3	-58.2	125.7	-26.1	0	0	114.8
141	G	26	Very low	26.9	Very low	61 Å²	61	131.4 Å²	131.4	63%	0.629	75%	0.753	S	S	*	*			cis	140	-164.2	-1.1	0	0	0	0	0	112.7
142	S	26.6	Very low	26.8	Very low	121 Å²	121	129.9 Å²	129.9	85%	0.846	75%	0.754	S	S	*	*			trans	62.2	151.2	175.4	36.7	0	0	0	0	117.4
143	S	28.7	Very low	26.8	Very low	110 Å²	110	135 Å²	135	77%	0.769	76%	0.762	S	S	*	*			cis	-166.8	178.9	-19.8	62.9	0	0	0	0	107.8
144	S	29.1	Very low	26.8	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	75%	0.751	S	S	*	*			cis	-161.2	155.2	14.6	51	0	0	0	0	112.4
145	S	30.8	Very low	26.8	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	76%	0.756	S	S	*	*			trans	59	152.4	152.1	47.3	0	0	0	0	120.8
146	S	26.5	Very low	26.7	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	75%	0.749	S	S	*	*			cis	-140.4	133.6	2.1	-122.1	0	0	0	0	109.6
147	S	29.9	Very low	26.7	Very low	90 Å²	90	139.8 Å²	139.8	63%	0.629	75%	0.751	S	S	*	*				69.9	143	81.3	-54.8	0	0	0	0	114.1
148	R	32	Very low	26.7	Very low	213 Å²	213	138.5 Å²	138.5	80%	0.804	75%	0.75	S	S	*	*			cis	-170.1	161.2	-10.2	-96.6	174.3	-168.5	-173.9	1.1	103.7
149	M	27.8	Very low	26.8	Very low	144 Å²	144	138.5 Å²	138.5	71%	0.709	75%	0.75	S	S	*	*			cis	-163.9	-171.7	-1.1	-113	174.7	-178.1	0	0	104.7
150	K	27.2	Very low	26.8	Very low	185 Å²	185	138.2 Å²	138.2	80%	0.804	75%	0.754	S	S	*	*			cis	-164.8	168.9	0	-122.3	-177.4	-179.4	-177.7	0	104.5
151	A	26.5	Very low	26.9	Very low	86 Å²	86	133.3 Å²	133.3	71%	0.711	74%	0.744	S	S	*	*			cis	-156.1	167.4	-9	0	0	0	0	0	109.3
152	E	27.7	Very low	26.8	Very low	164 Å²	164	141.8 Å²	141.8	77%	0.766	76%	0.759	S	S	*	*			trans	-81.7	-175.1	160.9	-48.3	179.5	131.9	0	0	110
153	R	27.9	Very low	26.7	Very low	219 Å²	219	139.1 Å²	139.1	83%	0.826	75%	0.75	S	S	*	*			cis	-173.1	150.8	26.4	-148.2	172.3	175.6	-174.2	-0.8	112.7
154	A	25.8	Very low	26.6	Very low	76 Å²	76	139.8 Å²	139.8	63%	0.628	76%	0.755	S	S	*	*			trans	30.5	125.1	143.9	0	0	0	0	0	125.5
155	L	24.9	Very low	26.5	Very low	150 Å²	150	140.7 Å²	140.7	79%	0.785	76%	0.761	S	S	*	*				82.5	133.4	120.7	-69	174.9	0	0	0	125.8
156	Y	23.6	Very low	26.4	Very low	182 Å²	182	139.8 Å²	139.8	71%	0.714	77%	0.769	S	S	*	*			trans	89.9	132.2	137.9	-94.6	-58.4	0	0	0	124.8
157	Y	24.8	Very low	26.4	Very low	197 Å²	197	138.2 Å²	138.2	77%	0.773	77%	0.768	S	S	*	*			trans	62	156.2	165.3	-71.9	-73.4	0	0	0	117.5
158	T	23.7	Very low	26.3	Very low	129 Å²	129	139.7 Å²	139.7	79%	0.791	78%	0.779	S	S	*	*			cis	-144.4	166	18.4	-40.8	0	0	0	0	112.3
159	M	25.1	Very low	26.3	Very low	177 Å²	177	135.8 Å²	135.8	87%	0.872	78%	0.778	S	S	*	*			trans	-95.3	142.4	168.1	-81.8	-159.3	-88	0	0	113.6
160	S	25.1	Very low	26.3	Very low	124 Å²	124	136.2 Å²	136.2	87%	0.867	78%	0.783	S	S	*	*			trans	176.3	154	144.6	-80.9	0	0	0	0	108.4
161	A	25.6	Very low	26.5	Very low	74 Å²	74	131.3 Å²	131.3	61%	0.612	78%	0.777	S	S	*	*			cis	147	154.5	-11	0	0	0	0	0	106.2
162	Y	24.2	Very low	26.5	Very low	239 Å²	239	131.5 Å²	131.5	94%	0.937	78%	0.779	S	S	*	*			trans	69	138.7	-171.9	-56.1	-86.5	0	0	0	115.7
163	G	24.6	Very low	26.6	Very low	65 Å²	65	133.1 Å²	133.1	67%	0.67	79%	0.787	S	S	*	*			cis	172.4	173.6	-8.6	0	0	0	0	0	113.5
164	S	26.5	Very low	26.5	Very low	124 Å²	124	126.7 Å²	126.7	87%	0.867	79%	0.788	S	S	*	*			trans	67.5	153.9	165.9	-70.5	0	0	0	0	118.7
165	S	27.1	Very low	26.6	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	80%	0.801	S	S	*	*			cis	-172.1	144.8	-16.8	49.2	0	0	0	0	112.6
166	G	27.6	Very low	26.7	Very low	87 Å²	87	125.6 Å²	125.6	90%	0.897	80%	0.801	S	S	*	*			trans	76	155.2	164.6	0	0	0	0	0	116
167	G	27	Very low	26.8	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	81%	0.81	S	S	*	*			cis	-174.3	137.1	-10.5	0	0	0	0	0	107.4
168	S	28	Very low	26.9	Very low	121 Å²	121	117.9 Å²	117.9	85%	0.846	82%	0.816	S	S	*	*				74.7	83	57.6	-64.3	0	0	0	0	114.8
169	V	30.7	Very low	26.9	Very low	131 Å²	131	115.8 Å²	115.8	79%	0.794	82%	0.82	S	S	*	*			trans	-165.8	129.4	139	-90.4	0	0	0	0	105.8
170	D	29.5	Very low	27	Very low	152 Å²	152	111 Å²	111	81%	0.813	82%	0.816	S	S	*	*				76.4	136.5	57.5	-68.7	-44.9	0	0	0	113.8
171	A	30.3	Very low	27.1	Very low	82 Å²	82	117.3 Å²	117.3	68%	0.678	82%	0.82	S	S	*	*			cis	-167.8	170.8	-11.6	0	0	0	0	0	111
172	A	27.5	Very low	27.2	Very low	91 Å²	91	122.8 Å²	122.8	75%	0.752	83%	0.833	S	S	*	*			trans	63.3	161.8	155.2	0	0	0	0	0	118.3
173	Q	28.6	Very low	27.3	Very low	198 Å²	198	123.1 Å²	123.1	93%	0.925	83%	0.833	S	S	*	*			cis	-157.5	158.4	-18.5	-113.7	172.8	18.1	0	0	107.6
174	G	27.1	Very low	27.5	Very low	83 Å²	83	129 Å²	129	86%	0.856	84%	0.843	S	S	*	*			trans	168.5	112.6	171	0	0	0	0	0	115.1
175	S	26.8	Very low	27.5	Very low	128 Å²	128	127.3 Å²	127.3	90%	0.895	84%	0.836	S	S	*	*			trans	-111.3	142.2	-174.8	55.6	0	0	0	0	113.7
176	G	26.6	Very low	27.8	Very low	76 Å²	76	128.3 Å²	128.3	78%	0.784	84%	0.84	S	S	*	*			trans	-164.7	142.8	168.4	0	0	0	0	0	111.2
177	S	27	Very low	27.8	Very low	130 Å²	130	132 Å²	132	91%	0.909	84%	0.838	S	S	*	*			trans	-131.9	147.8	-163.6	-60.7	0	0	0	0	115.7
178	G	25.7	Very low	27.9	Very low	87 Å²	87	140.4 Å²	140.4	90%	0.897	85%	0.851	S	S	*	*			trans	92	144.4	161.9	0	0	0	0	0	115.6
179	G	25.1	Very low	27.9	Very low	85 Å²	85	138.1 Å²	138.1	88%	0.876	85%	0.846	S	S	*	*			cis	169.8	128.9	-9.1	0	0	0	0	0	111.6
180	G	25.9	Very low	27.6	Very low	76 Å²	76	143 Å²	143	78%	0.784	85%	0.85	S	S	*	*			trans	-163.3	89.3	-171.5	0	0	0	0	0	115.2	Q182	G180-Q182 PolarHBondContact O-N 3.48Å
181	R	28.1	Very low	27.5	Very low	256 Å²	256	144.7 Å²	144.7	97%	0.966	85%	0.85	S	S	*	*			trans	-50.9	124.6	-176.1	-64.7	165.8	171.1	157.3	-4.7	114.9
182	Q	26.4	Very low	27.5	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	86%	0.858	S	S	*	*			trans	-87.6	160.2	151.1	-73	-178.9	-28.1	0	0	110.4	G180	G180-Q182 PolarHBondContact O-N 3.48Å
183	R	28.1	Very low	27.4	Very low	247 Å²	247	150.8 Å²	150.8	93%	0.932	86%	0.864	S	S	*	*			trans	-111.9	152.4	174.9	-81	-173.1	171.2	-174	-1.8	111.7
184	H	27.9	Very low	27.4	Very low	188 Å²	188	146 Å²	146	87%	0.87	86%	0.858	S	S	*	*			trans	-77	154.6	-167	-68.8	-111	0	0	0	114.9
185	A	26.6	Very low	27.4	Very low	88 Å²	88	151.6 Å²	151.6	73%	0.727	86%	0.862	S	S	*	*			trans	-112.3	142.7	145.7	0	0	0	0	0	108.7
186	P	33.9	Very low	27.4	Very low	131 Å²	131	152.9 Å²	152.9	85%	0.851	86%	0.859	S	S	*	*			trans	-85.4	150	-175.3	33.1	-34.7	0	0	0	113.6
187	L	27.8	Very low	27.4	Very low	166 Å²	166	157.3 Å²	157.3	87%	0.869	86%	0.864	S	S	*	*			trans	-113.1	148.2	172.5	-79.9	163.5	0	0	0	110.5
188	Y	28.2	Very low	27.4	Very low	244 Å²	244	156.8 Å²	156.8	96%	0.957	86%	0.857	S	S	*	*			trans	-147.5	130.4	156.1	-103	-86.6	0	0	0	107.5
189	G	27.4	Very low	27.6	Very low	72 Å²	72	157.1 Å²	157.1	74%	0.742	85%	0.852	S	S	*	*			cis	-165.3	158.9	-10.1	0	0	0	0	0	109.9
190	R	26.1	Very low	27.9	Very low	234 Å²	234	159.8 Å²	159.8	88%	0.883	85%	0.851	S	S	*	*			trans	-134.8	144.5	174.3	-169.6	177.4	175.8	169.6	-1.1	109.4
191	F	27.6	Very low	28	Very low	188 Å²	188	165.2 Å²	165.2	83%	0.825	86%	0.856	S	S	*	*			trans	-18.1	137.9	177.1	-64.7	-90.5	0	0	0	118.1
192	V	29.1	Very low	28	Very low	138 Å²	138	162.6 Å²	162.6	84%	0.836	85%	0.845	S	S	*	*			trans	-87.2	148.3	162.4	-69.3	0	0	0	0	110.4
193	D	25.2	Very low	28.2	Very low	163 Å²	163	159.4 Å²	159.4	87%	0.872	84%	0.835	S	S	*	*			trans	-85.3	175.7	167.4	-71.9	-60.8	0	0	0	111.2
194	A	29.1	Very low	28.4	Very low	98 Å²	98	153.8 Å²	153.8	81%	0.81	83%	0.828	S	S	*	*			trans	-97.5	162.5	-175.1	0	0	0	0	0	113.5
195	E	27.6	Very low	28.4	Very low	199 Å²	199	152.1 Å²	152.1	93%	0.93	82%	0.822	S	S	*	*			trans	-118	161	162.9	-82.8	-164.3	143.1	0	0	111.1
196	D	26.1	Very low	28.6	Very low	155 Å²	155	155.2 Å²	155.2	83%	0.829	82%	0.821	S	S	*	*			trans	-80	154.1	-165	-65.6	-69.7	0	0	0	116.1
197	L	26.1	Very low	28.6	Very low	170 Å²	170	157.2 Å²	157.2	89%	0.89	82%	0.819	S	S	*	*			trans	-132.9	149.1	143.9	-83.9	-179.9	0	0	0	109.9
198	P	28.3	Very low	28.8	Very low	119 Å²	119	159 Å²	159	77%	0.773	82%	0.822	S	S	*	*			trans	-85.3	159.1	-150.6	32.4	-37.8	0	0	0	115.6
199	A	30	Very low	28.9	Very low	94 Å²	94	152.7 Å²	152.7	78%	0.777	81%	0.814	S	S	*	*			trans	-70.7	155	178.3	0	0	0	0	0	114.1
200	T	29.4	Very low	29.4	Very low	141 Å²	141	154.2 Å²	154.2	87%	0.865	81%	0.813	S	S	*	*			trans	-156.3	155.7	140.6	8.8	0	0	0	0	112
201	H	29.3	Very low	30	Very low	190 Å²	190	148.7 Å²	148.7	88%	0.88	81%	0.807	S	S	*	*			trans	73.6	155.5	175	-112.8	-87.6	0	0	0	119.9
202	R	28.8	Very low	31	Very low	200 Å²	200	145.6 Å²	145.6	76%	0.755	81%	0.809	S	S	*	*			trans	-143.6	161.7	-147.4	-147.5	-174.9	-179	161.3	2.2	110
203	D	29.1	Very low	32	Very low	123 Å²	123	140.5 Å²	140.5	66%	0.658	78%	0.78	S	S	*	*			trans	62.8	99	162.5	-52.2	-41.2	0	0	0	116.3
204	V	32.4	Very low	33.5	Very low	129 Å²	129	136.5 Å²	136.5	78%	0.782	77%	0.765	S	S	*	*				82.3	112.8	73.5	167.1	0	0	0	0	113
205	M	27.6	Very low	34.6	Very low	152 Å²	152	135.7 Å²	135.7	75%	0.749	75%	0.753	S	S	*	*			trans	-162.6	143.5	139.8	-101.7	-48.9	179	0	0	113
206	H	31.1	Very low	35.7	Very low	153 Å²	153	132 Å²	132	71%	0.708	74%	0.735	S	S	*	*			trans	57.9	126.5	156.9	-63.8	-51.9	0	0	0	124.8
207	H	34.3	Very low	37	Very low	173 Å²	173	128.5 Å²	128.5	80%	0.801	72%	0.72	S	S	*	*			trans	-1.4	133.9	149.5	-69.1	-84.1	0	0	0	121	S209	H207-S209 PolarHBondContact O-N 2.9Å
208	H	32.1	Very low	38.4	Very low	203 Å²	203	128.1 Å²	128.1	94%	0.94	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-57.6	129.3	165.4	-62.1	-75.5	0	0	0	113.1
209	S	30.7	Very low	39.6	Very low	113 Å²	113	125.3 Å²	125.3	79%	0.79	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-103.3	167.2	163.5	-65.7	0	0	0	0	111.1	H207	H207-S209 PolarHBondContact O-N 2.9Å
210	S	36.7	Very low	40.6	Very low	104 Å²	104	128 Å²	128	73%	0.727	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-52.5	152.8	176.8	-54.6	0	0	0	0	113.6	S212	S210-S212 PolarHBondContact O-N 3.19Å
211	P	40.3	Very low	41.9	Very low	117 Å²	117	126.9 Å²	126.9	76%	0.76	68%	0.677	S	S	*	*			trans	-72.8	80.4	-173.5	30.5	-37	0	0	0	113.4	S213	P211-S213 PolarHBondContact O-N 3.28Å; P211-S213 VanDerWaalsContact O-N 3.14Å
212	S	47.7	Very low	43	Very low	123 Å²	123	121.9 Å²	121.9	86%	0.86	67%	0.668	S	S	*	*			trans	-83.6	51.5	171.6	53.1	0	0	0	0	112.4	S210	S210-S212 PolarHBondContact O-N 3.19Å
213	S	49.4	Very low	44.1	Very low	31 Å²	31	122.9 Å²	122.9	22%	0.217	67%	0.672	C	S	.	*			trans	-105.9	112.7	174.6	117.8	0	0	0	0	110.8	P211 S215 E216	P211-S213 PolarHBondContact O-N 3.28Å; P211-S213 VanDerWaalsContact O-N 3.14Å; S213-S215 PolarHBondContact O-N 2.84Å; S213-S215 PolarHBondContact OG-OG 2.77Å; S213-E216 WeakPolarHBondContact CB-OE2 3.31Å; S213-E216 WeakPolarHBondContact OG-CB 3.44Å; S213-E216 VanDerWaalsContact OG-CG 3.31Å; S213-E216 WeakPolarHBondContact OG-CG 3.37Å; S213-E216 PolarHBondContact OG-N 3.31Å; S213-E216 PolarHBondContact OG-OE2 3.11Å
214	S	56.5	Low	45.3	Very low	80 Å²	80	122.2 Å²	122.2	56%	0.559	67%	0.667	S	S	*	*	H	α-helix	trans	-74.9	-3.6	176.9	70.5	0	0	0	0	113.3	R218	S214-R218 VanDerWaalsContact O-CD 3.32Å; S214-R218 WeakPolarHBondContact O-CD 3.29Å; S214-R218 VanDerWaalsContact O-CG 3.26Å; S214-R218 WeakPolarHBondContact O-CG 3.43Å; S214-R218 PolarHBondContact O-NH1 3.05Å; S214-R218 PolarHBondContact OG-NH1 2.91Å
215	S	52.7	Low	46.3	Very low	80 Å²	80	120.3 Å²	120.3	56%	0.559	66%	0.657	S	S	*	*	H	α-helix	trans	-82.8	-45.9	176	32.1	0	0	0	0	112.4	S213 R218 A219	S213-S215 PolarHBondContact O-N 2.84Å; S213-S215 PolarHBondContact OG-OG 2.77Å; S215-R218 PolarHBondContact O-N 2.79Å; S215-A219 WeakPolarHBondContact O-CB 3.45Å; S215-A219 PolarHBondContact O-N 2.77Å
216	E	50.1	Low	47.8	Very low	121 Å²	121	120.2 Å²	120.2	57%	0.565	66%	0.66	S	S	*	*	H	α-helix	trans	-75.4	-36.5	-173.9	-69.7	167.7	116.9	0	0	112.6	S213 R218 A219 M220	S213-E216 WeakPolarHBondContact CB-OE2 3.31Å; S213-E216 WeakPolarHBondContact OG-CB 3.44Å; S213-E216 VanDerWaalsContact OG-CG 3.31Å; S213-E216 WeakPolarHBondContact OG-CG 3.37Å; S213-E216 PolarHBondContact OG-N 3.31Å; S213-E216 PolarHBondContact OG-OE2 3.11Å; E216-R218 VanDerWaalsContact C-N 3.32Å; E216-R218 PolarHBondContact O-N 3.25Å; E216-A219 PolarHBondContact O-N 2.81Å; E216-A219 VanDerWaalsContact O-N 3.15Å; E216-M220 PolarHBondContact O-N 3.27Å
217	V	54.3	Low	49.3	Very low	83 Å²	83	121.1 Å²	121.1	50%	0.503	66%	0.664	S	S	.	*	H	α-helix	trans	-60.8	-43.1	172.2	-179.2	0	0	0	0	110.7	M220 Q221	V217-M220 PolarHBondContact O-N 3.37Å; V217-Q221 WeakPolarHBondContact O-CB 3.48Å; V217-Q221 WeakPolarHBondContact O-CG 3.35Å; V217-Q221 PolarHBondContact O-N 3.14Å
218	R	56.3	Low	50.5	Low	162 Å²	162	121.4 Å²	121.4	61%	0.611	66%	0.663	S	S	*	*	H	α-helix	trans	-62.8	-40.3	172.9	-76.9	179.4	-179.7	126.3	-6.9	112.1	S214 S215 E216 M220 Q221 A222	S214-R218 VanDerWaalsContact O-CD 3.32Å; S214-R218 WeakPolarHBondContact O-CD 3.29Å; S214-R218 VanDerWaalsContact O-CG 3.26Å; S214-R218 WeakPolarHBondContact O-CG 3.43Å; S214-R218 PolarHBondContact O-NH1 3.05Å; S214-R218 PolarHBondContact OG-NH1 2.91Å; S215-R218 PolarHBondContact O-N 2.79Å; E216-R218 VanDerWaalsContact C-N 3.32Å; E216-R218 PolarHBondContact O-N 3.25Å; R218-M220 VanDerWaalsContact C-N 3.31Å; R218-M220 PolarHBondContact O-N 3.24Å; R218-Q221 PolarHBondContact O-N 3.46Å; R218-A222 VanDerWaalsContact O-CB 3.25Å; R218-A222 WeakPolarHBondContact O-CB 3.32Å; R218-A222 PolarHBondContact O-N 2.93Å
219	A	53.6	Low	51.9	Low	60 Å²	60	121.1 Å²	121.1	50%	0.496	65%	0.654	S	S	.	*	H	α-helix	trans	-65	-32	179.2	0	0	0	0	0	113.2	S215 E216	S215-A219 WeakPolarHBondContact O-CB 3.45Å; S215-A219 PolarHBondContact O-N 2.77Å; E216-A219 PolarHBondContact O-N 2.81Å; E216-A219 VanDerWaalsContact O-N 3.15Å
220	M	51.1	Low	53.7	Low	151 Å²	151	122 Å²	122	74%	0.744	65%	0.646	S	S	*	*	H	α-helix	trans	-76.1	-45.1	170.9	-66.4	-160.2	-173.1	0	0	112.3	E216 V217 R218 A222 R223	E216-M220 PolarHBondContact O-N 3.27Å; V217-M220 PolarHBondContact O-N 3.37Å; R218-M220 VanDerWaalsContact C-N 3.31Å; R218-M220 PolarHBondContact O-N 3.24Å; M220-A222 VanDerWaalsContact C-N 3.29Å; M220-A222 PolarHBondContact O-N 3.16Å; M220-R223 PolarHBondContact O-N 3.27Å; M220-R223 VanDerWaalsContact O-N 3.11Å
221	Q	55.4	Low	55	Low	117 Å²	117	122.5 Å²	122.5	55%	0.547	65%	0.646	S	S	.	*	H	α-helix	trans	-61.3	-36.1	178.9	-74.3	173.8	-27.6	0	0	112.3	V217 R218 R223 I224	V217-Q221 WeakPolarHBondContact O-CB 3.48Å; V217-Q221 WeakPolarHBondContact O-CG 3.35Å; V217-Q221 PolarHBondContact O-N 3.14Å; R218-Q221 PolarHBondContact O-N 3.46Å; Q221-R223 PolarHBondContact O-N 2.59Å; Q221-I224 PolarHBondContact O-N 3.26Å; Q221-I224 VanDerWaalsContact O-N 3.1Å
222	A	52.4	Low	56.2	Low	84 Å²	84	119.4 Å²	119.4	69%	0.694	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-6.4	176.3	0	0	0	0	0	115.1	R218 M220	R218-A222 VanDerWaalsContact O-CB 3.25Å; R218-A222 WeakPolarHBondContact O-CB 3.32Å; R218-A222 PolarHBondContact O-N 2.93Å; M220-A222 VanDerWaalsContact C-N 3.29Å; M220-A222 PolarHBondContact O-N 3.16Å
223	R	53	Low	57.3	Low	221 Å²	221	115.3 Å²	115.3	83%	0.834	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-4.3	174.5	-68	-175.8	176.7	176.6	1	114.1	M220 Q221	M220-R223 PolarHBondContact O-N 3.27Å; M220-R223 VanDerWaalsContact O-N 3.11Å; Q221-R223 PolarHBondContact O-N 2.59Å
224	I	53.4	Low	58.6	Low	109 Å²	109	114.4 Å²	114.4	56%	0.559	60%	0.597	S	S	*	*	S	Bend	trans	-90.4	128.3	170.9	-59.7	174.8	0	0	0	107.9	Q221 N226	Q221-I224 PolarHBondContact O-N 3.26Å; Q221-I224 VanDerWaalsContact O-N 3.1Å; I224-N226 PolarHBondContact O-N 2.93Å
225	P	54.2	Low	59.3	Low	89 Å²	89	114.4 Å²	114.4	58%	0.578	60%	0.596	S	S	*	*			trans	-65.1	109.4	175.2	-22.1	34.2	0	0	0	111.2	H227	P225-H227 CarbonylContact O-C 3.57Å; P225-H227 PolarHBondContact O-N 3.14Å
226	N	59.1	Low	60.3	Low	151 Å²	151	117.8 Å²	117.8	81%	0.807	61%	0.606	S	S	*	*	S	Bend	trans	-58.9	-15.8	179.3	-73.6	-12.3	0	0	0	114.1	I224	I224-N226 PolarHBondContact O-N 2.93Å
227	H	61.2	Low	61.5	Low	171 Å²	171	116.5 Å²	116.5	79%	0.792	60%	0.597	S	S	*	*	S	Bend	trans	-125.3	119.4	162.1	-76.9	-7	0	0	0	110.3	P225	P225-H227 CarbonylContact O-C 3.57Å; P225-H227 PolarHBondContact O-N 3.14Å
228	F	59.5	Low	62.6	Low	180 Å²	180	117.3 Å²	117.3	79%	0.789	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-61.4	145	151.7	-69.2	-90.2	0	0	0	108.4	E230	F228-E230 PolarHBondContact O-N 3.15Å
229	R	61.4	Low	63.4	Low	197 Å²	197	115.3 Å²	115.3	74%	0.743	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-57.6	134.7	172.1	-73.7	-172.7	176.1	-149.9	-0.3	109.2
230	E	68.8	Low	64.4	Low	132 Å²	132	115.9 Å²	115.9	62%	0.617	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-49.6	134.4	176.7	-69.1	-170.3	133.3	0	0	110.9	F228 A232 S233 G234	F228-E230 PolarHBondContact O-N 3.15Å; E230-A232 HydrophobicContact CB-CB 4.36Å; E230-A232 PolarHBondContact O-N 3.4Å; E230-A232 VanDerWaalsContact O-N 3.14Å; E230-S233 WeakPolarHBondContact O-CA 3.48Å; E230-S233 PolarHBondContact O-N 3.46Å; E230-S233 PolarHBondContact O-OG 3.42Å; E230-G234 PolarHBondContact O-N 3.32Å; E230-G234 VanDerWaalsContact O-N 3.13Å
231	P	64.2	Low	65.9	Low	114 Å²	114	113.6 Å²	113.6	74%	0.74	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-52.8	-35.3	172.9	-27.5	35.7	0	0	0	112.3	S233 G234 R237	P231-S233 VanDerWaalsContact C-N 3.32Å; P231-S233 PolarHBondContact O-N 2.89Å; P231-G234 PolarHBondContact O-N 3.35Å; P231-R237 WeakPolarHBondContact O-CD 3.2Å
232	A	67	Low	67.1	Low	51 Å²	51	109.1 Å²	109.1	42%	0.421	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-56	-41.6	173.4	0	0	0	0	0	113.2	E230 R237	E230-A232 HydrophobicContact CB-CB 4.36Å; E230-A232 PolarHBondContact O-N 3.4Å; E230-A232 VanDerWaalsContact O-N 3.14Å; A232-R237 PolarHBondContact O-NH1 2.87Å; A232-R237 VanDerWaalsContact O-NH1 3.09Å
233	S	69.3	Low	68.6	Low	37 Å²	37	109.4 Å²	109.4	26%	0.259	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-87.4	-11.1	-177.5	82.7	0	0	0	0	114.8	E230 P231 K238	E230-S233 WeakPolarHBondContact O-CA 3.48Å; E230-S233 PolarHBondContact O-N 3.46Å; E230-S233 PolarHBondContact O-OG 3.42Å; P231-S233 VanDerWaalsContact C-N 3.32Å; P231-S233 PolarHBondContact O-N 2.89Å; S233-K238 VanDerWaalsContact O-CE 3.25Å; S233-K238 WeakPolarHBondContact O-CE 3.36Å
234	G	76.3	Confident	70	Confident	12 Å²	12	104.9 Å²	104.9	12%	0.124	55%	0.549	C	S	.	.			trans	-59.9	145.3	-165.6	0	0	0	0	0	113.7	E230 P231 L236 R237 K238	E230-G234 PolarHBondContact O-N 3.32Å; E230-G234 VanDerWaalsContact O-N 3.13Å; P231-G234 PolarHBondContact O-N 3.35Å; G234-L236 PolarHBondContact O-N 2.88Å; G234-R237 PolarHBondContact O-N 3.07Å; G234-R237 VanDerWaalsContact O-N 3.15Å; G234-K238 PolarHBondContact O-N 2.86Å
235	P	71.3	Confident	71.5	Confident	81 Å²	81	106.5 Å²	106.5	53%	0.526	55%	0.552	S	S	.	*	H	α-helix	trans	-54.9	-40.1	-179.3	-25.4	34.1	0	0	0	113	K238 L239	P235-K238 PolarHBondContact O-N 3.43Å; P235-L239 WeakPolarHBondContact O-CB 3.31Å; P235-L239 VanDerWaalsContact O-CG 3.24Å; P235-L239 WeakPolarHBondContact O-CG 3.43Å; P235-L239 PolarHBondContact O-N 3.18Å
236	L	74	Confident	72.8	Confident	150 Å²	150	103.4 Å²	103.4	79%	0.785	53%	0.532	S	S	*	.	H	α-helix	trans	-61.5	-49	179.2	-155.7	75.4	0	0	0	111.3	G234 K238 L239 S240	G234-L236 PolarHBondContact O-N 2.88Å; L236-K238 PolarHBondContact O-N 3.46Å; L236-L239 CarbonylContact O-C 3.58Å; L236-L239 PolarHBondContact O-N 2.81Å; L236-L239 VanDerWaalsContact O-N 3.11Å; L236-S240 PolarHBondContact O-N 3.39Å; L236-S240 PolarHBondContact O-OG 3.36Å
237	R	75.4	Confident	73.8	Confident	95 Å²	95	103.2 Å²	103.2	36%	0.358	52%	0.52	S	S	.	.	H	α-helix	trans	-67.1	-34.7	-179.9	-167.7	175.1	177.1	-77.8	-12.4	112.7	P231 A232 G234 L239 S240 V241 D242	P231-R237 WeakPolarHBondContact O-CD 3.2Å; A232-R237 PolarHBondContact O-NH1 2.87Å; A232-R237 VanDerWaalsContact O-NH1 3.09Å; G234-R237 PolarHBondContact O-N 3.07Å; G234-R237 VanDerWaalsContact O-N 3.15Å; R237-L239 VanDerWaalsContact C-N 3.28Å; R237-L239 PolarHBondContact O-N 3.42Å; R237-S240 PolarHBondContact O-N 2.83Å; R237-V241 HydrophobicContact CG-CB 3.91Å; R237-V241 HydrophobicContact CG-CG2 4.06Å; R237-V241 PolarHBondContact O-N 3.33Å; R237-D242 IonicContact CZ-OD2 3.35Å; R237-D242 IonicContact NH1-OD2 3.3Å; R237-D242 PolarHBondContact NH1-OD2 2.99Å; R237-D242 IonicContact NH2-OD2 3.88Å; R237-D242 PolarHBondContact O-N 2.78Å
238	K	77.2	Confident	74.9	Confident	100 Å²	100	101.9 Å²	101.9	44%	0.435	51%	0.513	S	S	.	.	H	α-helix	trans	-67.9	-25.8	172.1	-72	-169.5	176.9	-171	0	113.4	S233 G234 P235 L236 T246	S233-K238 VanDerWaalsContact O-CE 3.25Å; S233-K238 WeakPolarHBondContact O-CE 3.36Å; G234-K238 PolarHBondContact O-N 2.86Å; P235-K238 PolarHBondContact O-N 3.43Å; L236-K238 PolarHBondContact O-N 3.46Å; K238-T246 VanDerWaalsContact O-CB 3.25Å; K238-T246 WeakPolarHBondContact O-CB 3.16Å; K238-T246 PolarHBondContact O-OG1 3.05Å
239	L	73	Confident	76	Confident	119 Å²	119	98.7 Å²	98.7	62%	0.623	50%	0.5	S	S	*	.	H	α-helix	trans	-97.1	-7.3	179.1	-66.9	171.1	0	0	0	113.9	P235 L236 R237	P235-L239 WeakPolarHBondContact O-CB 3.31Å; P235-L239 VanDerWaalsContact O-CG 3.24Å; P235-L239 WeakPolarHBondContact O-CG 3.43Å; P235-L239 PolarHBondContact O-N 3.18Å; L236-L239 CarbonylContact O-C 3.58Å; L236-L239 PolarHBondContact O-N 2.81Å; L236-L239 VanDerWaalsContact O-N 3.11Å; R237-L239 VanDerWaalsContact C-N 3.28Å; R237-L239 PolarHBondContact O-N 3.42Å
240	S	75.9	Confident	77	Confident	73 Å²	73	94 Å²	94	51%	0.51	49%	0.488	S	S	.	.	H	α-helix	trans	-118.6	-67.9	175.4	61.5	0	0	0	0	112.9	L236 R237 L243	L236-S240 PolarHBondContact O-N 3.39Å; L236-S240 PolarHBondContact O-OG 3.36Å; R237-S240 PolarHBondContact O-N 2.83Å; S240-L243 WeakPolarHBondContact O-CB 3.34Å
241	V	82.8	Confident	77.6	Confident	102 Å²	102	89.7 Å²	89.7	62%	0.618	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-50.4	-171.7	-178	0	0	0	0	112.2	R237 L243	R237-V241 HydrophobicContact CG-CB 3.91Å; R237-V241 HydrophobicContact CG-CG2 4.06Å; R237-V241 PolarHBondContact O-N 3.33Å; V241-L243 PolarHBondContact O-N 3.38Å
242	D	80.6	Confident	78.8	Confident	24 Å²	24	90.4 Å²	90.4	13%	0.128	46%	0.463	C	S	.	.	S	Bend	trans	-89.4	18.1	-180	-75.2	-63.8	0	0	0	112.6	R237 I244 K245 T246	R237-D242 IonicContact CZ-OD2 3.35Å; R237-D242 IonicContact NH1-OD2 3.3Å; R237-D242 PolarHBondContact NH1-OD2 2.99Å; R237-D242 IonicContact NH2-OD2 3.88Å; R237-D242 PolarHBondContact O-N 2.78Å; D242-I244 VanDerWaalsContact C-N 3.26Å; D242-I244 PolarHBondContact O-N 2.81Å; D242-I244 VanDerWaalsContact O-N 3.1Å; D242-K245 HydrophobicContact CB-CB 4.46Å; D242-K245 WeakPolarHBondContact O-CA 3.25Å; D242-K245 WeakPolarHBondContact O-CB 3.38Å; D242-K245 PolarHBondContact O-N 3.25Å; D242-K245 WeakPolarHBondContact OD1-CD 3.27Å; D242-K245 WeakPolarHBondContact OD1-CE 3.27Å; D242-K245 IonicContact OD1-NZ 3.78Å; D242-K245 PolarHBondContact OD1-NZ 2.91Å; D242-T246 PolarHBondContact O-N 2.98Å; D242-T246 PolarHBondContact O-OG1 3.11Å
243	L	82.6	Confident	79.7	Confident	89 Å²	89	91.4 Å²	91.4	47%	0.466	46%	0.464	S	S	.	.	H	α-helix	trans	-51	-41.5	-171.1	179.3	60.8	0	0	0	113.3	S240 V241 T246 Y247	S240-L243 WeakPolarHBondContact O-CB 3.34Å; V241-L243 PolarHBondContact O-N 3.38Å; L243-T246 PolarHBondContact O-N 2.97Å; L243-Y247 VanDerWaalsContact O-CB 3.28Å; L243-Y247 WeakPolarHBondContact O-CB 3.36Å; L243-Y247 PolarHBondContact O-N 2.99Å
244	I	82.2	Confident	80.3	Confident	126 Å²	126	95.2 Å²	95.2	65%	0.646	47%	0.473	S	S	*	.	H	α-helix	trans	-67	-39.7	177.5	-61.7	174.2	0	0	0	111.7	D242 K248	D242-I244 VanDerWaalsContact C-N 3.26Å; D242-I244 PolarHBondContact O-N 2.81Å; D242-I244 VanDerWaalsContact O-N 3.1Å; I244-K248 HydrophobicContact CG2-CD 4.42Å; I244-K248 WeakPolarHBondContact O-CB 3.26Å; I244-K248 WeakPolarHBondContact O-CG 3.48Å; I244-K248 PolarHBondContact O-N 3.03Å
245	K	85	Confident	80.5	Confident	143 Å²	143	101.2 Å²	101.2	62%	0.622	49%	0.493	S	S	*	.	H	α-helix	trans	-69.8	-42.7	176.6	-59.4	-178.9	-163.8	151.2	0	110.8	D242 Y247 K248 H249	D242-K245 HydrophobicContact CB-CB 4.46Å; D242-K245 WeakPolarHBondContact O-CA 3.25Å; D242-K245 WeakPolarHBondContact O-CB 3.38Å; D242-K245 PolarHBondContact O-N 3.25Å; D242-K245 WeakPolarHBondContact OD1-CD 3.27Å; D242-K245 WeakPolarHBondContact OD1-CE 3.27Å; D242-K245 IonicContact OD1-NZ 3.78Å; D242-K245 PolarHBondContact OD1-NZ 2.91Å; K245-Y247 VanDerWaalsContact C-N 3.35Å; K245-Y247 PolarHBondContact O-N 3.35Å; K245-K248 PolarHBondContact O-N 3.41Å; K245-H249 WeakPolarHBondContact O-CB 3.46Å; K245-H249 PolarHBondContact O-N 2.89Å
246	T	82.1	Confident	80.9	Confident	25 Å²	25	99.5 Å²	99.5	15%	0.153	49%	0.486	C	S	.	.	H	α-helix	trans	-58.6	-45.7	174	-61.8	0	0	0	0	111	K238 D242 L243 H249 I250	K238-T246 VanDerWaalsContact O-CB 3.25Å; K238-T246 WeakPolarHBondContact O-CB 3.16Å; K238-T246 PolarHBondContact O-OG1 3.05Å; D242-T246 PolarHBondContact O-N 2.98Å; D242-T246 PolarHBondContact O-OG1 3.11Å; L243-T246 PolarHBondContact O-N 2.97Å; T246-H249 PolarHBondContact O-N 3.13Å; T246-I250 HydrophobicContact CG2-CD1 3.75Å; T246-I250 WeakPolarHBondContact O-CB 3.43Å; T246-I250 VanDerWaalsContact O-CG1 3.23Å; T246-I250 WeakPolarHBondContact O-CG1 3.23Å; T246-I250 PolarHBondContact O-N 3.1Å
247	Y	79.3	Confident	81.4	Confident	146 Å²	146	97.6 Å²	97.6	57%	0.573	47%	0.471	S	S	*	.	H	α-helix	trans	-65.2	-46.3	177.2	-176.3	-105.6	0	0	0	112.2	L243 K245 H249 I250 N251	L243-Y247 VanDerWaalsContact O-CB 3.28Å; L243-Y247 WeakPolarHBondContact O-CB 3.36Å; L243-Y247 PolarHBondContact O-N 2.99Å; K245-Y247 VanDerWaalsContact C-N 3.35Å; K245-Y247 PolarHBondContact O-N 3.35Å; Y247-H249 PolarHBondContact O-N 2.87Å; Y247-I250 PolarHBondContact O-N 3.32Å; Y247-N251 WeakPolarHBondContact CE1-ND2 3.26Å; Y247-N251 WeakPolarHBondContact O-CB 3.34Å; Y247-N251 PolarHBondContact O-N 3.39Å; Y247-N251 PolarHBondContact OH-ND2 3.09Å
248	K	84.8	Confident	81.8	Confident	144 Å²	144	99.1 Å²	99.1	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-56.4	-48.8	174	-78.7	-179.1	177.5	-173.2	0	111.6	I244 K245 N251 E252	I244-K248 HydrophobicContact CG2-CD 4.42Å; I244-K248 WeakPolarHBondContact O-CB 3.26Å; I244-K248 WeakPolarHBondContact O-CG 3.48Å; I244-K248 PolarHBondContact O-N 3.03Å; K245-K248 PolarHBondContact O-N 3.41Å; K248-N251 PolarHBondContact O-N 3.14Å; K248-E252 VanDerWaalsContact O-CB 3.26Å; K248-E252 WeakPolarHBondContact O-CB 3.06Å; K248-E252 PolarHBondContact O-N 2.7Å
249	H	82.5	Confident	82	Confident	112 Å²	112	101.1 Å²	101.1	52%	0.519	49%	0.489	S	S	.	.	H	α-helix	trans	-66.2	-39.1	179.3	-176	62.3	0	0	0	113	K245 T246 Y247 E252 V253	K245-H249 WeakPolarHBondContact O-CB 3.46Å; K245-H249 PolarHBondContact O-N 2.89Å; T246-H249 PolarHBondContact O-N 3.13Å; Y247-H249 PolarHBondContact O-N 2.87Å; H249-E252 IonicContact ND1-OE2 3.11Å; H249-E252 PolarHBondContact O-N 3.24Å; H249-V253 WeakPolarHBondContact O-CB 3.31Å; H249-V253 VanDerWaalsContact O-CG2 3.27Å; H249-V253 WeakPolarHBondContact O-CG2 3.36Å; H249-V253 PolarHBondContact O-N 2.88Å
250	I	82.6	Confident	82.2	Confident	98 Å²	98	102.7 Å²	102.7	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-43.9	174.6	-73.2	169.1	0	0	0	110.7	T246 Y247 Y254	T246-I250 HydrophobicContact CG2-CD1 3.75Å; T246-I250 WeakPolarHBondContact O-CB 3.43Å; T246-I250 VanDerWaalsContact O-CG1 3.23Å; T246-I250 WeakPolarHBondContact O-CG1 3.23Å; T246-I250 PolarHBondContact O-N 3.1Å; Y247-I250 PolarHBondContact O-N 3.32Å; I250-Y254 VanDerWaalsContact O-CB 3.23Å; I250-Y254 WeakPolarHBondContact O-CB 3.48Å; I250-Y254 PolarHBondContact O-N 3.46Å
251	N	81.8	Confident	82.2	Confident	42 Å²	42	106.9 Å²	106.9	23%	0.225	49%	0.492	C	S	.	.	H	α-helix	trans	-65	-44	175.8	-82.1	0.9	0	0	0	111.6	Y247 K248 Y254 Y255	Y247-N251 WeakPolarHBondContact CE1-ND2 3.26Å; Y247-N251 WeakPolarHBondContact O-CB 3.34Å; Y247-N251 PolarHBondContact O-N 3.39Å; Y247-N251 PolarHBondContact OH-ND2 3.09Å; K248-N251 PolarHBondContact O-N 3.14Å; N251-Y254 CarbonylContact O-C 3.51Å; N251-Y254 WeakPolarHBondContact O-CB 3.12Å; N251-Y254 PolarHBondContact O-N 2.83Å; N251-Y255 HydrophobicContact CB-CD2 4.29Å; N251-Y255 HydrophobicContact CB-CE2 4.21Å; N251-Y255 WeakPolarHBondContact O-CD2 3.25Å; N251-Y255 PolarHBondContact O-N 2.88Å
252	E	88.6	Confident	81.5	Confident	130 Å²	130	104.4 Å²	104.4	61%	0.607	48%	0.482	S	S	*	.	H	α-helix	trans	-59.4	-47.7	176.2	-178.9	177.1	-124.7	0	0	111.7	K248 H249 Y254 Y255 A256	K248-E252 VanDerWaalsContact O-CB 3.26Å; K248-E252 WeakPolarHBondContact O-CB 3.06Å; K248-E252 PolarHBondContact O-N 2.7Å; H249-E252 IonicContact ND1-OE2 3.11Å; H249-E252 PolarHBondContact O-N 3.24Å; E252-Y254 VanDerWaalsContact C-N 3.33Å; E252-Y254 PolarHBondContact O-N 3.5Å; E252-Y255 PolarHBondContact O-N 3.47Å; E252-A256 WeakPolarHBondContact O-CB 3.23Å; E252-A256 PolarHBondContact O-N 3.47Å
253	V	86.8	Confident	80.8	Confident	71 Å²	71	108.7 Å²	108.7	43%	0.43	50%	0.501	S	S	.	.	H	α-helix	trans	-62.8	-38	173.7	169.7	0	0	0	0	111.6	H249 K257	H249-V253 WeakPolarHBondContact O-CB 3.31Å; H249-V253 VanDerWaalsContact O-CG2 3.27Å; H249-V253 WeakPolarHBondContact O-CG2 3.36Å; H249-V253 PolarHBondContact O-N 2.88Å; V253-K257 WeakPolarHBondContact O-CB 3.22Å; V253-K257 PolarHBondContact O-N 2.91Å
254	Y	81.9	Confident	79.6	Confident	118 Å²	118	111.3 Å²	111.3	46%	0.463	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-49.1	175.5	172.8	-98.5	0	0	0	111.9	I250 N251 E252 K257 K258	I250-Y254 VanDerWaalsContact O-CB 3.23Å; I250-Y254 WeakPolarHBondContact O-CB 3.48Å; I250-Y254 PolarHBondContact O-N 3.46Å; N251-Y254 CarbonylContact O-C 3.51Å; N251-Y254 WeakPolarHBondContact O-CB 3.12Å; N251-Y254 PolarHBondContact O-N 2.83Å; E252-Y254 VanDerWaalsContact C-N 3.33Å; E252-Y254 PolarHBondContact O-N 3.5Å; Y254-K257 CarbonylContact O-C 3.59Å; Y254-K257 PolarHBondContact O-N 3.34Å; Y254-K258 WeakPolarHBondContact O-CB 3.36Å; Y254-K258 PolarHBondContact O-N 2.64Å
255	Y	80.8	Confident	78.4	Confident	137 Å²	137	110.8 Å²	110.8	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-69.7	-36.5	178.6	-72	-62.8	0	0	0	112.2	N251 E252 K257 K258 K259	N251-Y255 HydrophobicContact CB-CD2 4.29Å; N251-Y255 HydrophobicContact CB-CE2 4.21Å; N251-Y255 WeakPolarHBondContact O-CD2 3.25Å; N251-Y255 PolarHBondContact O-N 2.88Å; E252-Y255 PolarHBondContact O-N 3.47Å; Y255-K257 VanDerWaalsContact C-N 3.31Å; Y255-K257 PolarHBondContact O-N 3.19Å; Y255-K258 HydrophobicContact CD1-CD 4.45Å; Y255-K258 PolarHBondContact O-N 2.72Å; Y255-K259 WeakPolarHBondContact O-CB 3.5Å; Y255-K259 PolarHBondContact O-N 3.39Å
256	A	79.3	Confident	76.6	Confident	46 Å²	46	112.1 Å²	112.1	38%	0.38	52%	0.522	S	S	.	.	H	α-helix	trans	-65.5	-33.4	171.1	0	0	0	0	0	112.3	E252 R260	E252-A256 WeakPolarHBondContact O-CB 3.23Å; E252-A256 PolarHBondContact O-N 3.47Å; A256-R260 WeakPolarHBondContact O-CB 3.38Å; A256-R260 WeakPolarHBondContact O-CG 3.25Å; A256-R260 PolarHBondContact O-N 2.85Å
257	K	83.8	Confident	74.9	Confident	110 Å²	110	114.3 Å²	114.3	48%	0.478	55%	0.549	S	S	.	.	H	α-helix	trans	-74.7	-33.2	172.6	-167.5	170.5	-174.6	173.1	0	112.1	V253 Y254 Y255 R261	V253-K257 WeakPolarHBondContact O-CB 3.22Å; V253-K257 PolarHBondContact O-N 2.91Å; Y254-K257 CarbonylContact O-C 3.59Å; Y254-K257 PolarHBondContact O-N 3.34Å; Y255-K257 VanDerWaalsContact C-N 3.31Å; Y255-K257 PolarHBondContact O-N 3.19Å; K257-R261 WeakPolarHBondContact O-CB 3.43Å; K257-R261 VanDerWaalsContact O-CG 3.29Å; K257-R261 WeakPolarHBondContact O-CG 3.2Å; K257-R261 PolarHBondContact O-N 2.93Å; K257-R261 VanDerWaalsContact O-N 3.14Å
258	K	85	Confident	73.3	Confident	127 Å²	127	113.8 Å²	113.8	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-67.3	-44.7	171.1	-169.7	-178.9	178.9	-174.7	0	111.2	Y254 Y255 R261 A262	Y254-K258 WeakPolarHBondContact O-CB 3.36Å; Y254-K258 PolarHBondContact O-N 2.64Å; Y255-K258 HydrophobicContact CD1-CD 4.45Å; Y255-K258 PolarHBondContact O-N 2.72Å; K258-R261 PolarHBondContact O-N 3.32Å; K258-A262 PolarHBondContact O-N 3.21Å
259	K	80.4	Confident	71.5	Confident	141 Å²	141	114.6 Å²	114.6	61%	0.613	57%	0.568	S	S	*	*	H	α-helix	trans	-63.1	-47.5	177.3	-169.7	175.3	-179	177.2	0	111.6	Y255 R261 A262 Q263	Y255-K259 WeakPolarHBondContact O-CB 3.5Å; Y255-K259 PolarHBondContact O-N 3.39Å; K259-R261 VanDerWaalsContact C-N 3.32Å; K259-R261 PolarHBondContact O-N 2.82Å; K259-A262 PolarHBondContact O-N 2.88Å; K259-Q263 WeakPolarHBondContact O-CG 3.35Å; K259-Q263 PolarHBondContact O-N 2.78Å; K259-Q263 PolarHBondContact O-OE1 3.19Å
260	R	77.6	Confident	69.9	Low	153 Å²	153	116.4 Å²	116.4	58%	0.577	58%	0.581	S	S	*	*	H	α-helix	trans	-57.4	-41.7	172.9	-79.4	-173.4	-70.4	169.5	-7.1	112.8	A256 Q263 Q264	A256-R260 WeakPolarHBondContact O-CB 3.38Å; A256-R260 WeakPolarHBondContact O-CG 3.25Å; A256-R260 PolarHBondContact O-N 2.85Å; R260-Q263 PolarHBondContact O-N 2.94Å; R260-Q264 WeakPolarHBondContact O-CB 3.33Å; R260-Q264 VanDerWaalsContact O-CG 3.31Å; R260-Q264 WeakPolarHBondContact O-CG 3.48Å; R260-Q264 PolarHBondContact O-N 3.34Å
261	R	74.8	Confident	68.1	Low	161 Å²	161	116.5 Å²	116.5	61%	0.608	59%	0.59	S	S	*	*	H	α-helix	trans	-64.7	-42.8	175.4	-77.4	171.3	167.5	-168.3	-8.5	112.7	K257 K258 K259 Q264 T265	K257-R261 WeakPolarHBondContact O-CB 3.43Å; K257-R261 VanDerWaalsContact O-CG 3.29Å; K257-R261 WeakPolarHBondContact O-CG 3.2Å; K257-R261 PolarHBondContact O-N 2.93Å; K257-R261 VanDerWaalsContact O-N 3.14Å; K258-R261 PolarHBondContact O-N 3.32Å; K259-R261 VanDerWaalsContact C-N 3.32Å; K259-R261 PolarHBondContact O-N 2.82Å; R261-Q264 CarbonylContact O-C 3.55Å; R261-Q264 PolarHBondContact O-N 2.72Å; R261-T265 PolarHBondContact O-N 2.92Å; R261-T265 VanDerWaalsContact O-N 3.17Å; R261-T265 PolarHBondContact O-OG1 3.46Å
262	A	68.6	Low	66.5	Low	50 Å²	50	119.4 Å²	119.4	41%	0.413	61%	0.614	S	S	.	*	H	α-helix	trans	-62.5	-42.7	175.5	0	0	0	0	0	111.9	K258 K259 T265 Q266	K258-A262 PolarHBondContact O-N 3.21Å; K259-A262 PolarHBondContact O-N 2.88Å; A262-T265 WeakPolarHBondContact O-CA 3.45Å; A262-T265 WeakPolarHBondContact O-CB 3.36Å; A262-T265 PolarHBondContact O-N 3.1Å; A262-Q266 PolarHBondContact O-N 2.83Å
263	Q	65.4	Low	64.3	Low	114 Å²	114	120.9 Å²	120.9	53%	0.533	63%	0.626	S	S	.	*	H	α-helix	trans	-65.5	-38	175.5	-69.3	173.5	-57.1	0	0	112	K259 R260 T265 Q266	K259-Q263 WeakPolarHBondContact O-CG 3.35Å; K259-Q263 PolarHBondContact O-N 2.78Å; K259-Q263 PolarHBondContact O-OE1 3.19Å; R260-Q263 PolarHBondContact O-N 2.94Å; Q263-T265 PolarHBondContact O-N 3.46Å; Q263-Q266 PolarHBondContact O-N 3.09Å; Q263-Q266 VanDerWaalsContact O-N 3.14Å
264	Q	59.4	Low	62.5	Low	144 Å²	144	126.4 Å²	126.4	67%	0.673	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-7	168.7	-73.1	-178.9	-58.2	0	0	114.2	R260 R261	R260-Q264 WeakPolarHBondContact O-CB 3.33Å; R260-Q264 VanDerWaalsContact O-CG 3.31Å; R260-Q264 WeakPolarHBondContact O-CG 3.48Å; R260-Q264 PolarHBondContact O-N 3.34Å; R261-Q264 CarbonylContact O-C 3.55Å; R261-Q264 PolarHBondContact O-N 2.72Å
265	T	55.5	Low	61	Low	114 Å²	114	130.2 Å²	130.2	70%	0.699	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	1	174.7	-40.7	0	0	0	0	112	R261 A262 Q263	R261-T265 PolarHBondContact O-N 2.92Å; R261-T265 VanDerWaalsContact O-N 3.17Å; R261-T265 PolarHBondContact O-OG1 3.46Å; A262-T265 WeakPolarHBondContact O-CA 3.45Å; A262-T265 WeakPolarHBondContact O-CB 3.36Å; A262-T265 PolarHBondContact O-N 3.1Å; Q263-T265 PolarHBondContact O-N 3.46Å
266	Q	48.4	Very low	59.9	Low	172 Å²	172	132.3 Å²	132.3	80%	0.804	68%	0.678	S	S	*	*	S	Bend	trans	-129.4	15.7	-175.9	-68.7	-172.3	-56.2	0	0	113.9	A262 Q263	A262-Q266 PolarHBondContact O-N 2.83Å; Q263-Q266 PolarHBondContact O-N 3.09Å; Q263-Q266 VanDerWaalsContact O-N 3.14Å
267	G	45.4	Very low	59.1	Low	70 Å²	70	141.2 Å²	141.2	72%	0.722	70%	0.702	S	S	*	*	S	Bend	trans	-142.6	24.6	-179.3	0	0	0	0	0	114
268	D	45	Very low	59	Low	135 Å²	135	143 Å²	143	72%	0.722	71%	0.709	S	S	*	*			trans	-129.7	30.2	-170.7	-150.5	46.9	0	0	0	110.7
269	D	48.3	Very low	59.1	Low	161 Å²	161	143.1 Å²	143.1	86%	0.861	72%	0.716	S	S	*	*	S	Bend	trans	-98.7	11.6	-175.5	-123.1	0.5	0	0	0	113
270	D	48.7	Very low	59.7	Low	151 Å²	151	139.9 Å²	139.9	81%	0.807	70%	0.7	S	S	*	*	S	Bend	trans	-140.8	148.4	171.5	-155.3	-12.8	0	0	0	111.3
271	S	43.8	Very low	60.5	Low	99 Å²	99	133.9 Å²	133.9	69%	0.692	68%	0.679	S	S	*	*	S	Bend	trans	60.9	75.4	176.6	-148.5	0	0	0	0	118.9	N273	S271-N273 PolarHBondContact O-N 3.1Å
272	S	49	Very low	61.5	Low	103 Å²	103	132.7 Å²	132.7	72%	0.72	69%	0.685	S	S	*	*	S	Bend	trans	43.2	77.3	136.4	60.1	0	0	0	0	119.9
273	N	42.3	Very low	62.7	Low	162 Å²	162	131.8 Å²	131.8	87%	0.866	68%	0.681	S	S	*	*			trans	-161.5	54.2	135.7	-114	-75.9	0	0	0	113.3	S271 K275	S271-N273 PolarHBondContact O-N 3.1Å; N273-K275 PolarHBondContact O-N 2.89Å
274	K	48.5	Very low	64.2	Low	187 Å²	187	129.9 Å²	129.9	81%	0.813	67%	0.669	S	S	*	*			trans	-58.8	104.4	167.6	-107	169.2	-176.6	151.5	0	108.8	E276	K274-E276 PolarHBondContact O-N 2.79Å
275	K	51.4	Low	66.1	Low	198 Å²	198	123.4 Å²	123.4	86%	0.861	64%	0.639	S	S	*	*			trans	-61.5	103.1	169.6	-136.3	178.2	-169.3	174.8	0	107.1	N273 R277	N273-K275 PolarHBondContact O-N 2.89Å; K275-R277 PolarHBondContact O-N 2.97Å; K275-R277 VanDerWaalsContact O-N 3.11Å
276	E	57.3	Low	68	Low	181 Å²	181	120 Å²	120	85%	0.846	62%	0.617	S	S	*	*			trans	-51.8	123.1	-177.8	-69.4	-171.2	125.8	0	0	109.4	K274 K278	K274-E276 PolarHBondContact O-N 2.79Å; E276-K278 PolarHBondContact O-N 2.82Å
277	R	62.6	Low	70.2	Confident	233 Å²	233	117.9 Å²	117.9	88%	0.879	61%	0.611	S	S	*	*			trans	-67.6	94.2	167.7	-80.8	-175.2	172.8	-180	-1.2	106.1	K275 L279	K275-R277 PolarHBondContact O-N 2.97Å; K275-R277 VanDerWaalsContact O-N 3.11Å; R277-L279 PolarHBondContact O-N 3.35Å
278	K	82	Confident	72.5	Confident	146 Å²	146	118.7 Å²	118.7	64%	0.635	60%	0.599	S	S	*	*			trans	-44.3	108.1	177.8	177.8	178.3	168.7	-166.6	0	109.2	E276 Y280	E276-K278 PolarHBondContact O-N 2.82Å; K278-Y280 HydrophobicContact CB-CE2 4.49Å; K278-Y280 HydrophobicContact CD-CE1 4.07Å; K278-Y280 HydrophobicContact CD-CE2 4.46Å; K278-Y280 VanDerWaalsContact CE-CE1 3.5Å; K278-Y280 HydrophobicContact CG-CE1 4.41Å; K278-Y280 HydrophobicContact CG-CE2 4.32Å; K278-Y280 VanDerWaalsContact O-CD2 3.27Å; K278-Y280 WeakPolarHBondContact O-CD2 3.42Å; K278-Y280 WeakPolarHBondContact O-CE2 3.18Å
279	L	85.9	Confident	75	Confident	131 Å²	131	114.7 Å²	114.7	69%	0.686	58%	0.575	S	S	*	*			trans	-70.6	131.5	179.2	-65.2	170.8	0	0	0	108.1	R277	R277-L279 PolarHBondContact O-N 3.35Å
280	Y	92.6	Very high	77.3	Confident	72 Å²	72	107 Å²	107	28%	0.282	54%	0.535	S	S	.	.	B	Isolated β-bridge	trans	-108.4	127.5	171.1	-63.3	-83.6	0	0	0	107.1	K278 D282 G283 Y284 D285 D287	K278-Y280 HydrophobicContact CB-CE2 4.49Å; K278-Y280 HydrophobicContact CD-CE1 4.07Å; K278-Y280 HydrophobicContact CD-CE2 4.46Å; K278-Y280 VanDerWaalsContact CE-CE1 3.5Å; K278-Y280 HydrophobicContact CG-CE1 4.41Å; K278-Y280 HydrophobicContact CG-CE2 4.32Å; K278-Y280 VanDerWaalsContact O-CD2 3.27Å; K278-Y280 WeakPolarHBondContact O-CD2 3.42Å; K278-Y280 WeakPolarHBondContact O-CE2 3.18Å; Y280-D282 PolarHBondContact O-N 2.77Å; Y280-G283 PolarHBondContact O-N 2.58Å; Y280-Y284 PolarHBondContact O-N 2.71Å; Y280-D285 PolarHBondContact O-N 3.2Å; Y280-D287 HydrophobicContact CD2-CB 4.41Å; Y280-D287 HydrophobicContact CE2-CB 3.74Å
281	N	95.1	Very high	79.7	Confident	27 Å²	27	100 Å²	100	14%	0.144	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	48.6	57.1	179.6	-165.7	38	0	0	0	111.7	G283 Y284 D285 N336 R375 N376	N281-G283 PolarHBondContact O-N 2.74Å; N281-Y284 WeakPolarHBondContact O-CB 3.42Å; N281-Y284 WeakPolarHBondContact O-CD2 3.48Å; N281-Y284 PolarHBondContact O-N 3.38Å; N281-D285 HydrophobicContact CB-CB 3.92Å; N281-D285 VanDerWaalsContact CB-OD1 3.22Å; N281-D285 WeakPolarHBondContact CB-OD1 3.24Å; N281-D285 VanDerWaalsContact CB-OD2 3.31Å; N281-D285 WeakPolarHBondContact CB-OD2 3.25Å; N281-D285 PolarHBondContact ND2-OD1 3.02Å; N281-N336 PolarHBondContact ND2-ND2 2.66Å; N281-R375 PolarHBondContact ND2-O 2.89Å; N281-N376 PolarHBondContact OD1-ND2 3.49Å
282	D	95.4	Very high	82.2	Confident	137 Å²	137	99 Å²	99	73%	0.733	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	55.9	19.2	-179	-48.2	-37.3	0	0	0	115.8	Y280 Y284	Y280-D282 PolarHBondContact O-N 2.77Å; D282-Y284 HydrophobicContact CB-CD2 4.31Å; D282-Y284 HydrophobicContact CB-CE2 4.21Å
283	G	95.3	Very high	84.5	Confident	31 Å²	31	95.8 Å²	95.8	32%	0.32	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	93.2	10.1	-177.3	0	0	0	0	0	114.6	Y280 N281	Y280-G283 PolarHBondContact O-N 2.58Å; N281-G283 PolarHBondContact O-N 2.74Å
284	Y	97	Very high	87.1	Confident	73 Å²	73	92.5 Å²	92.5	29%	0.286	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-19.4	173.5	-60.3	-59.6	0	0	0	113.9	Y280 N281 D282 Y291 I292 R375	Y280-Y284 PolarHBondContact O-N 2.71Å; N281-Y284 WeakPolarHBondContact O-CB 3.42Å; N281-Y284 WeakPolarHBondContact O-CD2 3.48Å; N281-Y284 PolarHBondContact O-N 3.38Å; D282-Y284 HydrophobicContact CB-CD2 4.31Å; D282-Y284 HydrophobicContact CB-CE2 4.21Å; Y284-Y291 HydrophobicContact CG-CE2 4.5Å; Y284-I292 WeakPolarHBondContact O-CB 3.45Å; Y284-I292 WeakPolarHBondContact O-CG1 3.48Å; Y284-I292 PolarHBondContact O-N 3.29Å; Y284-R375 HydrophobicContact CD2-CB 4.26Å; Y284-R375 HydrophobicContact CD2-CG 4.27Å; Y284-R375 VanDerWaalsContact CE1-NH1 3.3Å; Y284-R375 HydrophobicContact CE2-CG 4.32Å; Y284-R375 HydrophobicContact CG-CB 4.5Å
285	D	97.6	Very high	89.4	Confident	8 Å²	8	89.2 Å²	89.2	4%	0.043	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-110.8	149.7	-174.6	-66	16.3	0	0	0	112.6	Y280 N281 D290 N336 H377	Y280-D285 PolarHBondContact O-N 3.2Å; N281-D285 HydrophobicContact CB-CB 3.92Å; N281-D285 VanDerWaalsContact CB-OD1 3.22Å; N281-D285 WeakPolarHBondContact CB-OD1 3.24Å; N281-D285 VanDerWaalsContact CB-OD2 3.31Å; N281-D285 WeakPolarHBondContact CB-OD2 3.25Å; N281-D285 PolarHBondContact ND2-OD1 3.02Å; D285-D290 WeakPolarHBondContact CA-O 3.17Å; D285-N336 WeakPolarHBondContact OD2-CB 3.33Å; D285-N336 PolarHBondContact OD2-ND2 3.42Å; D285-H377 IonicContact OD1-CD2 3.95Å; D285-H377 IonicContact OD1-CE1 3.95Å; D285-H377 IonicContact OD1-NE2 2.64Å; D285-H377 PolarHBondContact OD1-NE2 3.23Å; D285-H377 IonicContact OD2-NE2 2.86Å
286	D	95.3	Very high	91.6	Very high	43 Å²	43	82 Å²	82	23%	0.23	41%	0.408	C	S	.	.			trans	-79.1	172.2	162.2	76.2	9.1	0	0	0	112.4	N288 H289 D290 I292 K311	D286-N288 PolarHBondContact O-N 3.01Å; D286-N288 VanDerWaalsContact O-N 3.1Å; D286-N288 VanDerWaalsContact OD1-C 3.24Å; D286-N288 VanDerWaalsContact OD1-CA 3.25Å; D286-N288 WeakPolarHBondContact OD1-CA 3.36Å; D286-N288 VanDerWaalsContact OD1-CB 3.24Å; D286-N288 WeakPolarHBondContact OD1-CB 3.24Å; D286-N288 PolarHBondContact OD1-N 3.06Å; D286-H289 PolarHBondContact O-N 2.97Å; D286-H289 VanDerWaalsContact O-N 3.1Å; D286-H289 PolarHBondContact OD1-N 3.46Å; D286-H289 VanDerWaalsContact OD1-N 3.09Å; D286-D290 PolarHBondContact N-O 3.15Å; D286-D290 PolarHBondContact OD1-N 3.47Å; D286-I292 HydrophobicContact CB-CG1 4.5Å; D286-K311 IonicContact OD2-NZ 2.71Å
287	D	95.2	Very high	93.5	Very high	127 Å²	127	74.9 Å²	74.9	68%	0.679	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-6.5	178.6	66.3	-29.3	0	0	0	113.8	Y280	Y280-D287 HydrophobicContact CD2-CB 4.41Å; Y280-D287 HydrophobicContact CE2-CB 3.74Å
288	N	94.8	Very high	95.2	Very high	87 Å²	87	67.8 Å²	67.8	47%	0.465	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	6.1	177.3	-167.4	48.8	0	0	0	112.3	D286 D290 K335	D286-N288 PolarHBondContact O-N 3.01Å; D286-N288 VanDerWaalsContact O-N 3.1Å; D286-N288 VanDerWaalsContact OD1-C 3.24Å; D286-N288 VanDerWaalsContact OD1-CA 3.25Å; D286-N288 WeakPolarHBondContact OD1-CA 3.36Å; D286-N288 VanDerWaalsContact OD1-CB 3.24Å; D286-N288 WeakPolarHBondContact OD1-CB 3.24Å; D286-N288 PolarHBondContact OD1-N 3.06Å; N288-D290 VanDerWaalsContact C-N 3.28Å; N288-D290 PolarHBondContact ND2-OD2 3.49Å; N288-D290 PolarHBondContact O-N 3.37Å; N288-K335 PolarHBondContact ND2-NZ 2.98Å; N288-K335 PolarHBondContact O-NZ 3.41Å
289	H	96.3	Very high	96	Very high	51 Å²	51	60.9 Å²	60.9	24%	0.236	32%	0.321	C	S	.	.	S	Bend	trans	64	21.7	-175.4	-45.9	-92.6	0	0	0	114.9	D286 K335 N336 K337	D286-H289 PolarHBondContact O-N 2.97Å; D286-H289 VanDerWaalsContact O-N 3.1Å; D286-H289 PolarHBondContact OD1-N 3.46Å; D286-H289 VanDerWaalsContact OD1-N 3.09Å; H289-K335 HydrophobicContact CB-CB 4.39Å; H289-K335 VanDerWaalsContact O-CA 3.26Å; H289-K335 WeakPolarHBondContact O-CA 3.4Å; H289-N336 PolarHBondContact ND1-O 2.99Å; H289-N336 PolarHBondContact O-N 3.11Å; H289-N336 VanDerWaalsContact O-N 3.08Å; H289-K337 PolarHBondContact NE2-NZ 2.83Å
290	D	97.4	Very high	96.5	Very high	1 Å²	1	59 Å²	59	1%	0.005	31%	0.311	C	S	.	.			trans	-86.9	142.4	167.9	-64.3	-54.1	0	0	0	110.7	D285 D286 N288 K311 Q316 K335	D285-D290 WeakPolarHBondContact CA-O 3.17Å; D286-D290 PolarHBondContact N-O 3.15Å; D286-D290 PolarHBondContact OD1-N 3.47Å; N288-D290 VanDerWaalsContact C-N 3.28Å; N288-D290 PolarHBondContact ND2-OD2 3.49Å; N288-D290 PolarHBondContact O-N 3.37Å; D290-K311 VanDerWaalsContact CG-CE 3.49Å; D290-K311 VanDerWaalsContact CG-NZ 3.3Å; D290-K311 WeakPolarHBondContact OD2-CE 3.28Å; D290-K311 IonicContact OD2-NZ 2.82Å; D290-K311 PolarHBondContact OD2-NZ 3.1Å; D290-Q316 HydrophobicContact CB-CG 4.44Å; D290-K335 WeakPolarHBondContact OD1-CE 3.41Å; D290-K335 WeakPolarHBondContact OD1-CG 3.35Å; D290-K335 IonicContact OD1-NZ 2.97Å; D290-K335 PolarHBondContact OD1-NZ 3.37Å; D290-K335 IonicContact OD2-NZ 3.88Å; D290-K335 PolarHBondContact OD2-NZ 2.93Å
291	Y	98	Very high	96.7	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.016	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-63.9	136	172.5	-172.4	-102.6	0	0	0	111.2	Y284 I293 E297 F299 Q316 I333 W374 R375 H377	Y284-Y291 HydrophobicContact CG-CE2 4.5Å; Y291-I293 HydrophobicContact CD1-CD1 3.99Å; Y291-I293 PolarHBondContact O-N 3.04Å; Y291-E297 WeakPolarHBondContact CE1-OE2 3.41Å; Y291-E297 PolarHBondContact OH-OE2 2.76Å; Y291-F299 HydrophobicContact CD1-CZ 4.14Å; Y291-F299 AromaticContact CE1-CE1 3.88Å; Y291-F299 HydrophobicContact CE1-CE1 3.88Å; Y291-F299 AromaticContact CE1-CZ 3.58Å; Y291-F299 HydrophobicContact CE1-CZ 3.58Å; Y291-F299 AromaticContact CZ-CZ 3.99Å; Y291-Q316 PolarHBondContact O-NE2 3.46Å; Y291-I333 HydrophobicContact CD1-CD1 4.43Å; Y291-W374 AromaticContact CZ-NE1 3.91Å; Y291-W374 PolarHBondContact OH-NE1 3.08Å; Y291-R375 HydrophobicContact CE2-CB 4.26Å; Y291-R375 PolarHBondContact OH-NH1 3.18Å; Y291-H377 AromaticContact CD2-CD2 3.54Å; Y291-H377 AromaticContact CD2-NE2 3.63Å; Y291-H377 PolarHBondContact N-CE1 2.87Å
292	I	97.3	Very high	96.8	Very high	76 Å²	76	62.5 Å²	62.5	39%	0.39	33%	0.332	S	S	.	.			trans	-77.1	93.5	175.6	-60.9	173.5	0	0	0	108.6	Y284 D286 K294	Y284-I292 WeakPolarHBondContact O-CB 3.45Å; Y284-I292 WeakPolarHBondContact O-CG1 3.48Å; Y284-I292 PolarHBondContact O-N 3.29Å; D286-I292 HydrophobicContact CB-CG1 4.5Å; I292-K294 PolarHBondContact O-N 2.97Å
293	I	97.1	Very high	97	Very high	36 Å²	36	56.1 Å²	56.1	19%	0.185	30%	0.298	C	S	.	.			trans	-56.2	134.7	178.8	-49	-53	0	0	0	110.7	Y291 I305 L308 Q316 V318 I333	Y291-I293 HydrophobicContact CD1-CD1 3.99Å; Y291-I293 PolarHBondContact O-N 3.04Å; I293-I305 HydrophobicContact CG2-CG2 3.95Å; I293-L308 HydrophobicContact CG1-CD1 4.28Å; I293-Q316 HydrophobicContact CD1-CB 4.49Å; I293-Q316 VanDerWaalsContact CD1-NE2 3.34Å; I293-V318 HydrophobicContact CD1-CG1 3.7Å; I293-V318 HydrophobicContact CG1-CG1 4.13Å; I293-V318 HydrophobicContact CG2-CG1 3.96Å; I293-I333 HydrophobicContact CD1-CD1 3.87Å
294	K	96.7	Very high	97.1	Very high	94 Å²	94	57.9 Å²	57.9	41%	0.409	30%	0.298	S	S	.	.			trans	-128.2	120	171.9	-63.2	169.3	-165.4	165.3	0	108.9	I292 E297	I292-K294 PolarHBondContact O-N 2.97Å; K294-E297 HydrophobicContact CB-CB 3.98Å; K294-E297 IonicContact NZ-OE1 3.7Å; K294-E297 WeakPolarHBondContact O-CB 3.37Å; K294-E297 PolarHBondContact O-N 2.81Å
295	N	97.1	Very high	97.2	Very high	117 Å²	117	54.5 Å²	54.5	63%	0.626	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	139.2	174.1	-51.4	66.9	0	0	0	109.6	E297 I305 D306	N295-E297 VanDerWaalsContact C-N 3.25Å; N295-E297 PolarHBondContact O-N 3.08Å; N295-I305 CarbonylContact C-O 3.56Å; N295-I305 WeakPolarHBondContact CA-O 3.47Å; N295-D306 PolarHBondContact ND2-O 3.31Å
296	G	97.3	Very high	97.2	Very high	47 Å²	47	57 Å²	57	49%	0.485	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	-4	-175.4	0	0	0	0	0	115.5	I305	G296-I305 PolarHBondContact N-O 2.69Å
297	E	98	Very high	97.3	Very high	31 Å²	31	56.7 Å²	56.7	15%	0.145	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-68.2	138.7	172.9	-173	167.5	-122.3	0	0	110.3	Y291 K294 N295 F299 I305 R375	Y291-E297 WeakPolarHBondContact CE1-OE2 3.41Å; Y291-E297 PolarHBondContact OH-OE2 2.76Å; K294-E297 HydrophobicContact CB-CB 3.98Å; K294-E297 IonicContact NZ-OE1 3.7Å; K294-E297 WeakPolarHBondContact O-CB 3.37Å; K294-E297 PolarHBondContact O-N 2.81Å; N295-E297 VanDerWaalsContact C-N 3.25Å; N295-E297 PolarHBondContact O-N 3.08Å; E297-F299 HydrophobicContact CG-CD1 4.35Å; E297-F299 HydrophobicContact CG-CE1 4.24Å; E297-I305 WeakPolarHBondContact O-CG1 3.32Å; E297-I305 PolarHBondContact O-N 2.9Å; E297-R375 IonicContact OE1-CZ 3.39Å; E297-R375 IonicContact OE1-NH1 2.72Å; E297-R375 PolarHBondContact OE1-NH1 3.47Å; E297-R375 IonicContact OE1-NH2 3.72Å; E297-R375 IonicContact OE2-NH1 2.74Å
298	K	97.6	Very high	97.4	Very high	84 Å²	84	54.6 Å²	54.6	37%	0.365	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124.6	175.6	-59.3	-162.8	-179.2	-147.2	0	110.9	Y303 E304 H323	K298-Y303 CarbonylContact C-O 3.56Å; K298-Y303 VanDerWaalsContact CA-O 3.32Å; K298-Y303 WeakPolarHBondContact CA-O 2.92Å; K298-E304 WeakPolarHBondContact CE-OE2 3.41Å; K298-E304 HydrophobicContact CG-CB 4.3Å; K298-E304 HydrophobicContact CG-CG 4.25Å; K298-E304 IonicContact NZ-OE2 3.66Å; K298-E304 PolarHBondContact NZ-OE2 3Å; K298-H323 PolarHBondContact NZ-NE2 2.94Å
299	F	97.9	Very high	97.4	Very high	1 Å²	1	54.5 Å²	54.5	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.4	170.7	-65.4	8.9	0	0	0	108.7	Y291 E297 D301 R302 Y303 I305 I333 F372 W374	Y291-F299 HydrophobicContact CD1-CZ 4.14Å; Y291-F299 AromaticContact CE1-CE1 3.88Å; Y291-F299 HydrophobicContact CE1-CE1 3.88Å; Y291-F299 AromaticContact CE1-CZ 3.58Å; Y291-F299 HydrophobicContact CE1-CZ 3.58Å; Y291-F299 AromaticContact CZ-CZ 3.99Å; E297-F299 HydrophobicContact CG-CD1 4.35Å; E297-F299 HydrophobicContact CG-CE1 4.24Å; F299-D301 PolarHBondContact O-N 2.94Å; F299-D301 VanDerWaalsContact O-N 3.17Å; F299-R302 PolarHBondContact O-N 2.87Å; F299-Y303 HydrophobicContact CB-CD2 4.34Å; F299-Y303 PolarHBondContact N-O 3.17Å; F299-Y303 PolarHBondContact O-N 2.87Å; F299-I305 HydrophobicContact CD1-CD1 4.28Å; F299-I305 HydrophobicContact CD1-CG1 4.03Å; F299-I305 HydrophobicContact CD2-CD1 4.28Å; F299-I305 HydrophobicContact CE1-CD1 4.19Å; F299-I305 HydrophobicContact CE1-CG1 3.74Å; F299-I305 HydrophobicContact CE2-CD1 4.22Å; F299-I305 HydrophobicContact CG-CD1 4.32Å; F299-I305 HydrophobicContact CZ-CD1 4.17Å; F299-I305 HydrophobicContact CZ-CG1 4.05Å; F299-I333 HydrophobicContact CE2-CD1 3.83Å; F299-I333 HydrophobicContact CE2-CG1 4.44Å; F299-I333 HydrophobicContact CZ-CD1 4Å; F299-F372 HydrophobicContact CB-CE2 4.29Å; F299-F372 HydrophobicContact CB-CZ 4.35Å; F299-F372 HydrophobicContact CD2-CE2 4.11Å; F299-F372 HydrophobicContact CD2-CZ 4.17Å; F299-W374 HydrophobicContact CB-CD2 4.12Å; F299-W374 HydrophobicContact CB-CE3 4.43Å; F299-W374 HydrophobicContact CB-CG 4.48Å; F299-W374 HydrophobicContact CB-CZ2 4.37Å; F299-W374 AromaticContact CD1-CD1 3.92Å; F299-W374 HydrophobicContact CD1-CD2 4.35Å; F299-W374 AromaticContact CD1-CE2 3.6Å; F299-W374 AromaticContact CD1-CZ2 3.92Å; F299-W374 HydrophobicContact CD1-CZ2 3.92Å; F299-W374 AromaticContact CD1-NE1 3.3Å; F299-W374 VanDerWaalsContact CD1-NE1 3.3Å; F299-W374 HydrophobicContact CD2-CB 4.46Å; F299-W374 AromaticContact CD2-CD1 3.66Å; F299-W374 HydrophobicContact CD2-CD2 4.39Å; F299-W374 AromaticContact CD2-CG 3.95Å; F299-W374 HydrophobicContact CD2-CG 3.95Å; F299-W374 AromaticContact CD2-NE1 3.92Å; F299-W374 AromaticContact CE1-CD1 3.89Å; F299-W374 AromaticContact CE1-NE1 3.35Å; F299-W374 AromaticContact CE2-CD1 3.61Å; F299-W374 HydrophobicContact CE2-CG 4.29Å; F299-W374 AromaticContact CE2-NE1 3.96Å; F299-W374 AromaticContact CG-CD1 3.82Å; F299-W374 HydrophobicContact CG-CD2 4.04Å; F299-W374 AromaticContact CG-CE2 3.75Å; F299-W374 HydrophobicContact CG-CG 4.07Å; F299-W374 HydrophobicContact CG-CZ2 4.29Å; F299-W374 AromaticContact CG-NE1 3.61Å; F299-W374 AromaticContact CZ-CD1 3.73Å; F299-W374 AromaticContact CZ-NE1 3.69Å
300	L	96.8	Very high	97.3	Very high	91 Å²	91	53.5 Å²	53.5	48%	0.476	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	31.5	-178.2	-55.1	172.2	0	0	0	113.3	R302 F372 W374	L300-R302 WeakPolarHBondContact O-CB 3.26Å; L300-R302 PolarHBondContact O-N 2.88Å; L300-F372 HydrophobicContact CD1-CB 4.19Å; L300-F372 HydrophobicContact CD1-CD1 4.31Å; L300-F372 HydrophobicContact CD1-CD2 3.58Å; L300-F372 HydrophobicContact CD1-CE2 3.93Å; L300-F372 HydrophobicContact CD1-CG 3.79Å; L300-F372 HydrophobicContact CD1-CZ 4.42Å; L300-F372 HydrophobicContact CG-CD2 4.34Å; L300-F372 HydrophobicContact CG-CE2 4.38Å; L300-W374 HydrophobicContact CD2-CE3 3.89Å; L300-W374 HydrophobicContact CD2-CZ3 3.94Å; L300-W374 HydrophobicContact CG-CE3 4.09Å; L300-W374 HydrophobicContact CG-CZ3 4.24Å; L300-W374 VanDerWaalsContact N-CZ3 3.34Å
301	D	97.3	Very high	97	Very high	142 Å²	142	58.5 Å²	58.5	76%	0.759	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	8.8	-171.7	-60.6	-51.1	0	0	0	116	F299	F299-D301 PolarHBondContact O-N 2.94Å; F299-D301 VanDerWaalsContact O-N 3.17Å
302	R	98.1	Very high	96.5	Very high	31 Å²	31	60.3 Å²	60.3	12%	0.117	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-44.9	-170.5	177.5	-171.5	176.6	135.2	14.8	113.3	F299 L300 D322 H323 E324 R370	F299-R302 PolarHBondContact O-N 2.87Å; L300-R302 WeakPolarHBondContact O-CB 3.26Å; L300-R302 PolarHBondContact O-N 2.88Å; R302-D322 IonicContact CZ-OD1 2.84Å; R302-D322 IonicContact CZ-OD2 2.71Å; R302-D322 VanDerWaalsContact NE-CG 3.35Å; R302-D322 IonicContact NE-OD1 3.85Å; R302-D322 PolarHBondContact NE-OD1 2.82Å; R302-D322 IonicContact NE-OD2 3.51Å; R302-D322 PolarHBondContact NE-OD2 3.43Å; R302-D322 IonicContact NH2-OD1 2.69Å; R302-D322 PolarHBondContact NH2-OD1 2.87Å; R302-D322 IonicContact NH2-OD2 2.82Å; R302-D322 PolarHBondContact NH2-OD2 2.88Å; R302-H323 WeakPolarHBondContact O-CB 3.47Å; R302-H323 PolarHBondContact O-CD2 2.7Å; R302-H323 PolarHBondContact O-N 2.84Å; R302-E324 VanDerWaalsContact CD-OE1 3.23Å; R302-E324 WeakPolarHBondContact CD-OE1 3.46Å; R302-E324 HydrophobicContact CG-CG 4.31Å; R302-E324 IonicContact CZ-OE1 3.43Å; R302-E324 VanDerWaalsContact CZ-OE1 3.24Å; R302-E324 IonicContact CZ-OE2 2.7Å; R302-E324 IonicContact NE-OE1 2.7Å; R302-E324 IonicContact NH1-OE1 3.45Å; R302-E324 PolarHBondContact NH1-OE1 2.91Å; R302-E324 IonicContact NH1-OE2 3.63Å; R302-E324 PolarHBondContact NH1-OE2 3.03Å; R302-E324 IonicContact NH2-OE2 2.75Å; R302-E324 PolarHBondContact NH2-OE2 3.04Å; R302-R370 VanDerWaalsContact NH2-CZ 3.26Å
303	Y	98.7	Very high	96	Very high	3 Å²	3	59.4 Å²	59.4	1%	0.012	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	107	-175.6	-52.7	-80.6	0	0	0	110.6	K298 F299 Y321 D322 V329 I331 R370 F372 V381	K298-Y303 CarbonylContact C-O 3.56Å; K298-Y303 VanDerWaalsContact CA-O 3.32Å; K298-Y303 WeakPolarHBondContact CA-O 2.92Å; F299-Y303 HydrophobicContact CB-CD2 4.34Å; F299-Y303 PolarHBondContact N-O 3.17Å; F299-Y303 PolarHBondContact O-N 2.87Å; Y303-Y321 WeakPolarHBondContact CA-O 3.41Å; Y303-D322 HydrophobicContact CD1-CB 4.02Å; Y303-D322 HydrophobicContact CE1-CB 3.99Å; Y303-D322 WeakPolarHBondContact CE1-OD2 3.47Å; Y303-V329 HydrophobicContact CD1-CG2 4.1Å; Y303-V329 HydrophobicContact CE1-CG2 4.44Å; Y303-I331 HydrophobicContact CD1-CD1 3.81Å; Y303-I331 HydrophobicContact CD2-CD1 4.44Å; Y303-I331 HydrophobicContact CG-CD1 3.74Å; Y303-R370 VanDerWaalsContact OH-CD 3.24Å; Y303-R370 WeakPolarHBondContact OH-CD 3.4Å; Y303-R370 PolarHBondContact OH-NH1 3.24Å; Y303-F372 AromaticContact CD2-CE1 3.79Å; Y303-F372 HydrophobicContact CD2-CE1 3.79Å; Y303-F372 AromaticContact CD2-CZ 3.67Å; Y303-F372 HydrophobicContact CD2-CZ 3.67Å; Y303-F372 HydrophobicContact CE2-CD1 4.07Å; Y303-F372 AromaticContact CE2-CE1 3.27Å; Y303-F372 HydrophobicContact CE2-CE1 3.27Å; Y303-F372 AromaticContact CE2-CZ 3.65Å; Y303-F372 HydrophobicContact CE2-CZ 3.65Å; Y303-F372 AromaticContact CZ-CE1 3.86Å; Y303-V381 HydrophobicContact CE1-CG1 4.03Å; Y303-V381 HydrophobicContact CE1-CG2 4.08Å
304	E	98.6	Very high	95.6	Very high	68 Å²	68	59.4 Å²	59.4	32%	0.318	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	118.3	175.7	-167.6	170	148.3	0	0	109.7	K298 D306 A320 Y321 H323	K298-E304 WeakPolarHBondContact CE-OE2 3.41Å; K298-E304 HydrophobicContact CG-CB 4.3Å; K298-E304 HydrophobicContact CG-CG 4.25Å; K298-E304 IonicContact NZ-OE2 3.66Å; K298-E304 PolarHBondContact NZ-OE2 3Å; E304-D306 PolarHBondContact O-N 2.75Å; E304-A320 CarbonylContact O-C 3.54Å; E304-A320 WeakPolarHBondContact O-CA 3.43Å; E304-A320 WeakPolarHBondContact O-CB 3.23Å; E304-Y321 PolarHBondContact N-O 3.1Å; E304-Y321 PolarHBondContact O-N 2.9Å; E304-H323 IonicContact OE2-CD2 2.7Å; E304-H323 IonicContact OE2-CE1 3.52Å; E304-H323 IonicContact OE2-NE2 3.6Å; E304-H323 PolarHBondContact OE2-NE2 2.81Å
305	I	98.4	Very high	95.4	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.015	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.9	-174.1	-56.7	-46.7	0	0	0	110.3	I293 N295 G296 E297 F299 V318 A320 I331	I293-I305 HydrophobicContact CG2-CG2 3.95Å; N295-I305 CarbonylContact C-O 3.56Å; N295-I305 WeakPolarHBondContact CA-O 3.47Å; G296-I305 PolarHBondContact N-O 2.69Å; E297-I305 WeakPolarHBondContact O-CG1 3.32Å; E297-I305 PolarHBondContact O-N 2.9Å; F299-I305 HydrophobicContact CD1-CD1 4.28Å; F299-I305 HydrophobicContact CD1-CG1 4.03Å; F299-I305 HydrophobicContact CD2-CD1 4.28Å; F299-I305 HydrophobicContact CE1-CD1 4.19Å; F299-I305 HydrophobicContact CE1-CG1 3.74Å; F299-I305 HydrophobicContact CE2-CD1 4.22Å; F299-I305 HydrophobicContact CG-CD1 4.32Å; F299-I305 HydrophobicContact CZ-CD1 4.17Å; F299-I305 HydrophobicContact CZ-CG1 4.05Å; I305-V318 HydrophobicContact CD1-CG2 4Å; I305-V318 HydrophobicContact CG2-CB 4.15Å; I305-V318 HydrophobicContact CG2-CG1 4.27Å; I305-V318 HydrophobicContact CG2-CG2 4.27Å; I305-A320 HydrophobicContact CD1-CB 3.96Å; I305-I331 HydrophobicContact CD1-CD1 4.36Å
306	D	98	Very high	95.4	Very high	60 Å²	60	50.2 Å²	50.2	32%	0.321	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-62.9	-177.8	172.3	-45.4	0	0	0	110.5	N295 E304 K319 H328	N295-D306 PolarHBondContact ND2-O 3.31Å; E304-D306 PolarHBondContact O-N 2.75Å; D306-K319 HydrophobicContact CB-CB 4.19Å; D306-K319 HydrophobicContact CB-CD 4.36Å; D306-K319 HydrophobicContact CB-CG 4.05Å; D306-K319 WeakPolarHBondContact CB-O 3.18Å; D306-K319 PolarHBondContact N-O 3.32Å; D306-K319 WeakPolarHBondContact OD2-CD 3.48Å; D306-K319 WeakPolarHBondContact OD2-CE 2.99Å; D306-K319 IonicContact OD2-NZ 2.59Å; D306-K319 PolarHBondContact OD2-NZ 2.76Å; D306-H328 IonicContact OD2-CE1 2.7Å
307	S	97.5	Very high	95.4	Very high	36 Å²	36	50.1 Å²	50.1	25%	0.252	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	156.1	-171.3	49.9	0	0	0	0	113.3	I309 V318 K319	S307-I309 PolarHBondContact O-N 3.47Å; S307-V318 CarbonylContact O-C 3.53Å; S307-V318 VanDerWaalsContact O-CA 3.23Å; S307-V318 WeakPolarHBondContact O-CA 3.32Å; S307-V318 WeakPolarHBondContact O-CB 3.45Å; S307-K319 PolarHBondContact N-O 3.18Å; S307-K319 PolarHBondContact O-N 3.03Å
308	L	97	Very high	95.4	Very high	84 Å²	84	48.6 Å²	48.6	44%	0.44	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	117.4	173.3	-178.9	71.7	0	0	0	110.2	I293 G310 Q316 V318	I293-L308 HydrophobicContact CG1-CD1 4.28Å; L308-G310 VanDerWaalsContact CD1-O 3.31Å; L308-G310 WeakPolarHBondContact CD1-O 3.41Å; L308-Q316 HydrophobicContact CD1-CB 3.8Å; L308-Q316 HydrophobicContact CD1-CG 4.13Å; L308-V318 HydrophobicContact CD1-CG1 4.14Å
309	I	95.2	Very high	95.5	Very high	85 Å²	85	46.9 Å²	46.9	44%	0.436	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-12	-178.7	62	174.5	0	0	0	113.8	S307 V317 K319 A330 L384	S307-I309 PolarHBondContact O-N 3.47Å; I309-V317 HydrophobicContact CD1-CG1 4.06Å; I309-V317 HydrophobicContact CG1-CB 4.26Å; I309-V317 HydrophobicContact CG1-CG1 3.92Å; I309-V317 WeakPolarHBondContact CG1-O 3.31Å; I309-V317 PolarHBondContact N-O 2.91Å; I309-K319 HydrophobicContact CD1-CB 4.34Å; I309-K319 HydrophobicContact CG2-CB 3.82Å; I309-A330 HydrophobicContact CD1-CB 4.19Å; I309-L384 HydrophobicContact CD1-CD1 3.92Å
310	G	92.8	Very high	95.5	Very high	29 Å²	29	46.8 Å²	46.8	30%	0.299	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	152.1	173.2	0	0	0	0	0	113.6	L308 Q316 V317	L308-G310 VanDerWaalsContact CD1-O 3.31Å; L308-G310 WeakPolarHBondContact CD1-O 3.41Å; G310-Q316 CarbonylContact O-C 3.57Å; G310-Q316 WeakPolarHBondContact O-CA 3.4Å; G310-V317 PolarHBondContact N-O 3.4Å; G310-V317 PolarHBondContact O-N 3.01Å
311	K	92.2	Very high	95.6	Very high	106 Å²	106	45.4 Å²	45.4	46%	0.461	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	138.6	171.9	-175.4	160.7	-169.8	156.2	0	109.7	D286 D290 Q316	D286-K311 IonicContact OD2-NZ 2.71Å; D290-K311 VanDerWaalsContact CG-CE 3.49Å; D290-K311 VanDerWaalsContact CG-NZ 3.3Å; D290-K311 WeakPolarHBondContact OD2-CE 3.28Å; D290-K311 IonicContact OD2-NZ 2.82Å; D290-K311 PolarHBondContact OD2-NZ 3.1Å; K311-Q316 HydrophobicContact CB-CG 4.28Å; K311-Q316 HydrophobicContact CD-CG 3.84Å; K311-Q316 HydrophobicContact CG-CG 3.84Å
312	G	87.7	Confident	95.7	Very high	43 Å²	43	38.6 Å²	38.6	44%	0.443	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	-166.8	-175.1	0	0	0	0	0	113.3	F314 G315	G312-F314 VanDerWaalsContact C-N 3.33Å; G312-F314 PolarHBondContact O-N 2.97Å; G312-G315 PolarHBondContact N-O 3.43Å; G312-G315 PolarHBondContact O-N 3.24Å
313	S	86.5	Confident	95.7	Very high	57 Å²	57	40.2 Å²	40.2	40%	0.399	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-39.3	179.5	45.3	0	0	0	0	113.2	K335 F340	S313-K335 WeakPolarHBondContact O-CD 3.43Å; S313-K335 WeakPolarHBondContact O-CE 3.39Å; S313-F340 WeakPolarHBondContact O-CE1 3.09Å
314	F	87.4	Confident	95.6	Very high	35 Å²	35	46.6 Å²	46.6	15%	0.154	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-19	-176.4	-56.4	-72.6	0	0	0	114.4	G312 I334 K335 F340 Q343	G312-F314 VanDerWaalsContact C-N 3.33Å; G312-F314 PolarHBondContact O-N 2.97Å; F314-I334 HydrophobicContact CB-CD1 4.47Å; F314-K335 PolarHBondContact O-N 2.8Å; F314-F340 HydrophobicContact CD1-CD1 4.42Å; F314-Q343 HydrophobicContact CE1-CG 4.43Å
315	G	93.4	Very high	95.6	Very high	7 Å²	7	47 Å²	47	7%	0.072	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	141.5	-140.6	-171.7	0	0	0	0	0	112.9	G312 I333	G312-G315 PolarHBondContact N-O 3.43Å; G312-G315 PolarHBondContact O-N 3.24Å; G315-I333 WeakPolarHBondContact CA-O 3.3Å
316	Q	96.7	Very high	95.5	Very high	12 Å²	12	52.7 Å²	52.7	6%	0.056	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	153.5	-170.4	-67.1	176	139.6	0	0	111.4	D290 Y291 I293 L308 G310 K311 K332 I333	D290-Q316 HydrophobicContact CB-CG 4.44Å; Y291-Q316 PolarHBondContact O-NE2 3.46Å; I293-Q316 HydrophobicContact CD1-CB 4.49Å; I293-Q316 VanDerWaalsContact CD1-NE2 3.34Å; L308-Q316 HydrophobicContact CD1-CB 3.8Å; L308-Q316 HydrophobicContact CD1-CG 4.13Å; G310-Q316 CarbonylContact O-C 3.57Å; G310-Q316 WeakPolarHBondContact O-CA 3.4Å; K311-Q316 HydrophobicContact CB-CG 4.28Å; K311-Q316 HydrophobicContact CD-CG 3.84Å; K311-Q316 HydrophobicContact CG-CG 3.84Å; Q316-K332 CarbonylContact O-C 3.55Å; Q316-K332 WeakPolarHBondContact O-CA 3.46Å; Q316-I333 PolarHBondContact N-O 2.96Å; Q316-I333 PolarHBondContact O-N 2.96Å
317	V	97.8	Very high	95.5	Very high	44 Å²	44	51.7 Å²	51.7	27%	0.267	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.3	173	-171.2	0	0	0	0	108.5	I309 G310 A330 I331 K332	I309-V317 HydrophobicContact CD1-CG1 4.06Å; I309-V317 HydrophobicContact CG1-CB 4.26Å; I309-V317 HydrophobicContact CG1-CG1 3.92Å; I309-V317 WeakPolarHBondContact CG1-O 3.31Å; I309-V317 PolarHBondContact N-O 2.91Å; G310-V317 PolarHBondContact N-O 3.4Å; G310-V317 PolarHBondContact O-N 3.01Å; V317-A330 HydrophobicContact CG1-CB 4.18Å; V317-I331 WeakPolarHBondContact CA-O 3.17Å; V317-K332 HydrophobicContact CG2-CB 4.3Å; V317-K332 HydrophobicContact CG2-CG 4.16Å
318	V	98.4	Very high	95.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.1	177.7	-64	0	0	0	0	110.9	I293 I305 S307 L308 A330 I331 I333	I293-V318 HydrophobicContact CD1-CG1 3.7Å; I293-V318 HydrophobicContact CG1-CG1 4.13Å; I293-V318 HydrophobicContact CG2-CG1 3.96Å; I305-V318 HydrophobicContact CD1-CG2 4Å; I305-V318 HydrophobicContact CG2-CB 4.15Å; I305-V318 HydrophobicContact CG2-CG1 4.27Å; I305-V318 HydrophobicContact CG2-CG2 4.27Å; S307-V318 CarbonylContact O-C 3.53Å; S307-V318 VanDerWaalsContact O-CA 3.23Å; S307-V318 WeakPolarHBondContact O-CA 3.32Å; S307-V318 WeakPolarHBondContact O-CB 3.45Å; L308-V318 HydrophobicContact CD1-CG1 4.14Å; V318-A330 CarbonylContact O-C 3.49Å; V318-A330 WeakPolarHBondContact O-CA 3.44Å; V318-I331 HydrophobicContact CG2-CB 3.91Å; V318-I331 PolarHBondContact N-O 2.97Å; V318-I331 PolarHBondContact O-N 3.35Å; V318-I333 HydrophobicContact CG1-CD1 4.38Å; V318-I333 HydrophobicContact CG2-CD1 4.02Å
319	K	98.6	Very high	95.6	Very high	47 Å²	47	49.7 Å²	49.7	20%	0.204	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.1	158.9	-177.3	178.1	178.7	-126.2	0	107.4	D306 S307 I309 H328 L384	D306-K319 HydrophobicContact CB-CB 4.19Å; D306-K319 HydrophobicContact CB-CD 4.36Å; D306-K319 HydrophobicContact CB-CG 4.05Å; D306-K319 WeakPolarHBondContact CB-O 3.18Å; D306-K319 PolarHBondContact N-O 3.32Å; D306-K319 WeakPolarHBondContact OD2-CD 3.48Å; D306-K319 WeakPolarHBondContact OD2-CE 2.99Å; D306-K319 IonicContact OD2-NZ 2.59Å; D306-K319 PolarHBondContact OD2-NZ 2.76Å; S307-K319 PolarHBondContact N-O 3.18Å; S307-K319 PolarHBondContact O-N 3.03Å; I309-K319 HydrophobicContact CD1-CB 4.34Å; I309-K319 HydrophobicContact CG2-CB 3.82Å; K319-H328 VanDerWaalsContact CE-CE1 3.49Å; K319-H328 WeakPolarHBondContact CE-CE1 3.41Å; K319-H328 WeakPolarHBondContact CE-NE2 3.49Å; K319-H328 PolarHBondContact NZ-CE1 3.38Å; K319-H328 PolarHBondContact NZ-NE2 3.41Å; K319-L384 HydrophobicContact CD-CD2 4.23Å; K319-L384 HydrophobicContact CG-CD2 4.19Å
320	A	98.7	Very high	95.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	168.8	172.3	0	0	0	0	0	110.6	E304 I305 H328 V329 I331	E304-A320 CarbonylContact O-C 3.54Å; E304-A320 WeakPolarHBondContact O-CA 3.43Å; E304-A320 WeakPolarHBondContact O-CB 3.23Å; I305-A320 HydrophobicContact CD1-CB 3.96Å; A320-H328 WeakPolarHBondContact O-CA 3.32Å; A320-H328 PolarHBondContact O-ND1 3.21Å; A320-V329 HydrophobicContact CB-CG2 4.04Å; A320-V329 PolarHBondContact N-O 2.92Å; A320-V329 PolarHBondContact O-N 3Å; A320-I331 HydrophobicContact CB-CD1 3.72Å; A320-I331 HydrophobicContact CB-CG1 4.17Å
321	Y	98.7	Very high	96.1	Very high	61 Å²	61	44.8 Å²	44.8	24%	0.239	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.8	166.7	-169.5	-100.6	0	0	0	109.3	Y303 E304 H323 Q326 H328	Y303-Y321 WeakPolarHBondContact CA-O 3.41Å; E304-Y321 PolarHBondContact N-O 3.1Å; E304-Y321 PolarHBondContact O-N 2.9Å; Y321-H323 AromaticContact CD1-CE1 3.74Å; Y321-H323 AromaticContact CD1-CG 3.97Å; Y321-H323 AromaticContact CD1-ND1 3.82Å; Y321-H323 AromaticContact CD1-NE2 3.86Å; Y321-H323 AromaticContact CE1-ND1 3.84Å; Y321-Q326 VanDerWaalsContact CZ-C 3.45Å; Y321-Q326 VanDerWaalsContact OH-CA 3.24Å; Y321-Q326 WeakPolarHBondContact OH-CA 3.31Å; Y321-Q326 PolarHBondContact OH-O 3.48Å; Y321-Q326 VanDerWaalsContact OH-O 3.05Å; Y321-Q326 PolarHBondContact OH-OE1 2.91Å; Y321-H328 AromaticContact CD2-CE1 3.91Å; Y321-H328 AromaticContact CD2-ND1 3.76Å
322	D	98.6	Very high	96.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	104	174.8	-176.5	-23.5	0	0	0	108.2	R302 Y303 E324 E325 Q326 C327 V329 R370	R302-D322 IonicContact CZ-OD1 2.84Å; R302-D322 IonicContact CZ-OD2 2.71Å; R302-D322 VanDerWaalsContact NE-CG 3.35Å; R302-D322 IonicContact NE-OD1 3.85Å; R302-D322 PolarHBondContact NE-OD1 2.82Å; R302-D322 IonicContact NE-OD2 3.51Å; R302-D322 PolarHBondContact NE-OD2 3.43Å; R302-D322 IonicContact NH2-OD1 2.69Å; R302-D322 PolarHBondContact NH2-OD1 2.87Å; R302-D322 IonicContact NH2-OD2 2.82Å; R302-D322 PolarHBondContact NH2-OD2 2.88Å; Y303-D322 HydrophobicContact CD1-CB 4.02Å; Y303-D322 HydrophobicContact CE1-CB 3.99Å; Y303-D322 WeakPolarHBondContact CE1-OD2 3.47Å; D322-E324 VanDerWaalsContact C-N 3.25Å; D322-E324 PolarHBondContact O-N 3.43Å; D322-E324 PolarHBondContact OD1-N 2.93Å; D322-E324 VanDerWaalsContact OD1-N 3.11Å; D322-E325 HydrophobicContact CB-CB 4.32Å; D322-E325 PolarHBondContact O-N 2.78Å; D322-E325 PolarHBondContact OD1-N 3.44Å; D322-Q326 WeakPolarHBondContact O-CA 3.48Å; D322-Q326 PolarHBondContact O-N 2.82Å; D322-C327 PolarHBondContact N-O 2.98Å; D322-C327 PolarHBondContact O-N 2.74Å; D322-V329 HydrophobicContact CB-CG1 3.98Å; D322-V329 HydrophobicContact CB-CG2 4.27Å; D322-R370 IonicContact OD2-CZ 3.68Å; D322-R370 IonicContact OD2-NH1 3.59Å; D322-R370 PolarHBondContact OD2-NH1 3.45Å
323	H	98.3	Very high	96.9	Very high	65 Å²	65	38.7 Å²	38.7	30%	0.301	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.9	-176.5	-80.3	-80.6	0	0	0	114.1	K298 R302 E304 Y321 Q326	K298-H323 PolarHBondContact NZ-NE2 2.94Å; R302-H323 WeakPolarHBondContact O-CB 3.47Å; R302-H323 PolarHBondContact O-CD2 2.7Å; R302-H323 PolarHBondContact O-N 2.84Å; E304-H323 IonicContact OE2-CD2 2.7Å; E304-H323 IonicContact OE2-CE1 3.52Å; E304-H323 IonicContact OE2-NE2 3.6Å; E304-H323 PolarHBondContact OE2-NE2 2.81Å; Y321-H323 AromaticContact CD1-CE1 3.74Å; Y321-H323 AromaticContact CD1-CG 3.97Å; Y321-H323 AromaticContact CD1-ND1 3.82Å; Y321-H323 AromaticContact CD1-NE2 3.86Å; Y321-H323 AromaticContact CE1-ND1 3.84Å; H323-Q326 PolarHBondContact O-NE2 2.94Å
324	E	97.6	Very high	97.5	Very high	137 Å²	137	36 Å²	36	64%	0.64	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-42.8	171.7	-81.4	177.2	-125.6	0	0	111.8	R302 D322 Q326	R302-E324 VanDerWaalsContact CD-OE1 3.23Å; R302-E324 WeakPolarHBondContact CD-OE1 3.46Å; R302-E324 HydrophobicContact CG-CG 4.31Å; R302-E324 IonicContact CZ-OE1 3.43Å; R302-E324 VanDerWaalsContact CZ-OE1 3.24Å; R302-E324 IonicContact CZ-OE2 2.7Å; R302-E324 IonicContact NE-OE1 2.7Å; R302-E324 IonicContact NH1-OE1 3.45Å; R302-E324 PolarHBondContact NH1-OE1 2.91Å; R302-E324 IonicContact NH1-OE2 3.63Å; R302-E324 PolarHBondContact NH1-OE2 3.03Å; R302-E324 IonicContact NH2-OE2 2.75Å; R302-E324 PolarHBondContact NH2-OE2 3.04Å; D322-E324 VanDerWaalsContact C-N 3.25Å; D322-E324 PolarHBondContact O-N 3.43Å; D322-E324 PolarHBondContact OD1-N 2.93Å; D322-E324 VanDerWaalsContact OD1-N 3.11Å; E324-Q326 VanDerWaalsContact C-N 3.32Å
325	E	97.2	Very high	97.9	Very high	76 Å²	76	35 Å²	35	36%	0.355	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-3	179	-69.5	-170.9	179.9	0	0	113.7	D322 C327 K369 R370	D322-E325 HydrophobicContact CB-CB 4.32Å; D322-E325 PolarHBondContact O-N 2.78Å; D322-E325 PolarHBondContact OD1-N 3.44Å; E325-C327 PolarHBondContact O-N 2.8Å; E325-C327 VanDerWaalsContact O-N 3.16Å; E325-K369 IonicContact OE2-NZ 2.68Å; E325-K369 PolarHBondContact OE2-NZ 3.37Å; E325-R370 IonicContact OE1-CZ 3.65Å; E325-R370 IonicContact OE1-NH2 3.65Å; E325-R370 PolarHBondContact OE1-NH2 3.32Å
326	Q	97.9	Very high	98.1	Very high	123 Å²	123	36.8 Å²	36.8	58%	0.575	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	34.4	-178	-66.2	-73.1	-65	0	0	113.3	Y321 D322 H323 E324	Y321-Q326 VanDerWaalsContact CZ-C 3.45Å; Y321-Q326 VanDerWaalsContact OH-CA 3.24Å; Y321-Q326 WeakPolarHBondContact OH-CA 3.31Å; Y321-Q326 PolarHBondContact OH-O 3.48Å; Y321-Q326 VanDerWaalsContact OH-O 3.05Å; Y321-Q326 PolarHBondContact OH-OE1 2.91Å; D322-Q326 WeakPolarHBondContact O-CA 3.48Å; D322-Q326 PolarHBondContact O-N 2.82Å; H323-Q326 PolarHBondContact O-NE2 2.94Å; E324-Q326 VanDerWaalsContact C-N 3.32Å
327	C	97.9	Very high	98.1	Very high	39 Å²	39	41 Å²	41	26%	0.264	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	158	-173.8	79.4	0	0	0	0	113.6	D322 E325	D322-C327 PolarHBondContact N-O 2.98Å; D322-C327 PolarHBondContact O-N 2.74Å; E325-C327 PolarHBondContact O-N 2.8Å; E325-C327 VanDerWaalsContact O-N 3.16Å
328	H	98.4	Very high	97.9	Very high	78 Å²	78	46.9 Å²	46.9	36%	0.361	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	138.2	172.7	-80.1	-53.3	0	0	0	112.1	D306 K319 A320 Y321 L384	D306-H328 IonicContact OD2-CE1 2.7Å; K319-H328 VanDerWaalsContact CE-CE1 3.49Å; K319-H328 WeakPolarHBondContact CE-CE1 3.41Å; K319-H328 WeakPolarHBondContact CE-NE2 3.49Å; K319-H328 PolarHBondContact NZ-CE1 3.38Å; K319-H328 PolarHBondContact NZ-NE2 3.41Å; A320-H328 WeakPolarHBondContact O-CA 3.32Å; A320-H328 PolarHBondContact O-ND1 3.21Å; Y321-H328 AromaticContact CD2-CE1 3.91Å; Y321-H328 AromaticContact CD2-ND1 3.76Å; H328-L384 HydrophobicContact CB-CD2 3.72Å
329	V	98.6	Very high	97.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.4	-179.3	-62.8	0	0	0	0	110.9	Y303 A320 D322 I331 K369 V381 F382	Y303-V329 HydrophobicContact CD1-CG2 4.1Å; Y303-V329 HydrophobicContact CE1-CG2 4.44Å; A320-V329 HydrophobicContact CB-CG2 4.04Å; A320-V329 PolarHBondContact N-O 2.92Å; A320-V329 PolarHBondContact O-N 3Å; D322-V329 HydrophobicContact CB-CG1 3.98Å; D322-V329 HydrophobicContact CB-CG2 4.27Å; V329-I331 HydrophobicContact CG2-CD1 4.3Å; V329-I331 HydrophobicContact CG2-CG1 4.06Å; V329-K369 HydrophobicContact CG1-CD 3.82Å; V329-V381 HydrophobicContact CB-CG1 3.83Å; V329-V381 HydrophobicContact CG1-CG1 4.07Å; V329-V381 HydrophobicContact CG2-CG1 3.94Å; V329-F382 WeakPolarHBondContact CB-O 3.32Å
330	A	98.6	Very high	97.4	Very high	11 Å²	11	51 Å²	51	9%	0.091	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.9	168.3	0	0	0	0	0	109.5	I309 V317 V318 F382 L384	I309-A330 HydrophobicContact CD1-CB 4.19Å; V317-A330 HydrophobicContact CG1-CB 4.18Å; V318-A330 CarbonylContact O-C 3.49Å; V318-A330 WeakPolarHBondContact O-CA 3.44Å; A330-F382 HydrophobicContact CB-CB 4.45Å; A330-F382 PolarHBondContact N-O 2.87Å; A330-F382 VanDerWaalsContact N-O 3.14Å; A330-F382 PolarHBondContact O-N 3.39Å; A330-L384 HydrophobicContact CB-CD1 4.08Å
331	I	98.6	Very high	97.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	113.5	-180	-51.6	-177.3	0	0	0	109.6	Y303 I305 V317 V318 A320 V329 I333 C379 L380 V381	Y303-I331 HydrophobicContact CD1-CD1 3.81Å; Y303-I331 HydrophobicContact CD2-CD1 4.44Å; Y303-I331 HydrophobicContact CG-CD1 3.74Å; I305-I331 HydrophobicContact CD1-CD1 4.36Å; V317-I331 WeakPolarHBondContact CA-O 3.17Å; V318-I331 HydrophobicContact CG2-CB 3.91Å; V318-I331 PolarHBondContact N-O 2.97Å; V318-I331 PolarHBondContact O-N 3.35Å; A320-I331 HydrophobicContact CB-CD1 3.72Å; A320-I331 HydrophobicContact CB-CG1 4.17Å; V329-I331 HydrophobicContact CG2-CD1 4.3Å; V329-I331 HydrophobicContact CG2-CG1 4.06Å; I331-I333 HydrophobicContact CG2-CG1 4.15Å; I331-I333 PolarHBondContact O-N 3.4Å; I331-C379 HydrophobicContact CG2-CB 3.93Å; I331-L380 CarbonylContact C-O 3.59Å; I331-L380 WeakPolarHBondContact CA-O 3.42Å; I331-V381 HydrophobicContact CG1-CG1 4.47Å; I331-V381 HydrophobicContact CG1-CG2 4.34Å
332	K	98.4	Very high	97	Very high	17 Å²	17	54.7 Å²	54.7	7%	0.074	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	105.4	173.4	-170.7	-175.3	-164.7	-175.7	0	108.3	Q316 V317 I334 E347 C379 L380 F382 D451	Q316-K332 CarbonylContact O-C 3.55Å; Q316-K332 WeakPolarHBondContact O-CA 3.46Å; V317-K332 HydrophobicContact CG2-CB 4.3Å; V317-K332 HydrophobicContact CG2-CG 4.16Å; K332-I334 HydrophobicContact CD-CD1 3.98Å; K332-I334 HydrophobicContact CG-CD1 3.95Å; K332-E347 IonicContact NZ-OE1 3.83Å; K332-E347 PolarHBondContact NZ-OE1 2.9Å; K332-E347 IonicContact NZ-OE2 3.59Å; K332-E347 PolarHBondContact NZ-OE2 3.27Å; K332-C379 WeakPolarHBondContact O-CA 3.14Å; K332-L380 HydrophobicContact CB-CB 4.3Å; K332-L380 PolarHBondContact N-O 2.75Å; K332-L380 PolarHBondContact O-N 3.18Å; K332-F382 HydrophobicContact CB-CD2 4.37Å; K332-F382 HydrophobicContact CB-CE2 3.82Å; K332-F382 HydrophobicContact CD-CE2 4.27Å; K332-D451 IonicContact NZ-OD1 3.96Å; K332-D451 PolarHBondContact NZ-OD1 3.5Å
333	I	98.5	Very high	96.6	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	107.6	178.2	-53.3	174.6	0	0	0	107.7	Y291 I293 F299 G315 Q316 V318 I331 H377	Y291-I333 HydrophobicContact CD1-CD1 4.43Å; I293-I333 HydrophobicContact CD1-CD1 3.87Å; F299-I333 HydrophobicContact CE2-CD1 3.83Å; F299-I333 HydrophobicContact CE2-CG1 4.44Å; F299-I333 HydrophobicContact CZ-CD1 4Å; G315-I333 WeakPolarHBondContact CA-O 3.3Å; Q316-I333 PolarHBondContact N-O 2.96Å; Q316-I333 PolarHBondContact O-N 2.96Å; V318-I333 HydrophobicContact CG1-CD1 4.38Å; V318-I333 HydrophobicContact CG2-CD1 4.02Å; I331-I333 HydrophobicContact CG2-CG1 4.15Å; I331-I333 PolarHBondContact O-N 3.4Å; I333-H377 HydrophobicContact CG2-CB 3.71Å
334	I	98.3	Very high	96.5	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	139.8	-176.9	-57.4	-64.8	0	0	0	110.2	F314 K332 F340 A344 H377 L378 L380	F314-I334 HydrophobicContact CB-CD1 4.47Å; K332-I334 HydrophobicContact CD-CD1 3.98Å; K332-I334 HydrophobicContact CG-CD1 3.95Å; I334-F340 HydrophobicContact CG2-CB 3.87Å; I334-A344 HydrophobicContact CB-CB 4.33Å; I334-A344 HydrophobicContact CD1-CB 3.79Å; I334-A344 HydrophobicContact CG1-CB 3.63Å; I334-A344 HydrophobicContact CG2-CB 3.9Å; I334-H377 PolarHBondContact O-ND1 3.28Å; I334-L378 HydrophobicContact CB-CB 4.36Å; I334-L378 VanDerWaalsContact CB-O 3.32Å; I334-L378 WeakPolarHBondContact CB-O 3.23Å; I334-L378 HydrophobicContact CG1-CB 4.49Å; I334-L378 VanDerWaalsContact CG1-O 3.31Å; I334-L378 WeakPolarHBondContact CG1-O 3.4Å; I334-L378 PolarHBondContact N-O 2.89Å; I334-L380 HydrophobicContact CD1-CD1 4.48Å; I334-L380 HydrophobicContact CG1-CD1 3.95Å
335	K	97.6	Very high	96.4	Very high	12 Å²	12	51 Å²	51	5%	0.052	25%	0.252	C	S	.	.			trans	-52.3	140.3	177.4	-77.3	177	175.4	-59.5	0	113.3	N288 H289 D290 S313 F314 K337 F340	N288-K335 PolarHBondContact ND2-NZ 2.98Å; N288-K335 PolarHBondContact O-NZ 3.41Å; H289-K335 HydrophobicContact CB-CB 4.39Å; H289-K335 VanDerWaalsContact O-CA 3.26Å; H289-K335 WeakPolarHBondContact O-CA 3.4Å; D290-K335 WeakPolarHBondContact OD1-CE 3.41Å; D290-K335 WeakPolarHBondContact OD1-CG 3.35Å; D290-K335 IonicContact OD1-NZ 2.97Å; D290-K335 PolarHBondContact OD1-NZ 3.37Å; D290-K335 IonicContact OD2-NZ 3.88Å; D290-K335 PolarHBondContact OD2-NZ 2.93Å; S313-K335 WeakPolarHBondContact O-CD 3.43Å; S313-K335 WeakPolarHBondContact O-CE 3.39Å; F314-K335 PolarHBondContact O-N 2.8Å; K335-K337 PolarHBondContact O-N 3.12Å; K335-F340 HydrophobicContact CB-CB 4.16Å; K335-F340 HydrophobicContact CB-CD2 3.47Å; K335-F340 VanDerWaalsContact CB-CD2 3.47Å; K335-F340 HydrophobicContact CB-CE2 4.11Å; K335-F340 HydrophobicContact CB-CG 4.01Å; K335-F340 HydrophobicContact CD-CD2 3.66Å; K335-F340 HydrophobicContact CD-CE2 3.4Å; K335-F340 HydrophobicContact CD-CG 4.35Å; K335-F340 HydrophobicContact CD-CZ 3.89Å; K335-F340 HydrophobicContact CG-CD2 4.2Å; K335-F340 HydrophobicContact CG-CE2 4.41Å
336	N	97.2	Very high	96.3	Very high	46 Å²	46	50 Å²	50	25%	0.246	25%	0.249	C	C	.	.	S	Bend	trans	-73.9	72.7	177.1	-174.9	4.6	0	0	0	111.5	N281 D285 H289	N281-N336 PolarHBondContact ND2-ND2 2.66Å; D285-N336 WeakPolarHBondContact OD2-CB 3.33Å; D285-N336 PolarHBondContact OD2-ND2 3.42Å; H289-N336 PolarHBondContact ND1-O 2.99Å; H289-N336 PolarHBondContact O-N 3.11Å; H289-N336 VanDerWaalsContact O-N 3.08Å
337	K	95.7	Very high	96.2	Very high	99 Å²	99	44.2 Å²	44.2	43%	0.43	22%	0.221	S	C	.	.	S	Bend	trans	-157.1	131.9	178.7	-145.5	175.9	-173.3	142.5	0	110.7	H289 K335 P339 F340 L341	H289-K337 PolarHBondContact NE2-NZ 2.83Å; K335-K337 PolarHBondContact O-N 3.12Å; K337-P339 VanDerWaalsContact C-CD 3.46Å; K337-P339 VanDerWaalsContact C-N 3.35Å; K337-P339 VanDerWaalsContact O-N 3.11Å; K337-F340 HydrophobicContact CB-CD2 3.78Å; K337-F340 HydrophobicContact CB-CE2 4.4Å; K337-F340 HydrophobicContact CD-CD2 4.38Å; K337-F340 HydrophobicContact CD-CE2 4.2Å; K337-F340 PolarHBondContact O-N 3.32Å; K337-L341 PolarHBondContact O-N 3.39Å
338	K	94.6	Very high	96.2	Very high	168 Å²	168	42.9 Å²	42.9	73%	0.73	21%	0.212	S	C	*	.	H	α-helix	trans	-46.4	-43.6	-176.3	-64.7	-175.7	178.2	-176.6	0	114.9	F340 L341 N342	K338-F340 PolarHBondContact O-N 3.21Å; K338-L341 PolarHBondContact O-N 3.5Å; K338-N342 WeakPolarHBondContact O-CB 3.15Å; K338-N342 PolarHBondContact O-N 3.31Å; K338-N342 PolarHBondContact O-OD1 2.88Å
339	P	92.3	Very high	96.1	Very high	83 Å²	83	43.5 Å²	43.5	54%	0.539	21%	0.214	S	C	.	.	H	α-helix	trans	-64.4	-37.2	178.5	-23.2	35.7	0	0	0	114.2	K337 Q343	K337-P339 VanDerWaalsContact C-CD 3.46Å; K337-P339 VanDerWaalsContact C-N 3.35Å; K337-P339 VanDerWaalsContact O-N 3.11Å; P339-Q343 WeakPolarHBondContact O-CB 3.4Å; P339-Q343 PolarHBondContact O-N 2.71Å
340	F	94	Very high	96	Very high	50 Å²	50	43.7 Å²	43.7	22%	0.219	22%	0.215	C	C	.	.	H	α-helix	trans	-74.6	-39.1	177.2	-62.2	-58.9	0	0	0	111.3	S313 F314 I334 K335 K337 K338 Q343 A344	S313-F340 WeakPolarHBondContact O-CE1 3.09Å; F314-F340 HydrophobicContact CD1-CD1 4.42Å; I334-F340 HydrophobicContact CG2-CB 3.87Å; K335-F340 HydrophobicContact CB-CB 4.16Å; K335-F340 HydrophobicContact CB-CD2 3.47Å; K335-F340 VanDerWaalsContact CB-CD2 3.47Å; K335-F340 HydrophobicContact CB-CE2 4.11Å; K335-F340 HydrophobicContact CB-CG 4.01Å; K335-F340 HydrophobicContact CD-CD2 3.66Å; K335-F340 HydrophobicContact CD-CE2 3.4Å; K335-F340 HydrophobicContact CD-CG 4.35Å; K335-F340 HydrophobicContact CD-CZ 3.89Å; K335-F340 HydrophobicContact CG-CD2 4.2Å; K335-F340 HydrophobicContact CG-CE2 4.41Å; K337-F340 HydrophobicContact CB-CD2 3.78Å; K337-F340 HydrophobicContact CB-CE2 4.4Å; K337-F340 HydrophobicContact CD-CD2 4.38Å; K337-F340 HydrophobicContact CD-CE2 4.2Å; K337-F340 PolarHBondContact O-N 3.32Å; K338-F340 PolarHBondContact O-N 3.21Å; F340-Q343 PolarHBondContact O-N 2.72Å; F340-A344 VanDerWaalsContact O-CB 3.3Å; F340-A344 WeakPolarHBondContact O-CB 3.42Å; F340-A344 PolarHBondContact O-N 3.03Å
341	L	95.7	Very high	96	Very high	46 Å²	46	43.2 Å²	43.2	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-51.5	173.3	177.7	61.8	0	0	0	111.7	K337 K338 Q343 A344 Q345 M373 L378	K337-L341 PolarHBondContact O-N 3.39Å; K338-L341 PolarHBondContact O-N 3.5Å; L341-Q343 VanDerWaalsContact C-N 3.31Å; L341-Q343 PolarHBondContact O-N 2.84Å; L341-A344 PolarHBondContact O-N 3.09Å; L341-Q345 WeakPolarHBondContact O-CG 3.49Å; L341-Q345 PolarHBondContact O-N 3.16Å; L341-M373 HydrophobicContact CD1-CE 4.12Å; L341-L378 HydrophobicContact CD1-CB 3.67Å; L341-L378 HydrophobicContact CD1-CD2 3.81Å; L341-L378 HydrophobicContact CD1-CG 4.33Å
342	N	93	Very high	95.9	Very high	93 Å²	93	47.2 Å²	47.2	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-60.5	-40.5	179.6	-69.1	20.7	0	0	0	111.7	K338 Q345 I346	K338-N342 WeakPolarHBondContact O-CB 3.15Å; K338-N342 PolarHBondContact O-N 3.31Å; K338-N342 PolarHBondContact O-OD1 2.88Å; N342-Q345 PolarHBondContact O-N 3.34Å; N342-I346 PolarHBondContact O-N 2.68Å
343	Q	91.2	Very high	95.8	Very high	15 Å²	15	48.6 Å²	48.6	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-69.6	-37.7	177.9	-170.1	60.2	24.7	0	0	112.1	F314 P339 F340 L341 Q345 I346 E347 G453 Y463	F314-Q343 HydrophobicContact CE1-CG 4.43Å; P339-Q343 WeakPolarHBondContact O-CB 3.4Å; P339-Q343 PolarHBondContact O-N 2.71Å; F340-Q343 PolarHBondContact O-N 2.72Å; L341-Q343 VanDerWaalsContact C-N 3.31Å; L341-Q343 PolarHBondContact O-N 2.84Å; Q343-Q345 VanDerWaalsContact C-N 3.33Å; Q343-Q345 PolarHBondContact O-N 2.81Å; Q343-I346 WeakPolarHBondContact O-CB 3.5Å; Q343-I346 PolarHBondContact O-N 2.65Å; Q343-E347 PolarHBondContact O-N 3.29Å; Q343-G453 WeakPolarHBondContact CG-O 3.23Å; Q343-G453 PolarHBondContact NE2-O 3.46Å; Q343-Y463 PolarHBondContact OE1-OH 3.22Å; Q343-Y463 VanDerWaalsContact OE1-OH 3.12Å
344	A	95.4	Very high	95.7	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.017	24%	0.236	C	C	.	.	H	α-helix	trans	-69.8	-27.5	174.8	0	0	0	0	0	113.2	I334 F340 L341 I346 E347 V348 L378	I334-A344 HydrophobicContact CB-CB 4.33Å; I334-A344 HydrophobicContact CD1-CB 3.79Å; I334-A344 HydrophobicContact CG1-CB 3.63Å; I334-A344 HydrophobicContact CG2-CB 3.9Å; F340-A344 VanDerWaalsContact O-CB 3.3Å; F340-A344 WeakPolarHBondContact O-CB 3.42Å; F340-A344 PolarHBondContact O-N 3.03Å; L341-A344 PolarHBondContact O-N 3.09Å; A344-I346 VanDerWaalsContact C-N 3.32Å; A344-E347 WeakPolarHBondContact O-CB 3.39Å; A344-E347 PolarHBondContact O-N 3.34Å; A344-V348 WeakPolarHBondContact O-CG2 3.46Å; A344-V348 PolarHBondContact O-N 3.45Å; A344-L378 HydrophobicContact CB-CD2 3.88Å
345	Q	95.8	Very high	95.6	Very high	107 Å²	107	50 Å²	50	50%	0.5	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-35	169.8	-73.7	171.6	-27.6	0	0	111.9	L341 N342 Q343 K349 L378	L341-Q345 WeakPolarHBondContact O-CG 3.49Å; L341-Q345 PolarHBondContact O-N 3.16Å; N342-Q345 PolarHBondContact O-N 3.34Å; Q343-Q345 VanDerWaalsContact C-N 3.33Å; Q343-Q345 PolarHBondContact O-N 2.81Å; Q345-K349 WeakPolarHBondContact O-CB 3.24Å; Q345-K349 PolarHBondContact O-N 2.85Å; Q345-K349 VanDerWaalsContact O-N 3.09Å; Q345-L378 HydrophobicContact CG-CD2 4.33Å
346	I	93.9	Very high	95.5	Very high	56 Å²	56	58.4 Å²	58.4	29%	0.287	28%	0.276	S	S	.	.	H	α-helix	trans	-66.4	-45.6	170.6	-61.6	168.9	0	0	0	109.8	N342 Q343 A344 V348 K349 L350 I462	N342-I346 PolarHBondContact O-N 2.68Å; Q343-I346 WeakPolarHBondContact O-CB 3.5Å; Q343-I346 PolarHBondContact O-N 2.65Å; A344-I346 VanDerWaalsContact C-N 3.32Å; I346-V348 PolarHBondContact O-N 2.9Å; I346-K349 PolarHBondContact O-N 2.84Å; I346-L350 HydrophobicContact CG2-CD1 4.03Å; I346-L350 HydrophobicContact CG2-CG 4.3Å; I346-L350 WeakPolarHBondContact O-CG 3.34Å; I346-L350 PolarHBondContact O-N 2.97Å; I346-I462 HydrophobicContact CD1-CD1 4.06Å
347	E	96.1	Very high	95.3	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-56.6	-47.7	176.1	-177.3	172.5	-162.2	0	0	112.2	K332 Q343 A344 L350 L351 L380 F452 G453	K332-E347 IonicContact NZ-OE1 3.83Å; K332-E347 PolarHBondContact NZ-OE1 2.9Å; K332-E347 IonicContact NZ-OE2 3.59Å; K332-E347 PolarHBondContact NZ-OE2 3.27Å; Q343-E347 PolarHBondContact O-N 3.29Å; A344-E347 WeakPolarHBondContact O-CB 3.39Å; A344-E347 PolarHBondContact O-N 3.34Å; E347-L350 PolarHBondContact O-N 3.03Å; E347-L351 HydrophobicContact CG-CD1 3.76Å; E347-L351 HydrophobicContact CG-CG 4.47Å; E347-L351 WeakPolarHBondContact O-CB 3.24Å; E347-L351 WeakPolarHBondContact O-CD1 3.45Å; E347-L351 VanDerWaalsContact O-CG 3.27Å; E347-L351 WeakPolarHBondContact O-CG 3.42Å; E347-L351 PolarHBondContact O-N 3.31Å; E347-L380 HydrophobicContact CG-CD2 4.32Å; E347-F452 HydrophobicContact CG-CB 4.07Å; E347-F452 PolarHBondContact OE1-N 3.38Å; E347-G453 PolarHBondContact OE1-N 2.76Å
348	V	97.8	Very high	95.2	Very high	11 Å²	11	54.6 Å²	54.6	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-55.5	-53.2	173.8	167.4	0	0	0	0	111	A344 I346 L350 L351 E352 L368 H371 L380	A344-V348 WeakPolarHBondContact O-CG2 3.46Å; A344-V348 PolarHBondContact O-N 3.45Å; I346-V348 PolarHBondContact O-N 2.9Å; V348-L350 VanDerWaalsContact C-N 3.31Å; V348-L350 PolarHBondContact O-N 2.86Å; V348-L351 PolarHBondContact O-N 2.81Å; V348-E352 HydrophobicContact CG1-CG 4.31Å; V348-E352 WeakPolarHBondContact O-CG 3.32Å; V348-E352 PolarHBondContact O-N 2.67Å; V348-L368 HydrophobicContact CG1-CD2 4.27Å; V348-L368 HydrophobicContact CG2-CD2 4.49Å; V348-H371 VanDerWaalsContact CG1-CD2 3.46Å; V348-H371 WeakPolarHBondContact CG1-CD2 3.39Å; V348-H371 HydrophobicContact CG2-CB 4.24Å; V348-L380 HydrophobicContact CG2-CD1 4.1Å; V348-L380 HydrophobicContact CG2-CD2 3.72Å; V348-L380 HydrophobicContact CG2-CG 3.77Å
349	K	96.9	Very high	94.8	Very high	92 Å²	92	50.9 Å²	50.9	40%	0.4	27%	0.268	S	S	.	.	H	α-helix	trans	-56.2	-45.1	-179	-177.9	-165	170.5	-157.9	0	111.8	Q345 I346 M353	Q345-K349 WeakPolarHBondContact O-CB 3.24Å; Q345-K349 PolarHBondContact O-N 2.85Å; Q345-K349 VanDerWaalsContact O-N 3.09Å; I346-K349 PolarHBondContact O-N 2.84Å; K349-M353 HydrophobicContact CG-SD 4.16Å; K349-M353 VanDerWaalsContact O-CG 3.27Å; K349-M353 WeakPolarHBondContact O-CG 3.3Å; K349-M353 PolarHBondContact O-N 3.27Å; K349-M353 VanDerWaalsContact O-N 3.08Å
350	L	96.9	Very high	94.7	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-66.9	-42	179.6	-65	179.5	0	0	0	111.6	I346 E347 V348 M353 M354 I427 Q457	I346-L350 HydrophobicContact CG2-CD1 4.03Å; I346-L350 HydrophobicContact CG2-CG 4.3Å; I346-L350 WeakPolarHBondContact O-CG 3.34Å; I346-L350 PolarHBondContact O-N 2.97Å; E347-L350 PolarHBondContact O-N 3.03Å; V348-L350 VanDerWaalsContact C-N 3.31Å; V348-L350 PolarHBondContact O-N 2.86Å; L350-M353 PolarHBondContact O-N 3.19Å; L350-M354 HydrophobicContact CB-CE 4.32Å; L350-M354 WeakPolarHBondContact O-CE 3.49Å; L350-M354 WeakPolarHBondContact O-CG 3.44Å; L350-M354 PolarHBondContact O-N 3.41Å; L350-I427 HydrophobicContact CB-CD1 4.39Å; L350-I427 HydrophobicContact CD2-CD1 4.05Å; L350-I427 HydrophobicContact CD2-CG1 4.2Å; L350-Q457 HydrophobicContact CD2-CG 3.73Å
351	L	97.8	Very high	94.4	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-43.9	175.8	-73.7	164.2	0	0	0	112.2	E347 V348 M353 M354 N355 V366 L368 L380 F382 F452	E347-L351 HydrophobicContact CG-CD1 3.76Å; E347-L351 HydrophobicContact CG-CG 4.47Å; E347-L351 WeakPolarHBondContact O-CB 3.24Å; E347-L351 WeakPolarHBondContact O-CD1 3.45Å; E347-L351 VanDerWaalsContact O-CG 3.27Å; E347-L351 WeakPolarHBondContact O-CG 3.42Å; E347-L351 PolarHBondContact O-N 3.31Å; V348-L351 PolarHBondContact O-N 2.81Å; L351-M353 PolarHBondContact O-N 3.11Å; L351-M354 HydrophobicContact CD2-CE 4.03Å; L351-M354 HydrophobicContact CG-CE 4.39Å; L351-M354 PolarHBondContact O-N 2.98Å; L351-N355 VanDerWaalsContact O-CB 3.3Å; L351-N355 WeakPolarHBondContact O-CB 3.16Å; L351-N355 PolarHBondContact O-N 2.87Å; L351-N355 PolarHBondContact O-OD1 3.16Å; L351-V366 HydrophobicContact CD2-CG1 4.01Å; L351-L368 HydrophobicContact CB-CB 4.06Å; L351-L368 HydrophobicContact CB-CD2 3.96Å; L351-L368 HydrophobicContact CD1-CB 4.36Å; L351-L368 HydrophobicContact CD1-CD2 4.31Å; L351-L380 HydrophobicContact CD1-CD2 4.2Å; L351-F382 HydrophobicContact CD1-CE1 3.63Å; L351-F382 HydrophobicContact CD1-CZ 3.78Å; L351-F382 HydrophobicContact CD2-CE1 4.34Å; L351-F452 HydrophobicContact CD2-CD2 4.08Å
352	E	96.8	Very high	94.3	Very high	84 Å²	84	57.7 Å²	57.7	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-39.4	176	-71.3	-175.3	156.1	0	0	112.6	V348 R356 L368	V348-E352 HydrophobicContact CG1-CG 4.31Å; V348-E352 WeakPolarHBondContact O-CG 3.32Å; V348-E352 PolarHBondContact O-N 2.67Å; E352-R356 WeakPolarHBondContact O-CB 3.04Å; E352-R356 PolarHBondContact O-N 3.14Å; E352-R356 VanDerWaalsContact O-N 3.1Å; E352-L368 HydrophobicContact CG-CD2 4.26Å
353	M	96	Very high	94.4	Very high	46 Å²	46	57.7 Å²	57.7	23%	0.227	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-47.7	174.6	-72.8	173.8	60.5	0	0	111.4	K349 L350 L351 R356 A357 L425	K349-M353 HydrophobicContact CG-SD 4.16Å; K349-M353 VanDerWaalsContact O-CG 3.27Å; K349-M353 WeakPolarHBondContact O-CG 3.3Å; K349-M353 PolarHBondContact O-N 3.27Å; K349-M353 VanDerWaalsContact O-N 3.08Å; L350-M353 PolarHBondContact O-N 3.19Å; L351-M353 PolarHBondContact O-N 3.11Å; M353-R356 PolarHBondContact O-N 3.35Å; M353-A357 PolarHBondContact O-N 3.31Å; M353-L425 HydrophobicContact CB-CD2 4.17Å
354	M	97.3	Very high	94.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.3	-46.3	178.4	-71.1	-177.7	-66.1	0	0	112.5	L350 L351 R356 A357 D358 I365 F419 L420 L425 I427 F452	L350-M354 HydrophobicContact CB-CE 4.32Å; L350-M354 WeakPolarHBondContact O-CE 3.49Å; L350-M354 WeakPolarHBondContact O-CG 3.44Å; L350-M354 PolarHBondContact O-N 3.41Å; L351-M354 HydrophobicContact CD2-CE 4.03Å; L351-M354 HydrophobicContact CG-CE 4.39Å; L351-M354 PolarHBondContact O-N 2.98Å; M354-R356 PolarHBondContact O-N 2.81Å; M354-A357 PolarHBondContact O-N 3.01Å; M354-A357 VanDerWaalsContact O-N 3.13Å; M354-D358 PolarHBondContact O-N 3.06Å; M354-I365 HydrophobicContact CB-CG2 4.39Å; M354-I365 HydrophobicContact CE-CG2 3.95Å; M354-I365 HydrophobicContact SD-CG1 4.39Å; M354-I365 HydrophobicContact SD-CG2 3.91Å; M354-F419 HydrophobicContact CB-CE1 4.07Å; M354-F419 HydrophobicContact CB-CZ 4.44Å; M354-F419 HydrophobicContact CG-CE1 4.18Å; M354-F419 WeakPolarHBondContact O-CZ 3.14Å; M354-L420 HydrophobicContact CG-CD2 4.36Å; M354-L420 HydrophobicContact SD-CD2 3.34Å; M354-L420 WeakPolarHBondContact SD-CD2 3.46Å; M354-L425 HydrophobicContact CG-CD1 4.23Å; M354-L425 HydrophobicContact CG-CD2 4.22Å; M354-I427 HydrophobicContact CE-CD1 4.39Å; M354-I427 HydrophobicContact CG-CD1 3.54Å; M354-I427 HydrophobicContact SD-CD1 3.7Å; M354-F452 HydrophobicContact CE-CD1 3.51Å; M354-F452 HydrophobicContact CE-CD2 4.05Å; M354-F452 HydrophobicContact CE-CE1 3.48Å; M354-F452 VanDerWaalsContact CE-CE1 3.48Å; M354-F452 HydrophobicContact CE-CE2 4.05Å; M354-F452 HydrophobicContact CE-CG 3.81Å; M354-F452 HydrophobicContact CE-CZ 3.78Å; M354-F452 HydrophobicContact SD-CD1 4.15Å; M354-F452 HydrophobicContact SD-CE1 3.56Å; M354-F452 VanDerWaalsContact SD-CE1 3.56Å; M354-F452 HydrophobicContact SD-CZ 3.87Å
355	N	95.4	Very high	94.9	Very high	34 Å²	34	60.4 Å²	60.4	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-71.1	-18	-178.9	-62.3	159.2	0	0	0	112.8	L351 V366 L368	L351-N355 VanDerWaalsContact O-CB 3.3Å; L351-N355 WeakPolarHBondContact O-CB 3.16Å; L351-N355 PolarHBondContact O-N 2.87Å; L351-N355 PolarHBondContact O-OD1 3.16Å; N355-V366 PolarHBondContact ND2-O 3.38Å; N355-L368 PolarHBondContact OD1-N 2.84Å
356	R	95.1	Very high	95	Very high	190 Å²	190	55.5 Å²	55.5	72%	0.717	27%	0.274	S	S	*	.	H	α-helix	trans	-77.5	-35.3	168.6	-170.9	-177.2	-54.6	161.5	7	112.5	E352 M353 M354	E352-R356 WeakPolarHBondContact O-CB 3.04Å; E352-R356 PolarHBondContact O-N 3.14Å; E352-R356 VanDerWaalsContact O-N 3.1Å; M353-R356 PolarHBondContact O-N 3.35Å; M354-R356 PolarHBondContact O-N 2.81Å
357	A	94.5	Very high	95.1	Very high	55 Å²	55	58 Å²	58	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-78.2	-33.4	175.5	0	0	0	0	0	112.6	M353 M354 A359 F419 L425	M353-A357 PolarHBondContact O-N 3.31Å; M354-A357 PolarHBondContact O-N 3.01Å; M354-A357 VanDerWaalsContact O-N 3.13Å; A357-A359 PolarHBondContact O-N 3.33Å; A357-F419 HydrophobicContact CB-CE2 3.82Å; A357-F419 HydrophobicContact CB-CZ 3.82Å; A357-L425 HydrophobicContact CB-CD1 4.45Å
358	D	93.6	Very high	95.2	Very high	10 Å²	10	58.7 Å²	58.7	5%	0.053	29%	0.286	C	S	.	.			trans	-93.6	56.8	174.6	-167.3	13.9	0	0	0	112.5	M354 E360 N361 K362 Y363 F419	M354-D358 PolarHBondContact O-N 3.06Å; D358-E360 PolarHBondContact O-N 3.22Å; D358-N361 PolarHBondContact O-N 3.24Å; D358-N361 VanDerWaalsContact O-N 3.12Å; D358-N361 WeakPolarHBondContact OD1-CA 3.23Å; D358-N361 PolarHBondContact OD1-N 2.67Å; D358-N361 WeakPolarHBondContact OD2-CA 3.43Å; D358-K362 PolarHBondContact OD1-N 3.13Å; D358-K362 PolarHBondContact OD2-N 2.93Å; D358-Y363 HydrophobicContact CB-CD2 3.88Å; D358-Y363 WeakPolarHBondContact OD1-CD2 3.45Å; D358-Y363 PolarHBondContact OD1-N 3.02Å; D358-Y363 PolarHBondContact OD2-N 2.65Å; D358-F419 HydrophobicContact CB-CE1 4.4Å; D358-F419 HydrophobicContact CB-CE2 4.3Å; D358-F419 HydrophobicContact CB-CZ 3.82Å
359	A	85.3	Confident	95.2	Very high	89 Å²	89	61.3 Å²	61.3	74%	0.736	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.1	-179.6	0	0	0	0	0	113.3	A357	A357-A359 PolarHBondContact O-N 3.33Å
360	E	89.3	Confident	95.2	Very high	140 Å²	140	60.2 Å²	60.2	65%	0.654	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	1.6	179.9	-63.8	-170.9	-82.4	0	0	114.2	D358 K362	D358-E360 PolarHBondContact O-N 3.22Å; E360-K362 VanDerWaalsContact C-N 3.32Å; E360-K362 HydrophobicContact CB-CD 3.83Å; E360-K362 HydrophobicContact CB-CG 3.89Å; E360-K362 VanDerWaalsContact CD-CE 3.46Å; E360-K362 PolarHBondContact O-N 2.87Å; E360-K362 WeakPolarHBondContact OE1-CE 3.5Å; E360-K362 IonicContact OE1-NZ 3.97Å; E360-K362 PolarHBondContact OE1-NZ 3.49Å; E360-K362 VanDerWaalsContact OE2-CE 3.23Å; E360-K362 WeakPolarHBondContact OE2-CE 3.25Å; E360-K362 IonicContact OE2-NZ 2.65Å; E360-K362 PolarHBondContact OE2-NZ 2.8Å
361	N	89.6	Confident	95.3	Very high	79 Å²	79	64 Å²	64	42%	0.422	31%	0.307	S	S	.	.	S	Bend	trans	59.4	36.9	178.1	-166	50.3	0	0	0	113.9	D358 K448	D358-N361 PolarHBondContact O-N 3.24Å; D358-N361 VanDerWaalsContact O-N 3.12Å; D358-N361 WeakPolarHBondContact OD1-CA 3.23Å; D358-N361 PolarHBondContact OD1-N 2.67Å; D358-N361 WeakPolarHBondContact OD2-CA 3.43Å; N361-K448 PolarHBondContact OD1-NZ 3.14Å
362	K	92.4	Very high	95.3	Very high	104 Å²	104	65.1 Å²	65.1	45%	0.452	31%	0.312	S	S	.	.			trans	-97.3	-20.5	-173.7	-72.4	177.7	179.4	168.1	0	114.6	D358 E360 Y364	D358-K362 PolarHBondContact OD1-N 3.13Å; D358-K362 PolarHBondContact OD2-N 2.93Å; E360-K362 VanDerWaalsContact C-N 3.32Å; E360-K362 HydrophobicContact CB-CD 3.83Å; E360-K362 HydrophobicContact CB-CG 3.89Å; E360-K362 VanDerWaalsContact CD-CE 3.46Å; E360-K362 PolarHBondContact O-N 2.87Å; E360-K362 WeakPolarHBondContact OE1-CE 3.5Å; E360-K362 IonicContact OE1-NZ 3.97Å; E360-K362 PolarHBondContact OE1-NZ 3.49Å; E360-K362 VanDerWaalsContact OE2-CE 3.23Å; E360-K362 WeakPolarHBondContact OE2-CE 3.25Å; E360-K362 IonicContact OE2-NZ 2.65Å; E360-K362 PolarHBondContact OE2-NZ 2.8Å; K362-Y364 WeakPolarHBondContact O-CE2 3.41Å
363	Y	95.9	Very high	95.4	Very high	93 Å²	93	65.7 Å²	65.7	37%	0.365	32%	0.316	S	S	.	.	S	Bend	trans	-98.6	17.2	-167.4	-62.6	-65.6	0	0	0	114.8	D358 I365 T415 A416 F419	D358-Y363 HydrophobicContact CB-CD2 3.88Å; D358-Y363 WeakPolarHBondContact OD1-CD2 3.45Å; D358-Y363 PolarHBondContact OD1-N 3.02Å; D358-Y363 PolarHBondContact OD2-N 2.65Å; Y363-I365 PolarHBondContact O-N 3.03Å; Y363-T415 HydrophobicContact CD1-CG2 4.18Å; Y363-A416 WeakPolarHBondContact O-CA 3.47Å; Y363-A416 WeakPolarHBondContact O-CB 3.36Å; Y363-F419 VanDerWaalsContact CB-CG 3.43Å; Y363-F419 HydrophobicContact CD1-CB 3.71Å; Y363-F419 AromaticContact CD1-CD2 3.98Å; Y363-F419 HydrophobicContact CD1-CD2 3.98Å; Y363-F419 HydrophobicContact CD1-CG 4.02Å; Y363-F419 AromaticContact CD2-CD2 3.33Å; Y363-F419 HydrophobicContact CD2-CD2 3.33Å; Y363-F419 AromaticContact CD2-CE2 3.49Å; Y363-F419 HydrophobicContact CD2-CE2 3.49Å; Y363-F419 VanDerWaalsContact CD2-CE2 3.49Å; Y363-F419 AromaticContact CD2-CG 3.91Å; Y363-F419 HydrophobicContact CD2-CG 3.91Å; Y363-F419 HydrophobicContact CD2-CZ 4.18Å; Y363-F419 HydrophobicContact CE1-CB 4.49Å; Y363-F419 HydrophobicContact CE1-CD2 4.4Å; Y363-F419 AromaticContact CE2-CD2 3.83Å; Y363-F419 HydrophobicContact CE2-CD2 3.83Å; Y363-F419 HydrophobicContact CE2-CE2 4.01Å; Y363-F419 HydrophobicContact CG-CB 3.73Å; Y363-F419 HydrophobicContact CG-CD1 4.18Å; Y363-F419 AromaticContact CG-CD2 3.43Å; Y363-F419 HydrophobicContact CG-CD2 3.43Å; Y363-F419 VanDerWaalsContact CG-CD2 3.43Å; Y363-F419 HydrophobicContact CG-CE2 4Å; Y363-F419 AromaticContact CG-CG 3.52Å; Y363-F419 HydrophobicContact CG-CG 3.52Å
364	Y	98	Very high	95.5	Very high	73 Å²	73	65.7 Å²	65.7	29%	0.286	31%	0.314	S	S	.	.			trans	58.9	27.1	171.3	-43.3	-76	0	0	0	114.8	K362 Q412 T415 A416 I447 K448 I449	K362-Y364 WeakPolarHBondContact O-CE2 3.41Å; Y364-Q412 HydrophobicContact CD1-CB 4.23Å; Y364-Q412 HydrophobicContact CD1-CG 4.18Å; Y364-Q412 HydrophobicContact CD2-CB 4.11Å; Y364-Q412 VanDerWaalsContact CD2-O 3.3Å; Y364-Q412 WeakPolarHBondContact CD2-O 3.21Å; Y364-Q412 HydrophobicContact CE1-CB 4.2Å; Y364-Q412 HydrophobicContact CE1-CG 3.71Å; Y364-Q412 HydrophobicContact CE2-CB 4.07Å; Y364-Q412 HydrophobicContact CE2-CG 4.13Å; Y364-Q412 HydrophobicContact CG-CB 4.19Å; Y364-T415 HydrophobicContact CD2-CG2 4.26Å; Y364-T415 HydrophobicContact CE2-CG2 3.77Å; Y364-A416 HydrophobicContact CD2-CB 4.47Å; Y364-I447 WeakPolarHBondContact CD1-O 3.16Å; Y364-K448 CarbonylContact O-C 3.59Å; Y364-K448 WeakPolarHBondContact O-CA 3.27Å; Y364-I449 PolarHBondContact O-N 2.98Å
365	I	98.3	Very high	95.5	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-95	144.4	170.4	-49.8	-48.2	0	0	0	108.8	M354 Y363 A416 F419 L420 K448 F452	M354-I365 HydrophobicContact CB-CG2 4.39Å; M354-I365 HydrophobicContact CE-CG2 3.95Å; M354-I365 HydrophobicContact SD-CG1 4.39Å; M354-I365 HydrophobicContact SD-CG2 3.91Å; Y363-I365 PolarHBondContact O-N 3.03Å; I365-A416 HydrophobicContact CD1-CB 4.25Å; I365-F419 HydrophobicContact CD1-CD1 4.39Å; I365-F419 HydrophobicContact CG1-CD1 3.83Å; I365-F419 HydrophobicContact CG1-CE1 3.81Å; I365-L420 HydrophobicContact CD1-CD2 4.01Å; I365-L420 HydrophobicContact CD1-CG 4.46Å; I365-L420 HydrophobicContact CG1-CD2 4.49Å; I365-K448 PolarHBondContact O-NZ 3.33Å; I365-F452 HydrophobicContact CD1-CZ 4.17Å; I365-F452 HydrophobicContact CG2-CE2 3.82Å; I365-F452 HydrophobicContact CG2-CZ 3.9Å
366	V	97.9	Very high	95.6	Very high	5 Å²	5	72.1 Å²	72.1	3%	0.03	34%	0.343	C	S	.	.			trans	-64.4	142.6	173.8	69.7	0	0	0	0	111.9	L351 N355 F382 E383 L385 I449 V450	L351-V366 HydrophobicContact CD2-CG1 4.01Å; N355-V366 PolarHBondContact ND2-O 3.38Å; V366-F382 HydrophobicContact CG1-CD1 4.01Å; V366-F382 HydrophobicContact CG1-CE1 3.94Å; V366-F382 HydrophobicContact CG2-CB 4.29Å; V366-F382 HydrophobicContact CG2-CD1 3.8Å; V366-F382 HydrophobicContact CG2-CG 4.39Å; V366-E383 HydrophobicContact CG2-CG 4.12Å; V366-L385 HydrophobicContact CG2-CD1 4.03Å; V366-I449 WeakPolarHBondContact CB-O 3.27Å; V366-I449 WeakPolarHBondContact CG1-O 3.49Å; V366-I449 PolarHBondContact N-O 3.04Å; V366-I449 VanDerWaalsContact N-O 3.08Å; V366-V450 HydrophobicContact CB-CG1 4.01Å; V366-V450 HydrophobicContact CG1-CB 4.42Å; V366-V450 HydrophobicContact CG1-CG1 4.22Å; V366-V450 HydrophobicContact CG2-CG1 4.26Å
367	K	97.2	Very high	95.7	Very high	107 Å²	107	63.1 Å²	63.1	47%	0.465	31%	0.309	S	S	.	.			trans	-91.3	114.2	178.8	-172.8	167.1	-175.9	167.2	0	110.8	K369 F382 E383	K367-K369 PolarHBondContact O-N 3.1Å; K367-F382 WeakPolarHBondContact O-CA 3.37Å; K367-E383 VanDerWaalsContact CB-OE1 3.28Å; K367-E383 WeakPolarHBondContact CB-OE1 3.35Å; K367-E383 PolarHBondContact N-OE1 3.3Å; K367-E383 PolarHBondContact O-N 2.95Å
368	L	97.9	Very high	95.9	Very high	17 Å²	17	61 Å²	61	9%	0.089	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	119.1	162.2	-175.5	66.5	0	0	0	107.8	V348 L351 E352 N355 R370 L380 F382	V348-L368 HydrophobicContact CG1-CD2 4.27Å; V348-L368 HydrophobicContact CG2-CD2 4.49Å; L351-L368 HydrophobicContact CB-CB 4.06Å; L351-L368 HydrophobicContact CB-CD2 3.96Å; L351-L368 HydrophobicContact CD1-CB 4.36Å; L351-L368 HydrophobicContact CD1-CD2 4.31Å; E352-L368 HydrophobicContact CG-CD2 4.26Å; N355-L368 PolarHBondContact OD1-N 2.84Å; L368-R370 WeakPolarHBondContact CD1-O 3.43Å; L368-L380 HydrophobicContact CD1-CB 3.78Å; L368-L380 HydrophobicContact CD1-CD2 4.2Å; L368-L380 HydrophobicContact CD1-CG 4.09Å; L368-F382 HydrophobicContact CB-CD1 4.47Å; L368-F382 HydrophobicContact CB-CE1 4.27Å; L368-F382 HydrophobicContact CD1-CD1 4.34Å; L368-F382 HydrophobicContact CD1-CE1 3.97Å; L368-F382 HydrophobicContact CD1-CZ 4.07Å
369	K	96.9	Very high	96.2	Very high	66 Å²	66	60.6 Å²	60.6	29%	0.287	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-45	175	-73.6	172.6	171.9	-88	0	111.1	E325 V329 K367 V381	E325-K369 IonicContact OE2-NZ 2.68Å; E325-K369 PolarHBondContact OE2-NZ 3.37Å; V329-K369 HydrophobicContact CG1-CD 3.82Å; K367-K369 PolarHBondContact O-N 3.1Å; K369-V381 HydrophobicContact CB-CB 4.38Å; K369-V381 HydrophobicContact CB-CG1 4.21Å; K369-V381 HydrophobicContact CD-CG1 4.2Å; K369-V381 PolarHBondContact N-O 2.72Å
370	R	97.3	Very high	96.8	Very high	69 Å²	69	56.3 Å²	56.3	26%	0.26	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	174.2	173.4	61.9	-164.6	78.7	80	1.7	110.7	R302 Y303 D322 E325 L368 V381	R302-R370 VanDerWaalsContact NH2-CZ 3.26Å; Y303-R370 VanDerWaalsContact OH-CD 3.24Å; Y303-R370 WeakPolarHBondContact OH-CD 3.4Å; Y303-R370 PolarHBondContact OH-NH1 3.24Å; D322-R370 IonicContact OD2-CZ 3.68Å; D322-R370 IonicContact OD2-NH1 3.59Å; D322-R370 PolarHBondContact OD2-NH1 3.45Å; E325-R370 IonicContact OE1-CZ 3.65Å; E325-R370 IonicContact OE1-NH2 3.65Å; E325-R370 PolarHBondContact OE1-NH2 3.32Å; L368-R370 WeakPolarHBondContact CD1-O 3.43Å; R370-V381 HydrophobicContact CG-CB 4.27Å; R370-V381 HydrophobicContact CG-CG2 4.14Å; R370-V381 PolarHBondContact O-N 2.98Å
371	H	98.5	Very high	97.2	Very high	82 Å²	82	49.7 Å²	49.7	38%	0.38	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.5	167.7	70.8	84.6	0	0	0	110.8	V348 L378 C379 L380	V348-H371 VanDerWaalsContact CG1-CD2 3.46Å; V348-H371 WeakPolarHBondContact CG1-CD2 3.39Å; V348-H371 HydrophobicContact CG2-CB 4.24Å; H371-L378 HydrophobicContact CB-CD1 4.34Å; H371-C379 CarbonylContact C-O 3.56Å; H371-C379 WeakPolarHBondContact CA-O 3.46Å; H371-C379 WeakPolarHBondContact CB-O 3.28Å; H371-L380 HydrophobicContact CB-CG 4.32Å
372	F	98.5	Very high	97.7	Very high	24 Å²	24	46.7 Å²	46.7	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	165.7	176.3	59.2	-90.7	0	0	0	111.7	F299 L300 Y303 W374 C379 V381	F299-F372 HydrophobicContact CB-CE2 4.29Å; F299-F372 HydrophobicContact CB-CZ 4.35Å; F299-F372 HydrophobicContact CD2-CE2 4.11Å; F299-F372 HydrophobicContact CD2-CZ 4.17Å; L300-F372 HydrophobicContact CD1-CB 4.19Å; L300-F372 HydrophobicContact CD1-CD1 4.31Å; L300-F372 HydrophobicContact CD1-CD2 3.58Å; L300-F372 HydrophobicContact CD1-CE2 3.93Å; L300-F372 HydrophobicContact CD1-CG 3.79Å; L300-F372 HydrophobicContact CD1-CZ 4.42Å; L300-F372 HydrophobicContact CG-CD2 4.34Å; L300-F372 HydrophobicContact CG-CE2 4.38Å; Y303-F372 AromaticContact CD2-CE1 3.79Å; Y303-F372 HydrophobicContact CD2-CE1 3.79Å; Y303-F372 AromaticContact CD2-CZ 3.67Å; Y303-F372 HydrophobicContact CD2-CZ 3.67Å; Y303-F372 HydrophobicContact CE2-CD1 4.07Å; Y303-F372 AromaticContact CE2-CE1 3.27Å; Y303-F372 HydrophobicContact CE2-CE1 3.27Å; Y303-F372 AromaticContact CE2-CZ 3.65Å; Y303-F372 HydrophobicContact CE2-CZ 3.65Å; Y303-F372 AromaticContact CZ-CE1 3.86Å; F372-W374 HydrophobicContact CD2-CB 4.01Å; F372-W374 HydrophobicContact CE2-CB 3.8Å; F372-C379 HydrophobicContact CD1-CB 4.35Å; F372-C379 HydrophobicContact CD2-CB 4Å; F372-C379 HydrophobicContact CE1-CB 4.09Å; F372-C379 HydrophobicContact CE2-CB 3.73Å; F372-C379 HydrophobicContact CG-CB 4.31Å; F372-C379 HydrophobicContact CZ-CB 3.78Å; F372-C379 PolarHBondContact N-O 3.08Å; F372-C379 PolarHBondContact O-N 2.71Å; F372-V381 HydrophobicContact CD1-CG2 4.07Å; F372-V381 HydrophobicContact CE1-CG2 3.52Å
373	M	98.2	Very high	97.9	Very high	97 Å²	97	43.8 Å²	43.8	48%	0.478	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.8	172.5	-173.4	61.1	56.3	0	0	109.2	L341 N376 H377 L378	L341-M373 HydrophobicContact CD1-CE 4.12Å; M373-N376 VanDerWaalsContact SD-C 3.53Å; M373-H377 WeakPolarHBondContact CA-O 3.42Å; M373-L378 HydrophobicContact CE-CB 4.03Å; M373-L378 HydrophobicContact CE-CD1 4.49Å
374	W	97.9	Very high	98	Very high	45 Å²	45	42.3 Å²	42.3	17%	0.17	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	119	176.6	178.1	-103.6	0	0	0	110	Y291 F299 L300 F372 N376 H377	Y291-W374 AromaticContact CZ-NE1 3.91Å; Y291-W374 PolarHBondContact OH-NE1 3.08Å; F299-W374 HydrophobicContact CB-CD2 4.12Å; F299-W374 HydrophobicContact CB-CE3 4.43Å; F299-W374 HydrophobicContact CB-CG 4.48Å; F299-W374 HydrophobicContact CB-CZ2 4.37Å; F299-W374 AromaticContact CD1-CD1 3.92Å; F299-W374 HydrophobicContact CD1-CD2 4.35Å; F299-W374 AromaticContact CD1-CE2 3.6Å; F299-W374 AromaticContact CD1-CZ2 3.92Å; F299-W374 HydrophobicContact CD1-CZ2 3.92Å; F299-W374 AromaticContact CD1-NE1 3.3Å; F299-W374 VanDerWaalsContact CD1-NE1 3.3Å; F299-W374 HydrophobicContact CD2-CB 4.46Å; F299-W374 AromaticContact CD2-CD1 3.66Å; F299-W374 HydrophobicContact CD2-CD2 4.39Å; F299-W374 AromaticContact CD2-CG 3.95Å; F299-W374 HydrophobicContact CD2-CG 3.95Å; F299-W374 AromaticContact CD2-NE1 3.92Å; F299-W374 AromaticContact CE1-CD1 3.89Å; F299-W374 AromaticContact CE1-NE1 3.35Å; F299-W374 AromaticContact CE2-CD1 3.61Å; F299-W374 HydrophobicContact CE2-CG 4.29Å; F299-W374 AromaticContact CE2-NE1 3.96Å; F299-W374 AromaticContact CG-CD1 3.82Å; F299-W374 HydrophobicContact CG-CD2 4.04Å; F299-W374 AromaticContact CG-CE2 3.75Å; F299-W374 HydrophobicContact CG-CG 4.07Å; F299-W374 HydrophobicContact CG-CZ2 4.29Å; F299-W374 AromaticContact CG-NE1 3.61Å; F299-W374 AromaticContact CZ-CD1 3.73Å; F299-W374 AromaticContact CZ-NE1 3.69Å; L300-W374 HydrophobicContact CD2-CE3 3.89Å; L300-W374 HydrophobicContact CD2-CZ3 3.94Å; L300-W374 HydrophobicContact CG-CE3 4.09Å; L300-W374 HydrophobicContact CG-CZ3 4.24Å; L300-W374 VanDerWaalsContact N-CZ3 3.34Å; F372-W374 HydrophobicContact CD2-CB 4.01Å; F372-W374 HydrophobicContact CE2-CB 3.8Å; W374-N376 VanDerWaalsContact C-N 3.28Å; W374-N376 PolarHBondContact O-N 3.18Å; W374-H377 PolarHBondContact N-O 3.06Å; W374-H377 WeakPolarHBondContact O-CB 3.44Å; W374-H377 PolarHBondContact O-N 3.37Å
375	R	97	Very high	98	Very high	74 Å²	74	40 Å²	40	28%	0.279	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.3	51.4	179.9	-62.3	176	176.1	165.3	1.3	112.1	N281 Y284 Y291 E297 H377	N281-R375 PolarHBondContact ND2-O 2.89Å; Y284-R375 HydrophobicContact CD2-CB 4.26Å; Y284-R375 HydrophobicContact CD2-CG 4.27Å; Y284-R375 VanDerWaalsContact CE1-NH1 3.3Å; Y284-R375 HydrophobicContact CE2-CG 4.32Å; Y284-R375 HydrophobicContact CG-CB 4.5Å; Y291-R375 HydrophobicContact CE2-CB 4.26Å; Y291-R375 PolarHBondContact OH-NH1 3.18Å; E297-R375 IonicContact OE1-CZ 3.39Å; E297-R375 IonicContact OE1-NH1 2.72Å; E297-R375 PolarHBondContact OE1-NH1 3.47Å; E297-R375 IonicContact OE1-NH2 3.72Å; E297-R375 IonicContact OE2-NH1 2.74Å; R375-H377 PolarHBondContact O-CD2 3.3Å; R375-H377 PolarHBondContact O-N 3.17Å
376	N	97.6	Very high	97.9	Very high	95 Å²	95	41.6 Å²	41.6	51%	0.508	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	5.1	-177.4	-57.4	-48.3	0	0	0	117.3	N281 M373 W374	N281-N376 PolarHBondContact OD1-ND2 3.49Å; M373-N376 VanDerWaalsContact SD-C 3.53Å; W374-N376 VanDerWaalsContact C-N 3.28Å; W374-N376 PolarHBondContact O-N 3.18Å
377	H	98.5	Very high	97.7	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.009	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	134.6	167.7	-64.5	-89	0	0	0	112	D285 Y291 I333 I334 M373 W374 R375	D285-H377 IonicContact OD1-CD2 3.95Å; D285-H377 IonicContact OD1-CE1 3.95Å; D285-H377 IonicContact OD1-NE2 2.64Å; D285-H377 PolarHBondContact OD1-NE2 3.23Å; D285-H377 IonicContact OD2-NE2 2.86Å; Y291-H377 AromaticContact CD2-CD2 3.54Å; Y291-H377 AromaticContact CD2-NE2 3.63Å; Y291-H377 PolarHBondContact N-CE1 2.87Å; I333-H377 HydrophobicContact CG2-CB 3.71Å; I334-H377 PolarHBondContact O-ND1 3.28Å; M373-H377 WeakPolarHBondContact CA-O 3.42Å; W374-H377 PolarHBondContact N-O 3.06Å; W374-H377 WeakPolarHBondContact O-CB 3.44Å; W374-H377 PolarHBondContact O-N 3.37Å; R375-H377 PolarHBondContact O-CD2 3.3Å; R375-H377 PolarHBondContact O-N 3.17Å
378	L	98.6	Very high	97.7	Very high	11 Å²	11	40.5 Å²	40.5	6%	0.058	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122.8	164.6	177.8	61.2	0	0	0	108.8	I334 L341 A344 Q345 H371 M373 L380	I334-L378 HydrophobicContact CB-CB 4.36Å; I334-L378 VanDerWaalsContact CB-O 3.32Å; I334-L378 WeakPolarHBondContact CB-O 3.23Å; I334-L378 HydrophobicContact CG1-CB 4.49Å; I334-L378 VanDerWaalsContact CG1-O 3.31Å; I334-L378 WeakPolarHBondContact CG1-O 3.4Å; I334-L378 PolarHBondContact N-O 2.89Å; L341-L378 HydrophobicContact CD1-CB 3.67Å; L341-L378 HydrophobicContact CD1-CD2 3.81Å; L341-L378 HydrophobicContact CD1-CG 4.33Å; A344-L378 HydrophobicContact CB-CD2 3.88Å; Q345-L378 HydrophobicContact CG-CD2 4.33Å; H371-L378 HydrophobicContact CB-CD1 4.34Å; M373-L378 HydrophobicContact CE-CB 4.03Å; M373-L378 HydrophobicContact CE-CD1 4.49Å; L378-L380 HydrophobicContact CD2-CD1 4.17Å; L378-L380 HydrophobicContact CG-CD1 3.85Å
379	C	98.7	Very high	97.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.6	-179.6	-67.7	0	0	0	0	109.8	I331 K332 H371 F372	I331-C379 HydrophobicContact CG2-CB 3.93Å; K332-C379 WeakPolarHBondContact O-CA 3.14Å; H371-C379 CarbonylContact C-O 3.56Å; H371-C379 WeakPolarHBondContact CA-O 3.46Å; H371-C379 WeakPolarHBondContact CB-O 3.28Å; F372-C379 HydrophobicContact CD1-CB 4.35Å; F372-C379 HydrophobicContact CD2-CB 4Å; F372-C379 HydrophobicContact CE1-CB 4.09Å; F372-C379 HydrophobicContact CE2-CB 3.73Å; F372-C379 HydrophobicContact CG-CB 4.31Å; F372-C379 HydrophobicContact CZ-CB 3.78Å; F372-C379 PolarHBondContact N-O 3.08Å; F372-C379 PolarHBondContact O-N 2.71Å
380	L	98.7	Very high	97.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.2	174.2	-72.2	70.3	0	0	0	108.9	I331 K332 I334 E347 V348 L351 L368 H371 L378 F382	I331-L380 CarbonylContact C-O 3.59Å; I331-L380 WeakPolarHBondContact CA-O 3.42Å; K332-L380 HydrophobicContact CB-CB 4.3Å; K332-L380 PolarHBondContact N-O 2.75Å; K332-L380 PolarHBondContact O-N 3.18Å; I334-L380 HydrophobicContact CD1-CD1 4.48Å; I334-L380 HydrophobicContact CG1-CD1 3.95Å; E347-L380 HydrophobicContact CG-CD2 4.32Å; V348-L380 HydrophobicContact CG2-CD1 4.1Å; V348-L380 HydrophobicContact CG2-CD2 3.72Å; V348-L380 HydrophobicContact CG2-CG 3.77Å; L351-L380 HydrophobicContact CD1-CD2 4.2Å; L368-L380 HydrophobicContact CD1-CB 3.78Å; L368-L380 HydrophobicContact CD1-CD2 4.2Å; L368-L380 HydrophobicContact CD1-CG 4.09Å; H371-L380 HydrophobicContact CB-CG 4.32Å; L378-L380 HydrophobicContact CD2-CD1 4.17Å; L378-L380 HydrophobicContact CG-CD1 3.85Å; L380-F382 HydrophobicContact CB-CD2 4.28Å; L380-F382 HydrophobicContact CB-CE2 3.49Å; L380-F382 VanDerWaalsContact CB-CE2 3.49Å; L380-F382 HydrophobicContact CB-CZ 3.9Å; L380-F382 HydrophobicContact CD2-CE2 4.17Å; L380-F382 HydrophobicContact CD2-CZ 3.8Å
381	V	98.6	Very high	97.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.9	-179.7	-172.1	0	0	0	0	109.6	Y303 V329 I331 K369 R370 F372	Y303-V381 HydrophobicContact CE1-CG1 4.03Å; Y303-V381 HydrophobicContact CE1-CG2 4.08Å; V329-V381 HydrophobicContact CB-CG1 3.83Å; V329-V381 HydrophobicContact CG1-CG1 4.07Å; V329-V381 HydrophobicContact CG2-CG1 3.94Å; I331-V381 HydrophobicContact CG1-CG1 4.47Å; I331-V381 HydrophobicContact CG1-CG2 4.34Å; K369-V381 HydrophobicContact CB-CB 4.38Å; K369-V381 HydrophobicContact CB-CG1 4.21Å; K369-V381 HydrophobicContact CD-CG1 4.2Å; K369-V381 PolarHBondContact N-O 2.72Å; R370-V381 HydrophobicContact CG-CB 4.27Å; R370-V381 HydrophobicContact CG-CG2 4.14Å; R370-V381 PolarHBondContact O-N 2.98Å; F372-V381 HydrophobicContact CD1-CG2 4.07Å; F372-V381 HydrophobicContact CE1-CG2 3.52Å
382	F	98.6	Very high	97.7	Very high	17 Å²	17	35.3 Å²	35.3	8%	0.075	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	163.1	-178.8	-63.3	-84.9	0	0	0	111.8	V329 A330 K332 L351 V366 K367 L368 L380	V329-F382 WeakPolarHBondContact CB-O 3.32Å; A330-F382 HydrophobicContact CB-CB 4.45Å; A330-F382 PolarHBondContact N-O 2.87Å; A330-F382 VanDerWaalsContact N-O 3.14Å; A330-F382 PolarHBondContact O-N 3.39Å; K332-F382 HydrophobicContact CB-CD2 4.37Å; K332-F382 HydrophobicContact CB-CE2 3.82Å; K332-F382 HydrophobicContact CD-CE2 4.27Å; L351-F382 HydrophobicContact CD1-CE1 3.63Å; L351-F382 HydrophobicContact CD1-CZ 3.78Å; L351-F382 HydrophobicContact CD2-CE1 4.34Å; V366-F382 HydrophobicContact CG1-CD1 4.01Å; V366-F382 HydrophobicContact CG1-CE1 3.94Å; V366-F382 HydrophobicContact CG2-CB 4.29Å; V366-F382 HydrophobicContact CG2-CD1 3.8Å; V366-F382 HydrophobicContact CG2-CG 4.39Å; K367-F382 WeakPolarHBondContact O-CA 3.37Å; L368-F382 HydrophobicContact CB-CD1 4.47Å; L368-F382 HydrophobicContact CB-CE1 4.27Å; L368-F382 HydrophobicContact CD1-CD1 4.34Å; L368-F382 HydrophobicContact CD1-CE1 3.97Å; L368-F382 HydrophobicContact CD1-CZ 4.07Å; L380-F382 HydrophobicContact CB-CD2 4.28Å; L380-F382 HydrophobicContact CB-CE2 3.49Å; L380-F382 VanDerWaalsContact CB-CE2 3.49Å; L380-F382 HydrophobicContact CB-CZ 3.9Å; L380-F382 HydrophobicContact CD2-CE2 4.17Å; L380-F382 HydrophobicContact CD2-CZ 3.8Å
383	E	97.4	Very high	97.6	Very high	43 Å²	43	34.1 Å²	34.1	20%	0.201	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	139.5	159.1	71.5	-165.3	122.7	0	0	110.7	V366 K367 L385 K448	V366-E383 HydrophobicContact CG2-CG 4.12Å; K367-E383 VanDerWaalsContact CB-OE1 3.28Å; K367-E383 WeakPolarHBondContact CB-OE1 3.35Å; K367-E383 PolarHBondContact N-OE1 3.3Å; K367-E383 PolarHBondContact O-N 2.95Å; E383-L385 HydrophobicContact CG-CD2 3.87Å; E383-L385 HydrophobicContact CG-CG 4.15Å; E383-L385 PolarHBondContact O-N 2.82Å; E383-K448 WeakPolarHBondContact OE1-CD 3.46Å; E383-K448 VanDerWaalsContact OE1-CE 3.23Å; E383-K448 WeakPolarHBondContact OE1-CE 3.42Å; E383-K448 IonicContact OE1-NZ 3.52Å; E383-K448 PolarHBondContact OE1-NZ 3.01Å; E383-K448 VanDerWaalsContact OE2-CE 3.23Å; E383-K448 WeakPolarHBondContact OE2-CE 3.41Å; E383-K448 IonicContact OE2-NZ 2.84Å; E383-K448 PolarHBondContact OE2-NZ 3.45Å
384	L	97.9	Very high	97.5	Very high	61 Å²	61	35.5 Å²	35.5	32%	0.319	16%	0.163	S	C	.	.	P	Polyproline II helix	trans	-77.1	116.7	174.7	-178.3	63.5	0	0	0	109.7	I309 K319 H328 A330	I309-L384 HydrophobicContact CD1-CD1 3.92Å; K319-L384 HydrophobicContact CD-CD2 4.23Å; K319-L384 HydrophobicContact CG-CD2 4.19Å; H328-L384 HydrophobicContact CB-CD2 3.72Å; A330-L384 HydrophobicContact CB-CD1 4.08Å
385	L	97.8	Very high	97.4	Very high	26 Å²	26	38.4 Å²	38.4	14%	0.136	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-96.9	172.6	173.2	-59.5	178	0	0	0	111.2	V366 E383 L438 K448 V450	V366-L385 HydrophobicContact CG2-CD1 4.03Å; E383-L385 HydrophobicContact CG-CD2 3.87Å; E383-L385 HydrophobicContact CG-CG 4.15Å; E383-L385 PolarHBondContact O-N 2.82Å; L385-L438 HydrophobicContact CB-CB 3.98Å; L385-L438 HydrophobicContact CB-CD2 3.89Å; L385-L438 HydrophobicContact CD1-CB 3.84Å; L385-L438 HydrophobicContact CD1-CD2 4.24Å; L385-K448 HydrophobicContact CD1-CB 3.82Å; L385-K448 HydrophobicContact CD1-CD 4.36Å; L385-K448 HydrophobicContact CD2-CD 3.79Å; L385-V450 HydrophobicContact CD1-CG1 3.89Å
386	S	96.3	Very high	97.4	Very high	33 Å²	33	36.4 Å²	36.4	23%	0.231	18%	0.177	C	C	.	.			trans	-92.8	-163.7	174.9	-156	0	0	0	0	111.6	L438 L439 P442	S386-L438 WeakPolarHBondContact O-CD2 3.41Å; S386-L439 WeakPolarHBondContact CA-O 3.19Å; S386-L439 WeakPolarHBondContact CB-O 3.38Å; S386-L439 PolarHBondContact N-O 3.4Å; S386-P442 WeakPolarHBondContact OG-CD 3.44Å
387	Y	92.9	Very high	97.4	Very high	61 Å²	61	38.1 Å²	38.1	24%	0.239	19%	0.186	C	C	.	.			trans	-63.5	155.5	-176.6	62.3	-93.4	0	0	0	113.2	D391 L392 L439 P442	Y387-D391 HydrophobicContact CD2-CB 3.91Å; Y387-D391 HydrophobicContact CG-CB 4.27Å; Y387-L392 HydrophobicContact CD2-CB 4.3Å; Y387-L392 HydrophobicContact CE2-CB 3.83Å; Y387-L392 HydrophobicContact CE2-CD1 3.95Å; Y387-L392 HydrophobicContact CE2-CG 4.42Å; Y387-L439 HydrophobicContact CD2-CD1 3.95Å; Y387-L439 HydrophobicContact CE1-CD1 4.16Å; Y387-L439 HydrophobicContact CE2-CD1 3.37Å; Y387-L439 VanDerWaalsContact CZ-CD1 3.47Å; Y387-L439 PolarHBondContact O-N 2.63Å; Y387-P442 HydrophobicContact CD1-CB 4.18Å; Y387-P442 HydrophobicContact CE1-CB 3.57Å; Y387-P442 PolarHBondContact OH-O 3.04Å
388	N	97.7	Very high	97.3	Very high	28 Å²	28	42 Å²	42	15%	0.15	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-84.4	170.4	-178	62.2	64.2	0	0	0	112.5	Y390 D391 L392 E435 I437 L438	N388-Y390 VanDerWaalsContact C-N 3.27Å; N388-Y390 PolarHBondContact O-N 2.73Å; N388-Y390 WeakPolarHBondContact OD1-CA 3.44Å; N388-Y390 VanDerWaalsContact OD1-CB 3.32Å; N388-Y390 WeakPolarHBondContact OD1-CB 3.38Å; N388-Y390 PolarHBondContact OD1-N 3.26Å; N388-D391 VanDerWaalsContact CG-OD2 3.24Å; N388-D391 PolarHBondContact N-OD2 2.63Å; N388-D391 PolarHBondContact ND2-OD2 3.15Å; N388-D391 WeakPolarHBondContact O-CB 3.12Å; N388-D391 PolarHBondContact O-N 2.78Å; N388-D391 VanDerWaalsContact O-N 3.14Å; N388-D391 PolarHBondContact OD1-N 2.88Å; N388-D391 PolarHBondContact OD1-OD2 3.23Å; N388-L392 PolarHBondContact O-N 3.43Å; N388-E435 WeakPolarHBondContact CB-O 3.48Å; N388-I437 CarbonylContact C-O 3.52Å; N388-I437 VanDerWaalsContact CA-O 3.27Å; N388-I437 WeakPolarHBondContact CA-O 3.44Å; N388-I437 WeakPolarHBondContact CB-O 3.28Å; N388-L438 HydrophobicContact CB-CD1 3.74Å; N388-L438 HydrophobicContact CB-CG 3.99Å
389	L	98.4	Very high	97.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.7	-21.8	-178.4	-64.5	-170.9	0	0	0	113.7	L392 L393 F409 P434 I437 L439 I447 M498	L389-L392 HydrophobicContact CD2-CD2 3.9Å; L389-L392 WeakPolarHBondContact O-CB 3.43Å; L389-L392 PolarHBondContact O-N 3.29Å; L389-L393 PolarHBondContact O-N 3.3Å; L389-F409 HydrophobicContact CD1-CD2 4.32Å; L389-F409 HydrophobicContact CD1-CG 4.37Å; L389-F409 HydrophobicContact CD2-CD1 4.44Å; L389-F409 HydrophobicContact CD2-CD2 4.33Å; L389-F409 HydrophobicContact CD2-CE1 3.96Å; L389-F409 HydrophobicContact CD2-CE2 3.81Å; L389-F409 HydrophobicContact CD2-CZ 3.61Å; L389-P434 HydrophobicContact CB-CB 3.96Å; L389-P434 WeakPolarHBondContact CB-O 3.34Å; L389-P434 PolarHBondContact N-O 3.32Å; L389-I437 HydrophobicContact CD1-CB 3.88Å; L389-I437 HydrophobicContact CD1-CD1 4.21Å; L389-I437 HydrophobicContact CD1-CG2 3.55Å; L389-I437 HydrophobicContact CG-CB 4.01Å; L389-I437 HydrophobicContact CG-CG2 3.85Å; L389-I437 PolarHBondContact N-O 2.84Å; L389-L439 HydrophobicContact CD2-CD2 4.2Å; L389-L439 HydrophobicContact CD2-CG 4.43Å; L389-I447 HydrophobicContact CD2-CG2 4.32Å; L389-M498 HydrophobicContact CB-CE 3.94Å; L389-M498 HydrophobicContact CB-SD 3.73Å; L389-M498 HydrophobicContact CD1-CE 4.35Å; L389-M498 HydrophobicContact CD1-SD 4.17Å; L389-M498 HydrophobicContact CD2-CE 4.25Å; L389-M498 HydrophobicContact CG-CE 4.41Å; L389-M498 HydrophobicContact CG-SD 4.49Å
390	Y	97.6	Very high	97.3	Very high	69 Å²	69	48.7 Å²	48.7	27%	0.271	23%	0.228	S	C	.	.	H	α-helix	trans	-72	-35.1	170	-174.5	-105.5	0	0	0	112.1	N388 L393 R394 F398 P434 E435	N388-Y390 VanDerWaalsContact C-N 3.27Å; N388-Y390 PolarHBondContact O-N 2.73Å; N388-Y390 WeakPolarHBondContact OD1-CA 3.44Å; N388-Y390 VanDerWaalsContact OD1-CB 3.32Å; N388-Y390 WeakPolarHBondContact OD1-CB 3.38Å; N388-Y390 PolarHBondContact OD1-N 3.26Å; Y390-L393 PolarHBondContact O-N 3.21Å; Y390-R394 HydrophobicContact CE1-CG 4.31Å; Y390-R394 PolarHBondContact O-N 2.59Å; Y390-F398 AromaticContact CE2-CE1 3.89Å; Y390-F398 HydrophobicContact CE2-CE1 3.89Å; Y390-F398 HydrophobicContact CE2-CZ 4.39Å; Y390-P434 PolarHBondContact N-O 2.94Å; Y390-E435 HydrophobicContact CG-CG 4.29Å
391	D	96.8	Very high	97.2	Very high	35 Å²	35	49.1 Å²	49.1	19%	0.187	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-38.7	170.3	-62.5	-30.7	0	0	0	111.5	Y387 N388 L393 R394 N395	Y387-D391 HydrophobicContact CD2-CB 3.91Å; Y387-D391 HydrophobicContact CG-CB 4.27Å; N388-D391 VanDerWaalsContact CG-OD2 3.24Å; N388-D391 PolarHBondContact N-OD2 2.63Å; N388-D391 PolarHBondContact ND2-OD2 3.15Å; N388-D391 WeakPolarHBondContact O-CB 3.12Å; N388-D391 PolarHBondContact O-N 2.78Å; N388-D391 VanDerWaalsContact O-N 3.14Å; N388-D391 PolarHBondContact OD1-N 2.88Å; N388-D391 PolarHBondContact OD1-OD2 3.23Å; D391-L393 VanDerWaalsContact C-N 3.31Å; D391-L393 PolarHBondContact O-N 3.33Å; D391-R394 WeakPolarHBondContact O-CB 3.32Å; D391-R394 PolarHBondContact O-N 2.89Å; D391-R394 IonicContact OD1-CZ 3.73Å; D391-R394 IonicContact OD1-NE 3.89Å; D391-R394 PolarHBondContact OD1-NE 3.39Å; D391-R394 IonicContact OD1-NH2 2.71Å; D391-R394 PolarHBondContact OD1-NH2 2.75Å; D391-N395 PolarHBondContact O-N 3.48Å; D391-N395 PolarHBondContact O-ND2 3.01Å; D391-N395 PolarHBondContact O-OD1 3.43Å
392	L	97.2	Very high	97.2	Very high	20 Å²	20	51 Å²	51	11%	0.105	24%	0.244	C	C	.	.	H	α-helix	trans	-58.5	-43.9	171.4	-176.5	57.2	0	0	0	111.1	Y387 N388 L389 N395 T396 V401 F409 M498	Y387-L392 HydrophobicContact CD2-CB 4.3Å; Y387-L392 HydrophobicContact CE2-CB 3.83Å; Y387-L392 HydrophobicContact CE2-CD1 3.95Å; Y387-L392 HydrophobicContact CE2-CG 4.42Å; N388-L392 PolarHBondContact O-N 3.43Å; L389-L392 HydrophobicContact CD2-CD2 3.9Å; L389-L392 WeakPolarHBondContact O-CB 3.43Å; L389-L392 PolarHBondContact O-N 3.29Å; L392-N395 WeakPolarHBondContact O-CB 3.5Å; L392-N395 PolarHBondContact O-N 3.07Å; L392-T396 PolarHBondContact O-N 3.28Å; L392-V401 HydrophobicContact CD1-CG1 4.5Å; L392-V401 HydrophobicContact CD2-CG1 3.92Å; L392-V401 HydrophobicContact CG-CG1 3.96Å; L392-F409 HydrophobicContact CD2-CE2 3.68Å; L392-F409 HydrophobicContact CD2-CZ 3.62Å; L392-M498 HydrophobicContact CD2-CE 4.06Å
393	L	97.4	Very high	97.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-42.1	175	-78.8	176.7	0	0	0	112.8	L389 Y390 D391 N395 T396 N397 F398 E497 M498	L389-L393 PolarHBondContact O-N 3.3Å; Y390-L393 PolarHBondContact O-N 3.21Å; D391-L393 VanDerWaalsContact C-N 3.31Å; D391-L393 PolarHBondContact O-N 3.33Å; L393-N395 VanDerWaalsContact C-N 3.3Å; L393-N395 PolarHBondContact O-N 3.46Å; L393-T396 PolarHBondContact O-N 2.76Å; L393-T396 VanDerWaalsContact O-N 3.12Å; L393-T396 PolarHBondContact O-OG1 3.21Å; L393-N397 PolarHBondContact O-N 3.35Å; L393-F398 HydrophobicContact CB-CD1 4.33Å; L393-F398 HydrophobicContact CB-CE1 4.48Å; L393-F398 PolarHBondContact O-N 2.58Å; L393-E497 HydrophobicContact CD1-CG 3.82Å; L393-M498 HydrophobicContact CD1-SD 3.78Å; L393-M498 HydrophobicContact CD2-CE 4.3Å; L393-M498 HydrophobicContact CD2-SD 4.45Å; L393-M498 HydrophobicContact CG-CE 4.03Å; L393-M498 HydrophobicContact CG-SD 3.91Å
394	R	96.7	Very high	97.2	Very high	126 Å²	126	50.7 Å²	50.7	48%	0.475	24%	0.244	S	C	.	.	H	α-helix	trans	-57.3	-42.1	171.3	-79.3	-170.2	-88	-179.3	-12.1	112.1	Y390 D391 T396 N397 F398	Y390-R394 HydrophobicContact CE1-CG 4.31Å; Y390-R394 PolarHBondContact O-N 2.59Å; D391-R394 WeakPolarHBondContact O-CB 3.32Å; D391-R394 PolarHBondContact O-N 2.89Å; D391-R394 IonicContact OD1-CZ 3.73Å; D391-R394 IonicContact OD1-NE 3.89Å; D391-R394 PolarHBondContact OD1-NE 3.39Å; D391-R394 IonicContact OD1-NH2 2.71Å; D391-R394 PolarHBondContact OD1-NH2 2.75Å; R394-T396 VanDerWaalsContact C-N 3.29Å; R394-T396 PolarHBondContact O-N 3.03Å; R394-N397 WeakPolarHBondContact O-CA 3.42Å; R394-N397 PolarHBondContact O-N 3.05Å; R394-F398 HydrophobicContact CB-CZ 4.49Å; R394-F398 HydrophobicContact CG-CE1 4.11Å; R394-F398 HydrophobicContact CG-CE2 3.98Å; R394-F398 HydrophobicContact CG-CZ 3.45Å; R394-F398 VanDerWaalsContact CG-CZ 3.45Å
395	N	96.1	Very high	97.2	Very high	106 Å²	106	49.9 Å²	49.9	57%	0.567	24%	0.24	S	C	*	.	H	α-helix	trans	-67.4	-25.6	177.4	-65.3	-16.3	0	0	0	112.9	D391 L392 L393 N397	D391-N395 PolarHBondContact O-N 3.48Å; D391-N395 PolarHBondContact O-ND2 3.01Å; D391-N395 PolarHBondContact O-OD1 3.43Å; L392-N395 WeakPolarHBondContact O-CB 3.5Å; L392-N395 PolarHBondContact O-N 3.07Å; L393-N395 VanDerWaalsContact C-N 3.3Å; L393-N395 PolarHBondContact O-N 3.46Å; N395-N397 PolarHBondContact O-N 3.3Å
396	T	95.6	Very high	97.2	Very high	32 Å²	32	48.7 Å²	48.7	20%	0.196	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	7.3	167.5	70.4	0	0	0	0	114	L392 L393 R394 F398 R399 G400 V401	L392-T396 PolarHBondContact O-N 3.28Å; L393-T396 PolarHBondContact O-N 2.76Å; L393-T396 VanDerWaalsContact O-N 3.12Å; L393-T396 PolarHBondContact O-OG1 3.21Å; R394-T396 VanDerWaalsContact C-N 3.29Å; R394-T396 PolarHBondContact O-N 3.03Å; T396-F398 PolarHBondContact O-N 3.21Å; T396-R399 VanDerWaalsContact O-CB 3.26Å; T396-R399 WeakPolarHBondContact O-CB 3.45Å; T396-R399 WeakPolarHBondContact O-CG 3.48Å; T396-R399 PolarHBondContact O-N 3.08Å; T396-R399 PolarHBondContact OG1-N 3.44Å; T396-G400 PolarHBondContact OG1-N 3.23Å; T396-V401 HydrophobicContact CG2-CG1 4Å
397	N	97.4	Very high	97.3	Very high	130 Å²	130	48.1 Å²	48.1	70%	0.695	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	36.2	-167.9	-46.7	119.2	0	0	0	113.2	L393 R394 N395 R399	L393-N397 PolarHBondContact O-N 3.35Å; R394-N397 WeakPolarHBondContact O-CA 3.42Å; R394-N397 PolarHBondContact O-N 3.05Å; N395-N397 PolarHBondContact O-N 3.3Å; N397-R399 VanDerWaalsContact C-N 3.25Å; N397-R399 PolarHBondContact O-N 3.47Å
398	F	97.9	Very high	97.6	Very high	83 Å²	83	50.7 Å²	50.7	36%	0.364	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	32.2	-173.1	-56.4	-79	0	0	0	114.2	Y390 L393 R394 T396 G501	Y390-F398 AromaticContact CE2-CE1 3.89Å; Y390-F398 HydrophobicContact CE2-CE1 3.89Å; Y390-F398 HydrophobicContact CE2-CZ 4.39Å; L393-F398 HydrophobicContact CB-CD1 4.33Å; L393-F398 HydrophobicContact CB-CE1 4.48Å; L393-F398 PolarHBondContact O-N 2.58Å; R394-F398 HydrophobicContact CB-CZ 4.49Å; R394-F398 HydrophobicContact CG-CE1 4.11Å; R394-F398 HydrophobicContact CG-CE2 3.98Å; R394-F398 HydrophobicContact CG-CZ 3.45Å; R394-F398 VanDerWaalsContact CG-CZ 3.45Å; T396-F398 PolarHBondContact O-N 3.21Å; F398-G501 WeakPolarHBondContact CB-O 3.21Å; F398-G501 WeakPolarHBondContact CD1-O 3.43Å; F398-G501 WeakPolarHBondContact O-CA 3.44Å
399	R	97.5	Very high	97.6	Very high	152 Å²	152	49.4 Å²	49.4	57%	0.574	23%	0.232	S	C	*	.	S	Bend	trans	-90.4	-8.9	169.3	-63.6	-179.4	173.5	-119.7	-0.9	113.5	T396 N397 R581	T396-R399 VanDerWaalsContact O-CB 3.26Å; T396-R399 WeakPolarHBondContact O-CB 3.45Å; T396-R399 WeakPolarHBondContact O-CG 3.48Å; T396-R399 PolarHBondContact O-N 3.08Å; T396-R399 PolarHBondContact OG1-N 3.44Å; N397-R399 VanDerWaalsContact C-N 3.25Å; N397-R399 PolarHBondContact O-N 3.47Å; R399-R581 PolarHBondContact O-NH2 3.42Å
400	G	97.7	Very high	97.6	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.01	23%	0.232	C	C	.	.			trans	79.9	152.9	178.5	0	0	0	0	0	113.4	T396 M498 R582	T396-G400 PolarHBondContact OG1-N 3.23Å; G400-M498 CarbonylContact C-O 3.48Å; G400-M498 VanDerWaalsContact CA-O 3.28Å; G400-M498 WeakPolarHBondContact CA-O 3.49Å; G400-R582 PolarHBondContact O-NH2 2.85Å
401	V	98.3	Very high	97.7	Very high	9 Å²	9	50.8 Å²	50.8	6%	0.055	24%	0.241	C	C	.	.			trans	-79.6	165.7	177.2	-57.8	0	0	0	0	111.6	L392 T396 L405 F409 M498 H499	L392-V401 HydrophobicContact CD1-CG1 4.5Å; L392-V401 HydrophobicContact CD2-CG1 3.92Å; L392-V401 HydrophobicContact CG-CG1 3.96Å; T396-V401 HydrophobicContact CG2-CG1 4Å; V401-L405 HydrophobicContact CB-CB 4.33Å; V401-L405 HydrophobicContact CB-CD2 4.02Å; V401-L405 HydrophobicContact CB-CG 4.36Å; V401-L405 HydrophobicContact CG1-CD2 4.09Å; V401-L405 HydrophobicContact CG2-CB 4.23Å; V401-L405 HydrophobicContact CG2-CD2 4.41Å; V401-L405 HydrophobicContact CG2-CG 4.25Å; V401-F409 HydrophobicContact CG2-CE2 4.45Å; V401-M498 HydrophobicContact CG1-CE 4.29Å; V401-M498 HydrophobicContact CG2-CB 4.38Å; V401-M498 HydrophobicContact CG2-CE 4.32Å; V401-M498 WeakPolarHBondContact CG2-O 3.45Å; V401-M498 PolarHBondContact N-O 3.18Å; V401-H499 PolarHBondContact O-ND1 3.48Å
402	S	98.2	Very high	97.8	Very high	38 Å²	38	50 Å²	50	27%	0.266	24%	0.236	S	C	.	.			trans	-64.3	155.6	176.7	62.4	0	0	0	0	112.6	N404 L405 T406 H588	S402-N404 PolarHBondContact O-N 3.22Å; S402-L405 PolarHBondContact O-N 3.18Å; S402-L405 VanDerWaalsContact O-N 3.08Å; S402-L405 PolarHBondContact OG-N 2.99Å; S402-T406 PolarHBondContact O-N 2.96Å; S402-T406 PolarHBondContact O-OG1 2.84Å; S402-H588 WeakPolarHBondContact CA-NE2 3.28Å
403	L	98.1	Very high	97.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-33.9	179	-173	60.3	0	0	0	111.4	T406 R407 H499 H588 D592 Y593 F596 F622	L403-T406 WeakPolarHBondContact O-CB 3.26Å; L403-T406 PolarHBondContact O-N 3.14Å; L403-R407 WeakPolarHBondContact O-CB 3.36Å; L403-R407 PolarHBondContact O-N 2.95Å; L403-H499 PolarHBondContact N-CE1 3.07Å; L403-H588 VanDerWaalsContact CB-CD2 3.49Å; L403-H588 WeakPolarHBondContact CB-CD2 3.45Å; L403-H588 PolarHBondContact N-NE2 2.96Å; L403-D592 HydrophobicContact CD2-CB 3.79Å; L403-Y593 HydrophobicContact CD2-CD1 4.31Å; L403-Y593 HydrophobicContact CD2-CE1 4.33Å; L403-F596 HydrophobicContact CD1-CB 4.07Å; L403-F596 HydrophobicContact CD1-CD1 3.72Å; L403-F596 HydrophobicContact CD1-CD2 4.12Å; L403-F596 HydrophobicContact CD1-CE1 4.16Å; L403-F596 HydrophobicContact CD1-CG 3.71Å; L403-F622 HydrophobicContact CD1-CE2 3.86Å; L403-F622 HydrophobicContact CD1-CZ 3.91Å; L403-F622 HydrophobicContact CD2-CE2 4.48Å; L403-F622 HydrophobicContact CG-CE2 4.08Å; L403-F622 HydrophobicContact CG-CZ 4.38Å
404	N	97.3	Very high	97.9	Very high	55 Å²	55	49.1 Å²	49.1	29%	0.294	23%	0.232	S	C	.	.	H	α-helix	trans	-63.9	-36.5	173.4	-72.2	-15.7	0	0	0	113.2	S402 R407 K408	S402-N404 PolarHBondContact O-N 3.22Å; N404-R407 PolarHBondContact OD1-NH1 2.84Å; N404-K408 WeakPolarHBondContact O-CG 3.42Å; N404-K408 PolarHBondContact O-N 3.45Å
405	L	97.7	Very high	98	Very high	44 Å²	44	44.8 Å²	44.8	23%	0.23	22%	0.219	C	C	.	.	H	α-helix	trans	-76.8	-37	174	-176.6	52.9	0	0	0	111.4	V401 S402 R407 K408 F409 S445	V401-L405 HydrophobicContact CB-CB 4.33Å; V401-L405 HydrophobicContact CB-CD2 4.02Å; V401-L405 HydrophobicContact CB-CG 4.36Å; V401-L405 HydrophobicContact CG1-CD2 4.09Å; V401-L405 HydrophobicContact CG2-CB 4.23Å; V401-L405 HydrophobicContact CG2-CD2 4.41Å; V401-L405 HydrophobicContact CG2-CG 4.25Å; S402-L405 PolarHBondContact O-N 3.18Å; S402-L405 VanDerWaalsContact O-N 3.08Å; S402-L405 PolarHBondContact OG-N 2.99Å; L405-R407 VanDerWaalsContact C-N 3.29Å; L405-R407 PolarHBondContact O-N 2.93Å; L405-K408 HydrophobicContact CD1-CB 4.44Å; L405-K408 PolarHBondContact O-N 2.99Å; L405-K408 VanDerWaalsContact O-N 3.11Å; L405-F409 HydrophobicContact CD1-CD2 4.47Å; L405-F409 HydrophobicContact CD1-CE1 4Å; L405-F409 HydrophobicContact CD1-CE2 3.92Å; L405-F409 HydrophobicContact CD1-CZ 3.65Å; L405-F409 HydrophobicContact CD2-CE2 4.07Å; L405-F409 HydrophobicContact CD2-CZ 4.11Å; L405-F409 HydrophobicContact CG-CD2 4.22Å; L405-F409 HydrophobicContact CG-CE2 3.6Å; L405-F409 HydrophobicContact CG-CZ 3.81Å; L405-F409 PolarHBondContact O-N 2.89Å; L405-S445 VanDerWaalsContact CD1-CB 3.47Å
406	T	98.6	Very high	98.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.4	-41.8	171.5	-52.1	0	0	0	0	111.3	S402 L403 K408 F409 A410 L495 H499 F596	S402-T406 PolarHBondContact O-N 2.96Å; S402-T406 PolarHBondContact O-OG1 2.84Å; L403-T406 WeakPolarHBondContact O-CB 3.26Å; L403-T406 PolarHBondContact O-N 3.14Å; T406-K408 PolarHBondContact O-N 2.97Å; T406-F409 PolarHBondContact O-N 2.9Å; T406-A410 VanDerWaalsContact O-CB 3.28Å; T406-A410 WeakPolarHBondContact O-CB 3.44Å; T406-A410 PolarHBondContact O-N 3.44Å; T406-L495 HydrophobicContact CG2-CB 4.32Å; T406-L495 HydrophobicContact CG2-CD2 4.13Å; T406-H499 HydrophobicContact CG2-CB 4.36Å; T406-F596 HydrophobicContact CG2-CE2 3.93Å; T406-F596 HydrophobicContact CG2-CZ 3.82Å
407	R	98.5	Very high	98.3	Very high	22 Å²	22	38.6 Å²	38.6	8%	0.083	19%	0.185	C	C	.	.	H	α-helix	trans	-59.3	-44.6	173.2	-169.3	-175.3	-63.2	114.4	10.8	112.2	L403 N404 L405 A410 Q411 F622 F623	L403-R407 WeakPolarHBondContact O-CB 3.36Å; L403-R407 PolarHBondContact O-N 2.95Å; N404-R407 PolarHBondContact OD1-NH1 2.84Å; L405-R407 VanDerWaalsContact C-N 3.29Å; L405-R407 PolarHBondContact O-N 2.93Å; R407-A410 PolarHBondContact O-N 2.89Å; R407-Q411 WeakPolarHBondContact O-CB 3.24Å; R407-Q411 PolarHBondContact O-N 3.35Å; R407-F622 HydrophobicContact CB-CE1 3.83Å; R407-F622 HydrophobicContact CB-CZ 3.72Å; R407-F622 WeakPolarHBondContact CD-O 3.48Å; R407-F622 HydrophobicContact CG-CD1 4.24Å; R407-F622 HydrophobicContact CG-CE1 3.84Å; R407-F622 HydrophobicContact CG-CZ 4.05Å; R407-F622 PolarHBondContact NE-O 2.69Å; R407-F623 HydrophobicContact CG-CD1 3.87Å; R407-F623 HydrophobicContact CG-CE1 4.15Å
408	K	98.1	Very high	98.3	Very high	114 Å²	114	35.1 Å²	35.1	50%	0.496	17%	0.166	S	C	.	.	H	α-helix	trans	-64.4	-39.1	178.1	-69.4	177.9	-177.7	-177.8	0	112.5	N404 L405 T406 Q412	N404-K408 WeakPolarHBondContact O-CG 3.42Å; N404-K408 PolarHBondContact O-N 3.45Å; L405-K408 HydrophobicContact CD1-CB 4.44Å; L405-K408 PolarHBondContact O-N 2.99Å; L405-K408 VanDerWaalsContact O-N 3.11Å; T406-K408 PolarHBondContact O-N 2.97Å; K408-Q412 WeakPolarHBondContact O-CG 3.27Å; K408-Q412 PolarHBondContact O-N 3.48Å; K408-Q412 PolarHBondContact O-NE2 3.38Å
409	F	98.7	Very high	98.4	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.009	15%	0.151	C	C	.	.	H	α-helix	trans	-69.7	-44.5	173.2	-62.4	-38.8	0	0	0	111.9	L389 L392 V401 L405 T406 Q411 Q412 L413 L439 I447 M498	L389-F409 HydrophobicContact CD1-CD2 4.32Å; L389-F409 HydrophobicContact CD1-CG 4.37Å; L389-F409 HydrophobicContact CD2-CD1 4.44Å; L389-F409 HydrophobicContact CD2-CD2 4.33Å; L389-F409 HydrophobicContact CD2-CE1 3.96Å; L389-F409 HydrophobicContact CD2-CE2 3.81Å; L389-F409 HydrophobicContact CD2-CZ 3.61Å; L392-F409 HydrophobicContact CD2-CE2 3.68Å; L392-F409 HydrophobicContact CD2-CZ 3.62Å; V401-F409 HydrophobicContact CG2-CE2 4.45Å; L405-F409 HydrophobicContact CD1-CD2 4.47Å; L405-F409 HydrophobicContact CD1-CE1 4Å; L405-F409 HydrophobicContact CD1-CE2 3.92Å; L405-F409 HydrophobicContact CD1-CZ 3.65Å; L405-F409 HydrophobicContact CD2-CE2 4.07Å; L405-F409 HydrophobicContact CD2-CZ 4.11Å; L405-F409 HydrophobicContact CG-CD2 4.22Å; L405-F409 HydrophobicContact CG-CE2 3.6Å; L405-F409 HydrophobicContact CG-CZ 3.81Å; L405-F409 PolarHBondContact O-N 2.89Å; T406-F409 PolarHBondContact O-N 2.9Å; F409-Q411 VanDerWaalsContact C-N 3.31Å; F409-Q411 PolarHBondContact O-N 2.9Å; F409-Q412 PolarHBondContact O-N 3.07Å; F409-L413 WeakPolarHBondContact O-CB 3.43Å; F409-L413 VanDerWaalsContact O-CG 3.28Å; F409-L413 WeakPolarHBondContact O-CG 3.43Å; F409-L413 PolarHBondContact O-N 3.43Å; F409-L439 HydrophobicContact CE1-CD2 3.78Å; F409-L439 HydrophobicContact CZ-CD2 3.99Å; F409-I447 HydrophobicContact CD1-CD1 4.29Å; F409-I447 HydrophobicContact CD1-CG2 3.75Å; F409-I447 HydrophobicContact CE1-CG2 3.69Å; F409-M498 HydrophobicContact CD2-CE 4.34Å; F409-M498 HydrophobicContact CE2-CE 4.06Å
410	A	98.8	Very high	98.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-56.5	-43.4	178.2	0	0	0	0	0	112.4	T406 R407 C414 L495 F622 F623	T406-A410 VanDerWaalsContact O-CB 3.28Å; T406-A410 WeakPolarHBondContact O-CB 3.44Å; T406-A410 PolarHBondContact O-N 3.44Å; R407-A410 PolarHBondContact O-N 2.89Å; A410-C414 WeakPolarHBondContact O-CB 3.21Å; A410-C414 PolarHBondContact O-N 2.95Å; A410-C414 PolarHBondContact O-SG 3.36Å; A410-L495 HydrophobicContact CB-CD1 3.48Å; A410-L495 VanDerWaalsContact CB-CD1 3.48Å; A410-L495 HydrophobicContact CB-CD2 3.67Å; A410-L495 HydrophobicContact CB-CG 4.22Å; A410-F622 HydrophobicContact CB-CE1 4.38Å; A410-F623 HydrophobicContact CB-CE1 3.79Å; A410-F623 HydrophobicContact CB-CZ 3.72Å
411	Q	98.6	Very high	98.4	Very high	97 Å²	97	26.2 Å²	26.2	45%	0.453	14%	0.136	S	C	.	.	H	α-helix	trans	-63.7	-49.2	179.5	-167.5	176.8	14.6	0	0	111.8	R407 F409 L413 C414 T415 L618 F623	R407-Q411 WeakPolarHBondContact O-CB 3.24Å; R407-Q411 PolarHBondContact O-N 3.35Å; F409-Q411 VanDerWaalsContact C-N 3.31Å; F409-Q411 PolarHBondContact O-N 2.9Å; Q411-L413 PolarHBondContact O-N 3.07Å; Q411-C414 PolarHBondContact O-N 3.35Å; Q411-T415 PolarHBondContact O-N 3.48Å; Q411-T415 PolarHBondContact O-OG1 2.79Å; Q411-T415 VanDerWaalsContact O-OG1 3.14Å; Q411-L618 HydrophobicContact CG-CD2 4.06Å; Q411-F623 HydrophobicContact CB-CD1 3.91Å; Q411-F623 HydrophobicContact CB-CE1 3.66Å; Q411-F623 HydrophobicContact CB-CZ 4.46Å; Q411-F623 HydrophobicContact CG-CD1 4.24Å; Q411-F623 HydrophobicContact CG-CE1 4.38Å
412	Q	98.6	Very high	98.3	Very high	19 Å²	19	27.9 Å²	27.9	9%	0.089	15%	0.146	C	C	.	.	H	α-helix	trans	-63.1	-41.8	178.6	-69.9	171.8	94.6	0	0	111.9	Y364 K408 F409 T415 A416 S445 I447	Y364-Q412 HydrophobicContact CD1-CB 4.23Å; Y364-Q412 HydrophobicContact CD1-CG 4.18Å; Y364-Q412 HydrophobicContact CD2-CB 4.11Å; Y364-Q412 VanDerWaalsContact CD2-O 3.3Å; Y364-Q412 WeakPolarHBondContact CD2-O 3.21Å; Y364-Q412 HydrophobicContact CE1-CB 4.2Å; Y364-Q412 HydrophobicContact CE1-CG 3.71Å; Y364-Q412 HydrophobicContact CE2-CB 4.07Å; Y364-Q412 HydrophobicContact CE2-CG 4.13Å; Y364-Q412 HydrophobicContact CG-CB 4.19Å; K408-Q412 WeakPolarHBondContact O-CG 3.27Å; K408-Q412 PolarHBondContact O-N 3.48Å; K408-Q412 PolarHBondContact O-NE2 3.38Å; F409-Q412 PolarHBondContact O-N 3.07Å; Q412-T415 PolarHBondContact O-N 3.21Å; Q412-A416 WeakPolarHBondContact O-CB 3.34Å; Q412-A416 PolarHBondContact O-N 3.1Å; Q412-S445 PolarHBondContact NE2-O 2.92Å; Q412-S445 PolarHBondContact OE1-O 3.37Å; Q412-I447 HydrophobicContact CB-CD1 3.83Å; Q412-I447 HydrophobicContact CB-CG1 3.8Å; Q412-I447 HydrophobicContact CG-CG1 4.38Å; Q412-I447 VanDerWaalsContact OE1-N 3.16Å
413	L	98.8	Very high	98.1	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-67.6	-37.7	177.5	-67.4	167.9	0	0	0	112.3	F409 Q411 A416 L417 I437 I447 I449 L491	F409-L413 WeakPolarHBondContact O-CB 3.43Å; F409-L413 VanDerWaalsContact O-CG 3.28Å; F409-L413 WeakPolarHBondContact O-CG 3.43Å; F409-L413 PolarHBondContact O-N 3.43Å; Q411-L413 PolarHBondContact O-N 3.07Å; L413-A416 PolarHBondContact O-N 2.74Å; L413-L417 WeakPolarHBondContact O-CB 3.34Å; L413-L417 WeakPolarHBondContact O-CG 3.22Å; L413-L417 PolarHBondContact O-N 3.16Å; L413-I437 HydrophobicContact CD1-CD1 3.89Å; L413-I437 HydrophobicContact CD2-CD1 3.82Å; L413-I437 HydrophobicContact CD2-CG1 4.08Å; L413-I437 HydrophobicContact CD2-CG2 4.15Å; L413-I447 HydrophobicContact CD1-CD1 4.29Å; L413-I447 HydrophobicContact CD2-CD1 3.73Å; L413-I447 HydrophobicContact CG-CD1 3.65Å; L413-I449 HydrophobicContact CD2-CD1 3.96Å; L413-I449 HydrophobicContact CD2-CG1 3.98Å; L413-L491 HydrophobicContact CB-CD1 3.58Å; L413-L491 HydrophobicContact CB-CD2 4.13Å; L413-L491 HydrophobicContact CD1-CD1 3.43Å; L413-L491 VanDerWaalsContact CD1-CD1 3.43Å; L413-L491 HydrophobicContact CG-CD1 4.09Å
414	C	98.8	Very high	97.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-38.6	173	-64.2	0	0	0	0	111.6	A410 Q411 L417 L418 P614 L618	A410-C414 WeakPolarHBondContact O-CB 3.21Å; A410-C414 PolarHBondContact O-N 2.95Å; A410-C414 PolarHBondContact O-SG 3.36Å; Q411-C414 PolarHBondContact O-N 3.35Å; C414-L417 PolarHBondContact O-N 2.79Å; C414-L418 WeakPolarHBondContact O-CB 3.48Å; C414-L418 PolarHBondContact O-N 3.47Å; C414-P614 WeakPolarHBondContact O-CB 3.21Å; C414-L618 HydrophobicContact CB-CD1 4.45Å; C414-L618 HydrophobicContact CB-CD2 3.68Å; C414-L618 HydrophobicContact CB-CG 3.72Å
415	T	98.6	Very high	97.8	Very high	34 Å²	34	34.8 Å²	34.8	21%	0.209	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-39.7	174.1	-59.4	0	0	0	0	112.2	Y363 Y364 Q411 Q412 L418 F419	Y363-T415 HydrophobicContact CD1-CG2 4.18Å; Y364-T415 HydrophobicContact CD2-CG2 4.26Å; Y364-T415 HydrophobicContact CE2-CG2 3.77Å; Q411-T415 PolarHBondContact O-N 3.48Å; Q411-T415 PolarHBondContact O-OG1 2.79Å; Q411-T415 VanDerWaalsContact O-OG1 3.14Å; Q412-T415 PolarHBondContact O-N 3.21Å; T415-L418 PolarHBondContact O-N 3.47Å; T415-F419 PolarHBondContact O-N 3.01Å
416	A	98.8	Very high	97.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-45.1	175.1	0	0	0	0	0	111.8	Y363 Y364 I365 Q412 L413 L418 F419 L420 I449	Y363-A416 WeakPolarHBondContact O-CA 3.47Å; Y363-A416 WeakPolarHBondContact O-CB 3.36Å; Y364-A416 HydrophobicContact CD2-CB 4.47Å; I365-A416 HydrophobicContact CD1-CB 4.25Å; Q412-A416 WeakPolarHBondContact O-CB 3.34Å; Q412-A416 PolarHBondContact O-N 3.1Å; L413-A416 PolarHBondContact O-N 2.74Å; A416-L418 VanDerWaalsContact C-N 3.33Å; A416-L418 PolarHBondContact O-N 3.41Å; A416-F419 WeakPolarHBondContact O-CB 3.2Å; A416-F419 PolarHBondContact O-N 3.49Å; A416-L420 WeakPolarHBondContact O-CG 3.5Å; A416-L420 PolarHBondContact O-N 3.32Å; A416-I449 HydrophobicContact CB-CD1 3.58Å; A416-I449 HydrophobicContact CB-CG1 4.49Å
417	L	98.8	Very high	97.7	Very high	9 Å²	9	35.1 Å²	35.1	5%	0.047	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-32.1	175.9	-70.1	-179.3	0	0	0	112.7	L413 C414 F419 L420 S421 L432 D487 M488 L491 P614	L413-L417 WeakPolarHBondContact O-CB 3.34Å; L413-L417 WeakPolarHBondContact O-CG 3.22Å; L413-L417 PolarHBondContact O-N 3.16Å; C414-L417 PolarHBondContact O-N 2.79Å; L417-F419 VanDerWaalsContact C-N 3.33Å; L417-L420 HydrophobicContact CD2-CD1 4.18Å; L417-L420 PolarHBondContact O-N 2.99Å; L417-S421 WeakPolarHBondContact O-CB 3.4Å; L417-S421 PolarHBondContact O-N 3.37Å; L417-S421 PolarHBondContact O-OG 2.86Å; L417-L432 HydrophobicContact CD1-CD1 4.33Å; L417-L432 HydrophobicContact CD2-CD1 4.08Å; L417-D487 HydrophobicContact CD1-CB 4.34Å; L417-D487 HydrophobicContact CD2-CB 3.82Å; L417-M488 HydrophobicContact CB-SD 4.42Å; L417-M488 HydrophobicContact CD1-CG 4.4Å; L417-M488 HydrophobicContact CD1-SD 3.53Å; L417-M488 VanDerWaalsContact CD1-SD 3.53Å; L417-L491 HydrophobicContact CD1-CB 4.39Å; L417-L491 HydrophobicContact CD1-CD2 3.98Å; L417-P614 HydrophobicContact CB-CB 4.08Å; L417-P614 HydrophobicContact CB-CG 3.68Å
418	L	98.6	Very high	97.7	Very high	57 Å²	57	34.1 Å²	34.1	30%	0.298	18%	0.179	S	C	.	.	H	α-helix	trans	-61.7	-43.4	171.7	-177.7	60	0	0	0	110.8	C414 T415 A416 S421 T422 P614 L618	C414-L418 WeakPolarHBondContact O-CB 3.48Å; C414-L418 PolarHBondContact O-N 3.47Å; T415-L418 PolarHBondContact O-N 3.47Å; A416-L418 VanDerWaalsContact C-N 3.33Å; A416-L418 PolarHBondContact O-N 3.41Å; L418-S421 WeakPolarHBondContact CA-OG 3.28Å; L418-S421 PolarHBondContact O-N 3.34Å; L418-S421 PolarHBondContact O-OG 2.95Å; L418-T422 PolarHBondContact O-N 3.2Å; L418-P614 HydrophobicContact CB-CB 3.81Å; L418-P614 HydrophobicContact CD1-CB 4.42Å; L418-L618 HydrophobicContact CD2-CD1 3.87Å
419	F	98.5	Very high	97.7	Very high	9 Å²	9	28.7 Å²	28.7	4%	0.039	16%	0.156	C	C	.	.	H	α-helix	trans	-64.3	-45.9	174.9	173.5	-107.1	0	0	0	112.8	M354 A357 D358 Y363 I365 T415 A416 L417 S421 T422 L425	M354-F419 HydrophobicContact CB-CE1 4.07Å; M354-F419 HydrophobicContact CB-CZ 4.44Å; M354-F419 HydrophobicContact CG-CE1 4.18Å; M354-F419 WeakPolarHBondContact O-CZ 3.14Å; A357-F419 HydrophobicContact CB-CE2 3.82Å; A357-F419 HydrophobicContact CB-CZ 3.82Å; D358-F419 HydrophobicContact CB-CE1 4.4Å; D358-F419 HydrophobicContact CB-CE2 4.3Å; D358-F419 HydrophobicContact CB-CZ 3.82Å; Y363-F419 VanDerWaalsContact CB-CG 3.43Å; Y363-F419 HydrophobicContact CD1-CB 3.71Å; Y363-F419 AromaticContact CD1-CD2 3.98Å; Y363-F419 HydrophobicContact CD1-CD2 3.98Å; Y363-F419 HydrophobicContact CD1-CG 4.02Å; Y363-F419 AromaticContact CD2-CD2 3.33Å; Y363-F419 HydrophobicContact CD2-CD2 3.33Å; Y363-F419 AromaticContact CD2-CE2 3.49Å; Y363-F419 HydrophobicContact CD2-CE2 3.49Å; Y363-F419 VanDerWaalsContact CD2-CE2 3.49Å; Y363-F419 AromaticContact CD2-CG 3.91Å; Y363-F419 HydrophobicContact CD2-CG 3.91Å; Y363-F419 HydrophobicContact CD2-CZ 4.18Å; Y363-F419 HydrophobicContact CE1-CB 4.49Å; Y363-F419 HydrophobicContact CE1-CD2 4.4Å; Y363-F419 AromaticContact CE2-CD2 3.83Å; Y363-F419 HydrophobicContact CE2-CD2 3.83Å; Y363-F419 HydrophobicContact CE2-CE2 4.01Å; Y363-F419 HydrophobicContact CG-CB 3.73Å; Y363-F419 HydrophobicContact CG-CD1 4.18Å; Y363-F419 AromaticContact CG-CD2 3.43Å; Y363-F419 HydrophobicContact CG-CD2 3.43Å; Y363-F419 VanDerWaalsContact CG-CD2 3.43Å; Y363-F419 HydrophobicContact CG-CE2 4Å; Y363-F419 AromaticContact CG-CG 3.52Å; Y363-F419 HydrophobicContact CG-CG 3.52Å; I365-F419 HydrophobicContact CD1-CD1 4.39Å; I365-F419 HydrophobicContact CG1-CD1 3.83Å; I365-F419 HydrophobicContact CG1-CE1 3.81Å; T415-F419 PolarHBondContact O-N 3.01Å; A416-F419 WeakPolarHBondContact O-CB 3.2Å; A416-F419 PolarHBondContact O-N 3.49Å; L417-F419 VanDerWaalsContact C-N 3.33Å; F419-S421 PolarHBondContact O-N 2.78Å; F419-S421 VanDerWaalsContact O-N 3.13Å; F419-T422 WeakPolarHBondContact O-CG2 3.08Å; F419-T422 PolarHBondContact O-N 3.45Å; F419-T422 VanDerWaalsContact O-N 3.15Å; F419-L425 HydrophobicContact CD1-CD1 4.11Å; F419-L425 HydrophobicContact CD2-CD1 4.21Å; F419-L425 HydrophobicContact CE1-CD1 3.7Å; F419-L425 HydrophobicContact CE2-CD1 3.82Å; F419-L425 HydrophobicContact CG-CD1 4.36Å; F419-L425 HydrophobicContact CZ-CD1 3.55Å
420	L	98.2	Very high	97.6	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-60	-25.9	174.3	-61.7	-169.8	0	0	0	112.7	M354 I365 A416 L417 N426 I427 H429 F452	M354-L420 HydrophobicContact CG-CD2 4.36Å; M354-L420 HydrophobicContact SD-CD2 3.34Å; M354-L420 WeakPolarHBondContact SD-CD2 3.46Å; I365-L420 HydrophobicContact CD1-CD2 4.01Å; I365-L420 HydrophobicContact CD1-CG 4.46Å; I365-L420 HydrophobicContact CG1-CD2 4.49Å; A416-L420 WeakPolarHBondContact O-CG 3.5Å; A416-L420 PolarHBondContact O-N 3.32Å; L417-L420 HydrophobicContact CD2-CD1 4.18Å; L417-L420 PolarHBondContact O-N 2.99Å; L420-N426 PolarHBondContact O-N 3.34Å; L420-I427 HydrophobicContact CB-CB 4.38Å; L420-I427 HydrophobicContact CD1-CG2 4.48Å; L420-I427 HydrophobicContact CD2-CB 4.29Å; L420-I427 HydrophobicContact CD2-CG2 4.34Å; L420-I427 PolarHBondContact O-N 3.05Å; L420-H429 HydrophobicContact CD1-CB 4.3Å; L420-F452 HydrophobicContact CD1-CE1 4.09Å; L420-F452 HydrophobicContact CD1-CZ 4.46Å; L420-F452 HydrophobicContact CD2-CE1 4.1Å; L420-F452 HydrophobicContact CD2-CZ 4.42Å
421	S	97.4	Very high	97.5	Very high	39 Å²	39	29.2 Å²	29.2	27%	0.273	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	3.6	178.6	75.2	0	0	0	0	116.4	L417 L418 F419 L484	L417-S421 WeakPolarHBondContact O-CB 3.4Å; L417-S421 PolarHBondContact O-N 3.37Å; L417-S421 PolarHBondContact O-OG 2.86Å; L418-S421 WeakPolarHBondContact CA-OG 3.28Å; L418-S421 PolarHBondContact O-N 3.34Å; L418-S421 PolarHBondContact O-OG 2.95Å; F419-S421 PolarHBondContact O-N 2.78Å; F419-S421 VanDerWaalsContact O-N 3.13Å; S421-L484 VanDerWaalsContact CA-CD2 3.45Å
422	T	96.9	Very high	97.5	Very high	43 Å²	43	24.7 Å²	24.7	26%	0.264	14%	0.138	S	C	.	.	S	Bend	trans	-69.1	150.7	174.7	77.4	0	0	0	0	111.2	L418 F419 E424 L425 N426	L418-T422 PolarHBondContact O-N 3.2Å; F419-T422 WeakPolarHBondContact O-CG2 3.08Å; F419-T422 PolarHBondContact O-N 3.45Å; F419-T422 VanDerWaalsContact O-N 3.15Å; T422-E424 WeakPolarHBondContact CB-OE2 3.42Å; T422-E424 PolarHBondContact O-N 3.01Å; T422-E424 VanDerWaalsContact O-N 3.11Å; T422-E424 PolarHBondContact OG1-OE2 3.26Å; T422-L425 PolarHBondContact O-N 2.79Å; T422-L425 VanDerWaalsContact O-N 3.11Å; T422-N426 PolarHBondContact O-N 3.33Å
423	P	93.9	Very high	97.5	Very high	100 Å²	100	24.9 Å²	24.9	65%	0.649	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-30.4	-173.3	-27.7	36.8	0	0	0	115	N426	P423-N426 WeakPolarHBondContact CA-ND2 3.34Å; P423-N426 PolarHBondContact O-ND2 2.87Å
424	E	92.6	Very high	97.5	Very high	135 Å²	135	24.8 Å²	24.8	63%	0.631	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-25.7	-176.2	-47.6	70.4	-148.9	0	0	112.2	T422	T422-E424 WeakPolarHBondContact CB-OE2 3.42Å; T422-E424 PolarHBondContact O-N 3.01Å; T422-E424 VanDerWaalsContact O-N 3.11Å; T422-E424 PolarHBondContact OG1-OE2 3.26Å
425	L	96	Very high	97.4	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-59.1	-179	-64.9	178.4	0	0	0	110.9	M353 M354 A357 F419 T422 I427 Q457	M353-L425 HydrophobicContact CB-CD2 4.17Å; M354-L425 HydrophobicContact CG-CD1 4.23Å; M354-L425 HydrophobicContact CG-CD2 4.22Å; A357-L425 HydrophobicContact CB-CD1 4.45Å; F419-L425 HydrophobicContact CD1-CD1 4.11Å; F419-L425 HydrophobicContact CD2-CD1 4.21Å; F419-L425 HydrophobicContact CE1-CD1 3.7Å; F419-L425 HydrophobicContact CE2-CD1 3.82Å; F419-L425 HydrophobicContact CG-CD1 4.36Å; F419-L425 HydrophobicContact CZ-CD1 3.55Å; T422-L425 PolarHBondContact O-N 2.79Å; T422-L425 VanDerWaalsContact O-N 3.11Å; L425-I427 HydrophobicContact CB-CD1 4.15Å; L425-I427 HydrophobicContact CB-CG1 4.14Å; L425-I427 HydrophobicContact CD2-CD1 4.22Å; L425-I427 PolarHBondContact O-N 3.24Å; L425-Q457 PolarHBondContact O-NE2 3.43Å
426	N	96.4	Very high	97.4	Very high	50 Å²	50	27.1 Å²	27.1	27%	0.267	15%	0.147	S	C	.	.			trans	49	42.1	-176.1	-94.1	-65.9	0	0	0	112.8	L420 T422 P423 Q457 L458	L420-N426 PolarHBondContact O-N 3.34Å; T422-N426 PolarHBondContact O-N 3.33Å; P423-N426 WeakPolarHBondContact CA-ND2 3.34Å; P423-N426 PolarHBondContact O-ND2 2.87Å; N426-Q457 CarbonylContact O-C 3.5Å; N426-Q457 WeakPolarHBondContact O-CA 3.48Å; N426-L458 HydrophobicContact CB-CB 3.99Å; N426-L458 PolarHBondContact O-N 3.33Å
427	I	97.6	Very high	97.4	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.7	-172.8	-66.2	173.1	0	0	0	110.4	L350 M354 L420 L425 F452 Q457	L350-I427 HydrophobicContact CB-CD1 4.39Å; L350-I427 HydrophobicContact CD2-CD1 4.05Å; L350-I427 HydrophobicContact CD2-CG1 4.2Å; M354-I427 HydrophobicContact CE-CD1 4.39Å; M354-I427 HydrophobicContact CG-CD1 3.54Å; M354-I427 HydrophobicContact SD-CD1 3.7Å; L420-I427 HydrophobicContact CB-CB 4.38Å; L420-I427 HydrophobicContact CD1-CG2 4.48Å; L420-I427 HydrophobicContact CD2-CB 4.29Å; L420-I427 HydrophobicContact CD2-CG2 4.34Å; L420-I427 PolarHBondContact O-N 3.05Å; L425-I427 HydrophobicContact CB-CD1 4.15Å; L425-I427 HydrophobicContact CB-CG1 4.14Å; L425-I427 HydrophobicContact CD2-CD1 4.22Å; L425-I427 PolarHBondContact O-N 3.24Å; I427-F452 HydrophobicContact CG2-CD1 4.35Å; I427-F452 HydrophobicContact CG2-CE1 4.29Å; I427-Q457 HydrophobicContact CG1-CG 4.33Å
428	I	98.1	Very high	97.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.3	166.4	-44.8	170	0	0	0	106.9	C430 S455 C456 L458 R461 Y482 L484 I486 D487	I428-C430 WeakPolarHBondContact CG2-SG 3.3Å; I428-S455 VanDerWaalsContact O-CA 3.25Å; I428-S455 WeakPolarHBondContact O-CA 3.47Å; I428-S455 WeakPolarHBondContact O-CB 3.39Å; I428-C456 PolarHBondContact N-O 2.95Å; I428-C456 PolarHBondContact O-N 3.22Å; I428-C456 VanDerWaalsContact O-N 3.07Å; I428-L458 HydrophobicContact CD1-CD1 4.29Å; I428-R461 HydrophobicContact CD1-CG 4.44Å; I428-Y482 HydrophobicContact CD1-CD2 4.08Å; I428-Y482 HydrophobicContact CD1-CE2 3.8Å; I428-L484 HydrophobicContact CG1-CD1 4.2Å; I428-L484 HydrophobicContact CG1-CG 4.02Å; I428-I486 HydrophobicContact CG2-CD1 3.53Å; I428-I486 HydrophobicContact CG2-CG1 3.68Å; I428-D487 WeakPolarHBondContact CG2-OD2 3.48Å
429	H	98.2	Very high	97.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.			trans	-69.3	-36.6	-178.7	-176	-93.8	0	0	0	111.5	L420 D431 L432 I449 V450 F452 S455 D487	L420-H429 HydrophobicContact CD1-CB 4.3Å; H429-D431 PolarHBondContact CE1-O 3.24Å; H429-D431 VanDerWaalsContact ND1-C 3.27Å; H429-D431 PolarHBondContact ND1-N 3.47Å; H429-D431 PolarHBondContact O-N 2.98Å; H429-L432 HydrophobicContact CB-CG 4.18Å; H429-L432 WeakPolarHBondContact ND1-CD2 3.5Å; H429-L432 PolarHBondContact ND1-N 3.23Å; H429-L432 VanDerWaalsContact ND1-N 3.2Å; H429-I449 WeakPolarHBondContact NE2-CG2 3.34Å; H429-V450 PolarHBondContact NE2-O 2.86Å; H429-F452 AromaticContact CD2-CD1 3.82Å; H429-F452 AromaticContact CD2-CE1 3.58Å; H429-F452 AromaticContact CD2-CZ 3.69Å; H429-S455 WeakPolarHBondContact CA-OG 3.2Å; H429-S455 WeakPolarHBondContact O-CA 3.41Å; H429-S455 PolarHBondContact O-OG 3.41Å; H429-D487 PolarHBondContact N-OD2 2.79Å
430	C	97.5	Very high	97.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	65.7	-7.8	173.7	-66.3	0	0	0	0	116.9	I428 S454 I466 Q467 D487	I428-C430 WeakPolarHBondContact CG2-SG 3.3Å; C430-S454 VanDerWaalsContact CB-O 3.23Å; C430-S454 WeakPolarHBondContact CB-O 3.23Å; C430-I466 HydrophobicContact CB-CB 4.34Å; C430-I466 HydrophobicContact CB-CD1 4.27Å; C430-Q467 WeakPolarHBondContact O-CA 3.36Å; C430-Q467 VanDerWaalsContact O-CG 3.28Å; C430-Q467 WeakPolarHBondContact O-CG 3.31Å; C430-Q467 PolarHBondContact O-N 3.39Å; C430-D487 PolarHBondContact N-OD1 3.02Å
431	D	97.2	Very high	97.1	Very high	14 Å²	14	31.3 Å²	31.3	8%	0.075	17%	0.173	C	C	.	.			trans	-147.1	51.9	171.7	-164.2	33.1	0	0	0	113.9	H429 K433 N436 S468	H429-D431 PolarHBondContact CE1-O 3.24Å; H429-D431 VanDerWaalsContact ND1-C 3.27Å; H429-D431 PolarHBondContact ND1-N 3.47Å; H429-D431 PolarHBondContact O-N 2.98Å; D431-K433 IonicContact OD2-NZ 3.81Å; D431-K433 PolarHBondContact OD2-NZ 2.95Å; D431-N436 PolarHBondContact O-ND2 3.08Å; D431-S468 WeakPolarHBondContact OD1-CA 3.33Å; D431-S468 WeakPolarHBondContact OD1-CB 3.27Å; D431-S468 PolarHBondContact OD1-N 2.98Å; D431-S468 PolarHBondContact OD1-OG 3.05Å; D431-S468 PolarHBondContact OD2-OG 3.25Å
432	L	98.6	Very high	96.8	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.18	C	C	.	.			trans	-70.2	129.7	171.1	-81.5	-172.5	0	0	0	111.6	L417 H429 I449 D487 I494	L417-L432 HydrophobicContact CD1-CD1 4.33Å; L417-L432 HydrophobicContact CD2-CD1 4.08Å; H429-L432 HydrophobicContact CB-CG 4.18Å; H429-L432 WeakPolarHBondContact ND1-CD2 3.5Å; H429-L432 PolarHBondContact ND1-N 3.23Å; H429-L432 VanDerWaalsContact ND1-N 3.2Å; L432-I449 HydrophobicContact CD2-CD1 4.27Å; L432-I449 HydrophobicContact CD2-CG2 3.89Å; L432-D487 HydrophobicContact CD1-CB 3.95Å; L432-I494 HydrophobicContact CB-CD1 4.11Å
433	K	98.5	Very high	96.6	Very high	24 Å²	24	39.5 Å²	39.5	10%	0.104	21%	0.206	C	C	.	.			trans	-162.1	160.5	-180	61.9	-174.3	-171.3	-107.3	0	109.8	D431 E435 N436 Y471	D431-K433 IonicContact OD2-NZ 3.81Å; D431-K433 PolarHBondContact OD2-NZ 2.95Å; K433-E435 WeakPolarHBondContact CB-OE2 3.4Å; K433-E435 HydrophobicContact CD-CB 4.31Å; K433-E435 HydrophobicContact CG-CB 4.2Å; K433-E435 WeakPolarHBondContact CG-OE2 3.44Å; K433-E435 PolarHBondContact O-N 3.03Å; K433-N436 WeakPolarHBondContact CE-OD1 3.33Å; K433-N436 HydrophobicContact CG-CB 3.94Å; K433-N436 PolarHBondContact NZ-ND2 3.18Å; K433-N436 PolarHBondContact NZ-OD1 3.09Å; K433-N436 VanDerWaalsContact NZ-OD1 3.15Å; K433-N436 PolarHBondContact O-N 3.05Å; K433-Y471 HydrophobicContact CB-CD2 3.56Å; K433-Y471 HydrophobicContact CB-CE2 3.33Å; K433-Y471 HydrophobicContact CB-CG 4.43Å
434	P	98.6	Very high	96.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-60	-26.5	-179.2	-20.7	32.7	0	0	0	113.8	L389 Y390 N436 Y471 I494 M498	L389-P434 HydrophobicContact CB-CB 3.96Å; L389-P434 WeakPolarHBondContact CB-O 3.34Å; L389-P434 PolarHBondContact N-O 3.32Å; Y390-P434 PolarHBondContact N-O 2.94Å; P434-N436 VanDerWaalsContact C-N 3.33Å; P434-Y471 WeakPolarHBondContact CD-OH 3.46Å; P434-Y471 HydrophobicContact CG-CE1 4.32Å; P434-I494 HydrophobicContact CG-CG1 4.33Å; P434-I494 HydrophobicContact CG-CG2 4.36Å; P434-M498 HydrophobicContact CB-SD 4.48Å
435	E	97.3	Very high	96.8	Very high	71 Å²	71	38.6 Å²	38.6	33%	0.332	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-68.7	-28	174.5	-53.2	95.9	125.9	0	0	113.2	N388 Y390 K433 L438	N388-E435 WeakPolarHBondContact CB-O 3.48Å; Y390-E435 HydrophobicContact CG-CG 4.29Å; K433-E435 WeakPolarHBondContact CB-OE2 3.4Å; K433-E435 HydrophobicContact CD-CB 4.31Å; K433-E435 HydrophobicContact CG-CB 4.2Å; K433-E435 WeakPolarHBondContact CG-OE2 3.44Å; K433-E435 PolarHBondContact O-N 3.03Å; E435-L438 WeakPolarHBondContact O-CD1 3.44Å
436	N	98.3	Very high	96.9	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.064	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-96.3	16.1	-178.2	-74.8	12.5	0	0	0	112.7	D431 K433 P434 V450 D451	D431-N436 PolarHBondContact O-ND2 3.08Å; K433-N436 WeakPolarHBondContact CE-OD1 3.33Å; K433-N436 HydrophobicContact CG-CB 3.94Å; K433-N436 PolarHBondContact NZ-ND2 3.18Å; K433-N436 PolarHBondContact NZ-OD1 3.09Å; K433-N436 VanDerWaalsContact NZ-OD1 3.15Å; K433-N436 PolarHBondContact O-N 3.05Å; P434-N436 VanDerWaalsContact C-N 3.33Å; N436-V450 HydrophobicContact CB-CG2 4.33Å; N436-V450 PolarHBondContact O-N 3.03Å; N436-D451 PolarHBondContact ND2-OD2 2.82Å
437	I	98.8	Very high	97	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	113.2	174.5	-56.2	161	0	0	0	107.4	N388 L389 L413 I447 I494	N388-I437 CarbonylContact C-O 3.52Å; N388-I437 VanDerWaalsContact CA-O 3.27Å; N388-I437 WeakPolarHBondContact CA-O 3.44Å; N388-I437 WeakPolarHBondContact CB-O 3.28Å; L389-I437 HydrophobicContact CD1-CB 3.88Å; L389-I437 HydrophobicContact CD1-CD1 4.21Å; L389-I437 HydrophobicContact CD1-CG2 3.55Å; L389-I437 HydrophobicContact CG-CB 4.01Å; L389-I437 HydrophobicContact CG-CG2 3.85Å; L389-I437 PolarHBondContact N-O 2.84Å; L413-I437 HydrophobicContact CD1-CD1 3.89Å; L413-I437 HydrophobicContact CD2-CD1 3.82Å; L413-I437 HydrophobicContact CD2-CG1 4.08Å; L413-I437 HydrophobicContact CD2-CG2 4.15Å; I437-I447 HydrophobicContact CG2-CB 3.98Å; I437-I447 HydrophobicContact CG2-CD1 3.78Å; I437-I447 HydrophobicContact CG2-CG1 4.48Å; I437-I447 HydrophobicContact CG2-CG2 4.06Å; I437-I494 HydrophobicContact CD1-CD1 4.13Å; I437-I494 HydrophobicContact CD1-CG2 4.27Å
438	L	98.6	Very high	97.1	Very high	34 Å²	34	38.3 Å²	38.3	18%	0.178	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.5	-173.6	-81.3	65.3	0	0	0	111.5	L385 S386 N388 E435 I447 K448 V450	L385-L438 HydrophobicContact CB-CB 3.98Å; L385-L438 HydrophobicContact CB-CD2 3.89Å; L385-L438 HydrophobicContact CD1-CB 3.84Å; L385-L438 HydrophobicContact CD1-CD2 4.24Å; S386-L438 WeakPolarHBondContact O-CD2 3.41Å; N388-L438 HydrophobicContact CB-CD1 3.74Å; N388-L438 HydrophobicContact CB-CG 3.99Å; E435-L438 WeakPolarHBondContact O-CD1 3.44Å; L438-I447 CarbonylContact O-C 3.5Å; L438-I447 WeakPolarHBondContact O-CA 3.31Å; L438-K448 PolarHBondContact N-O 2.74Å; L438-K448 PolarHBondContact O-N 3.49Å; L438-V450 HydrophobicContact CD1-CB 4.5Å; L438-V450 HydrophobicContact CD1-CG1 4.07Å; L438-V450 HydrophobicContact CD1-CG2 3.55Å; L438-V450 HydrophobicContact CD2-CG1 4.33Å
439	L	98.3	Very high	97.1	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	136	171.9	-64.2	169.8	0	0	0	110.2	S386 Y387 L389 F409 N441 A446 I447	S386-L439 WeakPolarHBondContact CA-O 3.19Å; S386-L439 WeakPolarHBondContact CB-O 3.38Å; S386-L439 PolarHBondContact N-O 3.4Å; Y387-L439 HydrophobicContact CD2-CD1 3.95Å; Y387-L439 HydrophobicContact CE1-CD1 4.16Å; Y387-L439 HydrophobicContact CE2-CD1 3.37Å; Y387-L439 VanDerWaalsContact CZ-CD1 3.47Å; Y387-L439 PolarHBondContact O-N 2.63Å; L389-L439 HydrophobicContact CD2-CD2 4.2Å; L389-L439 HydrophobicContact CD2-CG 4.43Å; F409-L439 HydrophobicContact CE1-CD2 3.78Å; F409-L439 HydrophobicContact CZ-CD2 3.99Å; L439-N441 PolarHBondContact O-N 3.18Å; L439-A446 CarbonylContact C-O 3.52Å; L439-A446 WeakPolarHBondContact CA-O 3.23Å; L439-I447 HydrophobicContact CD2-CG2 3.73Å
440	C	96.9	Very high	97.1	Very high	51 Å²	51	39.6 Å²	39.6	35%	0.345	20%	0.201	S	C	.	.	S	Bend	trans	-70.3	-21.4	173.5	-52.6	0	0	0	0	112.3	A446	C440-A446 HydrophobicContact CB-CB 4.16Å; C440-A446 PolarHBondContact N-O 2.86Å
441	N	94.5	Very high	97	Very high	74 Å²	74	40.9 Å²	40.9	40%	0.396	21%	0.208	S	C	.	.	S	Bend	trans	-153.6	137.5	177.5	178.9	-76.4	0	0	0	110	L439 K443 R444	L439-N441 PolarHBondContact O-N 3.18Å; N441-K443 PolarHBondContact O-N 3.41Å; N441-K443 PolarHBondContact OD1-N 2.99Å; N441-R444 HydrophobicContact CB-CB 4.14Å; N441-R444 HydrophobicContact CB-CG 4.07Å; N441-R444 PolarHBondContact O-N 3Å; N441-R444 VanDerWaalsContact O-N 3.14Å
442	P	90.5	Very high	96.9	Very high	64 Å²	64	40.2 Å²	40.2	42%	0.416	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-15.3	-173.1	24.8	-35.8	0	0	0	115.2	S386 Y387	S386-P442 WeakPolarHBondContact OG-CD 3.44Å; Y387-P442 HydrophobicContact CD1-CB 4.18Å; Y387-P442 HydrophobicContact CE1-CB 3.57Å; Y387-P442 PolarHBondContact OH-O 3.04Å
443	K	91.6	Very high	96.6	Very high	190 Å²	190	40.2 Å²	40.2	83%	0.826	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.1	12.4	-178.2	-59.6	-177.3	179.9	-179.5	0	113.3	N441	N441-K443 PolarHBondContact O-N 3.41Å; N441-K443 PolarHBondContact OD1-N 2.99Å
444	R	95.5	Very high	96.3	Very high	179 Å²	179	40.5 Å²	40.5	68%	0.675	21%	0.21	S	C	*	.	S	Bend	trans	-134.3	150.4	-178.2	-56	-69	-73	-86.8	0.5	110.8	N441 A446	N441-R444 HydrophobicContact CB-CB 4.14Å; N441-R444 HydrophobicContact CB-CG 4.07Å; N441-R444 PolarHBondContact O-N 3Å; N441-R444 VanDerWaalsContact O-N 3.14Å; R444-A446 PolarHBondContact O-N 2.96Å
445	S	96.2	Very high	96.1	Very high	38 Å²	38	40.7 Å²	40.7	27%	0.266	21%	0.211	S	C	.	.			trans	-81	8.7	179.9	64.3	0	0	0	0	115	L405 Q412	L405-S445 VanDerWaalsContact CD1-CB 3.47Å; Q412-S445 PolarHBondContact NE2-O 2.92Å; Q412-S445 PolarHBondContact OE1-O 3.37Å
446	A	97.9	Very high	95.9	Very high	39 Å²	39	37.8 Å²	37.8	32%	0.322	20%	0.198	S	C	.	.			trans	-74.3	131.1	179.4	0	0	0	0	0	109.8	L439 C440 R444	L439-A446 CarbonylContact C-O 3.52Å; L439-A446 WeakPolarHBondContact CA-O 3.23Å; C440-A446 HydrophobicContact CB-CB 4.16Å; C440-A446 PolarHBondContact N-O 2.86Å; R444-A446 PolarHBondContact O-N 2.96Å
447	I	98.6	Very high	95.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	159.9	-177.3	51.4	165.3	0	0	0	113.1	Y364 L389 F409 Q412 L413 I437 L438 L439	Y364-I447 WeakPolarHBondContact CD1-O 3.16Å; L389-I447 HydrophobicContact CD2-CG2 4.32Å; F409-I447 HydrophobicContact CD1-CD1 4.29Å; F409-I447 HydrophobicContact CD1-CG2 3.75Å; F409-I447 HydrophobicContact CE1-CG2 3.69Å; Q412-I447 HydrophobicContact CB-CD1 3.83Å; Q412-I447 HydrophobicContact CB-CG1 3.8Å; Q412-I447 HydrophobicContact CG-CG1 4.38Å; Q412-I447 VanDerWaalsContact OE1-N 3.16Å; L413-I447 HydrophobicContact CD1-CD1 4.29Å; L413-I447 HydrophobicContact CD2-CD1 3.73Å; L413-I447 HydrophobicContact CG-CD1 3.65Å; I437-I447 HydrophobicContact CG2-CB 3.98Å; I437-I447 HydrophobicContact CG2-CD1 3.78Å; I437-I447 HydrophobicContact CG2-CG1 4.48Å; I437-I447 HydrophobicContact CG2-CG2 4.06Å; L438-I447 CarbonylContact O-C 3.5Å; L438-I447 WeakPolarHBondContact O-CA 3.31Å; L439-I447 HydrophobicContact CD2-CG2 3.73Å
448	K	98.7	Very high	95.2	Very high	9 Å²	9	41.8 Å²	41.8	4%	0.039	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.4	164.9	-86	161.3	171.3	-89.1	0	111.4	N361 Y364 I365 E383 L385 L438	N361-K448 PolarHBondContact OD1-NZ 3.14Å; Y364-K448 CarbonylContact O-C 3.59Å; Y364-K448 WeakPolarHBondContact O-CA 3.27Å; I365-K448 PolarHBondContact O-NZ 3.33Å; E383-K448 WeakPolarHBondContact OE1-CD 3.46Å; E383-K448 VanDerWaalsContact OE1-CE 3.23Å; E383-K448 WeakPolarHBondContact OE1-CE 3.42Å; E383-K448 IonicContact OE1-NZ 3.52Å; E383-K448 PolarHBondContact OE1-NZ 3.01Å; E383-K448 VanDerWaalsContact OE2-CE 3.23Å; E383-K448 WeakPolarHBondContact OE2-CE 3.41Å; E383-K448 IonicContact OE2-NZ 2.84Å; E383-K448 PolarHBondContact OE2-NZ 3.45Å; L385-K448 HydrophobicContact CD1-CB 3.82Å; L385-K448 HydrophobicContact CD1-CD 4.36Å; L385-K448 HydrophobicContact CD2-CD 3.79Å; L438-K448 PolarHBondContact N-O 2.74Å; L438-K448 PolarHBondContact O-N 3.49Å
449	I	98.8	Very high	94.4	Very high	1 Å²	1	43 Å²	43	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	138.3	172.6	-58.2	177.5	0	0	0	109.2	Y364 V366 L413 A416 H429 L432 F452	Y364-I449 PolarHBondContact O-N 2.98Å; V366-I449 WeakPolarHBondContact CB-O 3.27Å; V366-I449 WeakPolarHBondContact CG1-O 3.49Å; V366-I449 PolarHBondContact N-O 3.04Å; V366-I449 VanDerWaalsContact N-O 3.08Å; L413-I449 HydrophobicContact CD2-CD1 3.96Å; L413-I449 HydrophobicContact CD2-CG1 3.98Å; A416-I449 HydrophobicContact CB-CD1 3.58Å; A416-I449 HydrophobicContact CB-CG1 4.49Å; H429-I449 WeakPolarHBondContact NE2-CG2 3.34Å; L432-I449 HydrophobicContact CD2-CD1 4.27Å; L432-I449 HydrophobicContact CD2-CG2 3.89Å; I449-F452 HydrophobicContact CG2-CE2 4.05Å; I449-F452 HydrophobicContact CG2-CZ 4.06Å
450	V	98	Very high	93.7	Very high	25 Å²	25	48.4 Å²	48.4	15%	0.152	27%	0.265	C	S	.	.			trans	-130.6	169.5	-178.5	-52.7	0	0	0	0	112.2	V366 L385 H429 N436 L438	V366-V450 HydrophobicContact CB-CG1 4.01Å; V366-V450 HydrophobicContact CG1-CB 4.42Å; V366-V450 HydrophobicContact CG1-CG1 4.22Å; V366-V450 HydrophobicContact CG2-CG1 4.26Å; L385-V450 HydrophobicContact CD1-CG1 3.89Å; H429-V450 PolarHBondContact NE2-O 2.86Å; N436-V450 HydrophobicContact CB-CG2 4.33Å; N436-V450 PolarHBondContact O-N 3.03Å; L438-V450 HydrophobicContact CD1-CB 4.5Å; L438-V450 HydrophobicContact CD1-CG1 4.07Å; L438-V450 HydrophobicContact CD1-CG2 3.55Å; L438-V450 HydrophobicContact CD2-CG1 4.33Å
451	D	95.1	Very high	92.9	Very high	28 Å²	28	50.3 Å²	50.3	15%	0.15	27%	0.265	C	S	.	.			trans	67	61.7	171.7	-168	42.3	0	0	0	114.5	K332 N436 G453	K332-D451 IonicContact NZ-OD1 3.96Å; K332-D451 PolarHBondContact NZ-OD1 3.5Å; N436-D451 PolarHBondContact ND2-OD2 2.82Å; D451-G453 PolarHBondContact O-N 2.96Å
452	F	96.2	Very high	91.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-73.4	12.2	172.7	-72.2	-101.2	0	0	0	112.9	E347 L351 M354 I365 L420 I427 H429 I449 S454 S455	E347-F452 HydrophobicContact CG-CB 4.07Å; E347-F452 PolarHBondContact OE1-N 3.38Å; L351-F452 HydrophobicContact CD2-CD2 4.08Å; M354-F452 HydrophobicContact CE-CD1 3.51Å; M354-F452 HydrophobicContact CE-CD2 4.05Å; M354-F452 HydrophobicContact CE-CE1 3.48Å; M354-F452 VanDerWaalsContact CE-CE1 3.48Å; M354-F452 HydrophobicContact CE-CE2 4.05Å; M354-F452 HydrophobicContact CE-CG 3.81Å; M354-F452 HydrophobicContact CE-CZ 3.78Å; M354-F452 HydrophobicContact SD-CD1 4.15Å; M354-F452 HydrophobicContact SD-CE1 3.56Å; M354-F452 VanDerWaalsContact SD-CE1 3.56Å; M354-F452 HydrophobicContact SD-CZ 3.87Å; I365-F452 HydrophobicContact CD1-CZ 4.17Å; I365-F452 HydrophobicContact CG2-CE2 3.82Å; I365-F452 HydrophobicContact CG2-CZ 3.9Å; L420-F452 HydrophobicContact CD1-CE1 4.09Å; L420-F452 HydrophobicContact CD1-CZ 4.46Å; L420-F452 HydrophobicContact CD2-CE1 4.1Å; L420-F452 HydrophobicContact CD2-CZ 4.42Å; I427-F452 HydrophobicContact CG2-CD1 4.35Å; I427-F452 HydrophobicContact CG2-CE1 4.29Å; H429-F452 AromaticContact CD2-CD1 3.82Å; H429-F452 AromaticContact CD2-CE1 3.58Å; H429-F452 AromaticContact CD2-CZ 3.69Å; I449-F452 HydrophobicContact CG2-CE2 4.05Å; I449-F452 HydrophobicContact CG2-CZ 4.06Å; F452-S454 PolarHBondContact O-N 2.71Å; F452-S454 VanDerWaalsContact O-N 3.1Å; F452-S455 VanDerWaalsContact CA-OG 3.28Å; F452-S455 WeakPolarHBondContact CA-OG 3.2Å; F452-S455 WeakPolarHBondContact CD1-OG 3.38Å; F452-S455 WeakPolarHBondContact O-CB 3.34Å; F452-S455 PolarHBondContact O-N 3.12Å; F452-S455 PolarHBondContact O-OG 2.74Å
453	G	91.4	Very high	91.4	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.01	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-63.5	-9.2	176.9	0	0	0	0	0	115	Q343 E347 D451	Q343-G453 WeakPolarHBondContact CG-O 3.23Å; Q343-G453 PolarHBondContact NE2-O 3.46Å; E347-G453 PolarHBondContact OE1-N 2.76Å; D451-G453 PolarHBondContact O-N 2.96Å
454	S	91.8	Very high	91.1	Very high	30 Å²	30	51.7 Å²	51.7	21%	0.21	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-110.1	-3.7	171.3	-59.8	0	0	0	0	114.1	C430 F452	C430-S454 VanDerWaalsContact CB-O 3.23Å; C430-S454 WeakPolarHBondContact CB-O 3.23Å; F452-S454 PolarHBondContact O-N 2.71Å; F452-S454 VanDerWaalsContact O-N 3.1Å
455	S	95.1	Very high	90.8	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.021	25%	0.251	C	S	.	.			trans	-80	157.6	-166.2	-52.7	0	0	0	0	113.6	I428 H429 F452	I428-S455 VanDerWaalsContact O-CA 3.25Å; I428-S455 WeakPolarHBondContact O-CA 3.47Å; I428-S455 WeakPolarHBondContact O-CB 3.39Å; H429-S455 WeakPolarHBondContact CA-OG 3.2Å; H429-S455 WeakPolarHBondContact O-CA 3.41Å; H429-S455 PolarHBondContact O-OG 3.41Å; F452-S455 VanDerWaalsContact CA-OG 3.28Å; F452-S455 WeakPolarHBondContact CA-OG 3.2Å; F452-S455 WeakPolarHBondContact CD1-OG 3.38Å; F452-S455 WeakPolarHBondContact O-CB 3.34Å; F452-S455 PolarHBondContact O-N 3.12Å; F452-S455 PolarHBondContact O-OG 2.74Å
456	C	93.3	Very high	90.7	Very high	10 Å²	10	46.4 Å²	46.4	7%	0.068	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	151.4	175.6	61.3	0	0	0	0	111.8	I428	I428-C456 PolarHBondContact N-O 2.95Å; I428-C456 PolarHBondContact O-N 3.22Å; I428-C456 VanDerWaalsContact O-N 3.07Å
457	Q	92.8	Very high	90.7	Very high	28 Å²	28	44.7 Å²	44.7	13%	0.131	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	149.7	168.7	-60.6	-169.4	-95.1	0	0	110.8	L350 L425 N426 I427 G459 Q460	L350-Q457 HydrophobicContact CD2-CG 3.73Å; L425-Q457 PolarHBondContact O-NE2 3.43Å; N426-Q457 CarbonylContact O-C 3.5Å; N426-Q457 WeakPolarHBondContact O-CA 3.48Å; I427-Q457 HydrophobicContact CG1-CG 4.33Å; Q457-G459 PolarHBondContact O-N 3.06Å; Q457-Q460 HydrophobicContact CB-CB 4.46Å; Q457-Q460 CarbonylContact O-C 3.57Å; Q457-Q460 WeakPolarHBondContact O-CA 3.49Å; Q457-Q460 PolarHBondContact O-N 3.21Å
458	L	89.1	Confident	90.6	Very high	68 Å²	68	46.3 Å²	46.3	36%	0.356	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	138.9	171.5	-166.9	64	0	0	0	110.1	N426 I428 Q460 D483 L484	N426-L458 HydrophobicContact CB-CB 3.99Å; N426-L458 PolarHBondContact O-N 3.33Å; I428-L458 HydrophobicContact CD1-CD1 4.29Å; L458-Q460 PolarHBondContact O-N 2.88Å; L458-D483 HydrophobicContact CD1-CB 3.86Å; L458-L484 HydrophobicContact CB-CD1 4.38Å; L458-L484 HydrophobicContact CD1-CD1 4.2Å; L458-L484 HydrophobicContact CD2-CD1 4.07Å; L458-L484 HydrophobicContact CG-CD1 4.45Å
459	G	83	Confident	90.6	Very high	60 Å²	60	47.2 Å²	47.2	62%	0.619	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.8	-35.8	-170.5	0	0	0	0	0	114.3	Q457 R461	Q457-G459 PolarHBondContact O-N 3.06Å; G459-R461 VanDerWaalsContact C-N 3.27Å; G459-R461 PolarHBondContact O-N 3.46Å
460	Q	84.1	Confident	90.6	Very high	117 Å²	117	50 Å²	50	55%	0.547	25%	0.252	S	S	.	.			trans	-91.5	44.2	177.6	-60.5	-178.3	18.7	0	0	112.1	Q457 L458 I462	Q457-Q460 HydrophobicContact CB-CB 4.46Å; Q457-Q460 CarbonylContact O-C 3.57Å; Q457-Q460 WeakPolarHBondContact O-CA 3.49Å; Q457-Q460 PolarHBondContact O-N 3.21Å; L458-Q460 PolarHBondContact O-N 2.88Å; Q460-I462 PolarHBondContact O-N 2.99Å
461	R	78.5	Confident	90.6	Very high	92 Å²	92	49.2 Å²	49.2	35%	0.347	25%	0.246	S	C	.	.			trans	-81.8	115.3	-175.5	-70.4	172.4	-71.1	-146.9	-4.5	110.9	I428 G459 Y482	I428-R461 HydrophobicContact CD1-CG 4.44Å; G459-R461 VanDerWaalsContact C-N 3.27Å; G459-R461 PolarHBondContact O-N 3.46Å; R461-Y482 VanDerWaalsContact CD-O 3.26Å; R461-Y482 WeakPolarHBondContact CD-O 3.5Å; R461-Y482 HydrophobicContact CG-CE2 4.17Å; R461-Y482 PolarHBondContact NH1-O 3.4Å
462	I	73.3	Confident	90.8	Very high	96 Å²	96	47.9 Å²	47.9	49%	0.492	24%	0.239	S	C	.	.			trans	-98.2	-28.2	-172.7	-48	179.8	0	0	0	112.8	I346 Q460	I346-I462 HydrophobicContact CD1-CD1 4.06Å; Q460-I462 PolarHBondContact O-N 2.99Å
463	Y	81.6	Confident	90.9	Very high	85 Å²	85	47.9 Å²	47.9	33%	0.333	24%	0.239	S	C	.	.			trans	-127.8	131	-162.1	-58.4	-54.2	0	0	0	114.1	Q343 Y482	Q343-Y463 PolarHBondContact OE1-OH 3.22Å; Q343-Y463 VanDerWaalsContact OE1-OH 3.12Å; Y463-Y482 WeakPolarHBondContact O-CE1 3.47Å; Y463-Y482 PolarHBondContact O-OH 3.34Å
464	H	84.8	Confident	91.3	Very high	175 Å²	175	47.9 Å²	47.9	81%	0.81	24%	0.239	S	C	*	.	S	Bend	trans	-87.3	-4.6	173.8	-62.6	-65.9	0	0	0	114.5
465	Y	89.2	Confident	91.6	Very high	100 Å²	100	46.5 Å²	46.5	39%	0.392	23%	0.229	S	C	.	.	S	Bend	trans	-133.3	76.1	-171.7	-172.3	-103.4	0	0	0	110.8	Q72 R472 E510	Q72-Y465 HydrophobicContact CB-CE1 4.06Å; Q72-Y465 VanDerWaalsContact CD-CE1 3.47Å; Q72-Y465 HydrophobicContact CG-CE1 4.23Å; Q72-Y465 PolarHBondContact NE2-O 2.92Å; Y465-R472 PolarHBondContact OH-NH1 3.39Å; Y465-E510 HydrophobicContact CE2-CG 4.45Å
466	I	94.1	Very high	91.7	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.036	23%	0.23	C	C	.	.			trans	-116.5	177.4	-172.4	58.9	174	0	0	0	111.7	C430 R472 V476 Y482 I486	C430-I466 HydrophobicContact CB-CB 4.34Å; C430-I466 HydrophobicContact CB-CD1 4.27Å; I466-R472 VanDerWaalsContact O-CZ 3.26Å; I466-R472 PolarHBondContact O-NE 3.39Å; I466-R472 PolarHBondContact O-NH2 3.11Å; I466-R472 VanDerWaalsContact O-NH2 3.08Å; I466-V476 HydrophobicContact CD1-CG2 4.15Å; I466-V476 HydrophobicContact CG1-CG1 3.79Å; I466-V476 HydrophobicContact CG1-CG2 4.03Å; I466-Y482 HydrophobicContact CD1-CD1 4.27Å; I466-Y482 HydrophobicContact CD1-CD2 3.83Å; I466-Y482 HydrophobicContact CD1-CE1 3.91Å; I466-Y482 HydrophobicContact CD1-CE2 3.43Å; I466-Y482 VanDerWaalsContact CD1-CE2 3.43Å; I466-Y482 HydrophobicContact CD1-CG 4.25Å; I466-Y482 VanDerWaalsContact CD1-CZ 3.49Å; I466-I486 HydrophobicContact CD1-CD1 3.41Å; I466-I486 VanDerWaalsContact CD1-CD1 3.41Å; I466-I486 HydrophobicContact CG1-CD1 4.42Å
467	Q	97.3	Very high	91.9	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.009	23%	0.227	C	C	.	.	S	Bend	trans	60.6	133.3	-177.1	-57.1	173	-64.3	0	0	115.4	C430 R469 Y471 R472 I486 S490	C430-Q467 WeakPolarHBondContact O-CA 3.36Å; C430-Q467 VanDerWaalsContact O-CG 3.28Å; C430-Q467 WeakPolarHBondContact O-CG 3.31Å; C430-Q467 PolarHBondContact O-N 3.39Å; Q467-R469 PolarHBondContact O-N 3.22Å; Q467-Y471 PolarHBondContact NE2-O 2.84Å; Q467-R472 HydrophobicContact CB-CB 3.95Å; Q467-R472 HydrophobicContact CB-CG 4.19Å; Q467-R472 PolarHBondContact O-NE 3.26Å; Q467-R472 PolarHBondContact O-NH2 2.82Å; Q467-I486 HydrophobicContact CG-CD1 4.12Å; Q467-I486 PolarHBondContact NE2-O 3.02Å; Q467-S490 PolarHBondContact NE2-OG 2.74Å
468	S	96.8	Very high	92.2	Very high	35 Å²	35	44.8 Å²	44.8	25%	0.245	22%	0.221	C	C	.	.			trans	-58.7	130.9	168.7	-71.9	0	0	0	0	110.4	D431 F470 Y471 R472	D431-S468 WeakPolarHBondContact OD1-CA 3.33Å; D431-S468 WeakPolarHBondContact OD1-CB 3.27Å; D431-S468 PolarHBondContact OD1-N 2.98Å; D431-S468 PolarHBondContact OD1-OG 3.05Å; D431-S468 PolarHBondContact OD2-OG 3.25Å; S468-F470 VanDerWaalsContact C-N 3.31Å; S468-F470 PolarHBondContact O-N 3.28Å; S468-Y471 PolarHBondContact O-N 2.74Å; S468-R472 PolarHBondContact O-N 2.82Å
469	R	98.2	Very high	92.5	Very high	28 Å²	28	42.5 Å²	42.5	11%	0.106	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-54.6	-38.4	-153.8	-162.1	-172.3	-49.7	104.8	10.5	115.3	C75 Q467 Y471 R472 G507 C508 Q513	C75-R469 PolarHBondContact SG-NH1 3.17Å; Q467-R469 PolarHBondContact O-N 3.22Å; R469-Y471 PolarHBondContact O-N 3.49Å; R469-R472 WeakPolarHBondContact O-CB 3.38Å; R469-R472 PolarHBondContact O-N 2.93Å; R469-G507 WeakPolarHBondContact CD-O 3.48Å; R469-G507 PolarHBondContact NH1-O 3.14Å; R469-C508 PolarHBondContact NH1-O 3.01Å; R469-Q513 HydrophobicContact CG-CB 4.37Å; R469-Q513 HydrophobicContact CG-CG 4.28Å; R469-Q513 PolarHBondContact O-NE2 2.88Å; R469-Q513 VanDerWaalsContact O-NE2 3.09Å; R469-Q513 PolarHBondContact O-OE1 3.11Å
470	F	98.6	Very high	93.1	Very high	60 Å²	60	41.3 Å²	41.3	26%	0.263	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-64.6	-27.5	-178.1	-60	-19.5	0	0	0	113.1	S468 P503 F505 G507 Q513	S468-F470 VanDerWaalsContact C-N 3.31Å; S468-F470 PolarHBondContact O-N 3.28Å; F470-P503 HydrophobicContact CD2-CB 3.88Å; F470-P503 HydrophobicContact CD2-CG 3.91Å; F470-P503 HydrophobicContact CE2-CB 4.39Å; F470-P503 HydrophobicContact CE2-CG 4.06Å; F470-P503 HydrophobicContact CG-CB 4.34Å; F470-F505 WeakPolarHBondContact CA-O 3.35Å; F470-F505 WeakPolarHBondContact CD1-O 3.5Å; F470-G507 WeakPolarHBondContact CE1-O 3.32Å; F470-Q513 PolarHBondContact O-NE2 2.87Å
471	Y	98.8	Very high	93.6	Very high	8 Å²	8	42.9 Å²	42.9	3%	0.031	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-107.1	8.8	-176.4	-35.4	-74.9	0	0	0	112.3	K433 P434 Q467 S468 R469 S490 C493 I494 E497	K433-Y471 HydrophobicContact CB-CD2 3.56Å; K433-Y471 HydrophobicContact CB-CE2 3.33Å; K433-Y471 HydrophobicContact CB-CG 4.43Å; P434-Y471 WeakPolarHBondContact CD-OH 3.46Å; P434-Y471 HydrophobicContact CG-CE1 4.32Å; Q467-Y471 PolarHBondContact NE2-O 2.84Å; S468-Y471 PolarHBondContact O-N 2.74Å; R469-Y471 PolarHBondContact O-N 3.49Å; Y471-S490 PolarHBondContact O-OG 2.96Å; Y471-C493 HydrophobicContact CD1-CB 3.95Å; Y471-I494 HydrophobicContact CD1-CG1 3.85Å; Y471-I494 HydrophobicContact CE1-CG1 4.12Å; Y471-E497 WeakPolarHBondContact CE1-OE2 3.47Å; Y471-E497 PolarHBondContact OH-OE2 3.29Å
472	R	98.8	Very high	94.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.186	C	C	.	.			trans	-77.5	136.3	-178.4	-177.1	179.6	-66.9	167.2	1	111.5	Y465 I466 Q467 S468 R469 V476 L477 W489 E510	Y465-R472 PolarHBondContact OH-NH1 3.39Å; I466-R472 VanDerWaalsContact O-CZ 3.26Å; I466-R472 PolarHBondContact O-NE 3.39Å; I466-R472 PolarHBondContact O-NH2 3.11Å; I466-R472 VanDerWaalsContact O-NH2 3.08Å; Q467-R472 HydrophobicContact CB-CB 3.95Å; Q467-R472 HydrophobicContact CB-CG 4.19Å; Q467-R472 PolarHBondContact O-NE 3.26Å; Q467-R472 PolarHBondContact O-NH2 2.82Å; S468-R472 PolarHBondContact O-N 2.82Å; R469-R472 WeakPolarHBondContact O-CB 3.38Å; R469-R472 PolarHBondContact O-N 2.93Å; R472-V476 HydrophobicContact CG-CB 3.99Å; R472-V476 HydrophobicContact CG-CG1 3.88Å; R472-L477 HydrophobicContact CG-CD2 4.4Å; R472-L477 HydrophobicContact CG-CG 4.09Å; R472-W489 PolarHBondContact O-NE1 3.41Å; R472-E510 IonicContact NH1-OE1 2.72Å
473	S	98.8	Very high	95.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.176	C	C	.	.			trans	-82.3	161.1	-174.8	73.3	0	0	0	0	114.6	E475 V476 L477 W489	S473-E475 WeakPolarHBondContact CB-OE1 3.46Å; S473-E475 PolarHBondContact O-N 3.45Å; S473-E475 PolarHBondContact OG-OE1 2.62Å; S473-V476 PolarHBondContact O-N 2.91Å; S473-L477 PolarHBondContact O-N 3.46Å; S473-L477 VanDerWaalsContact O-N 3.07Å; S473-W489 VanDerWaalsContact CA-CD1 3.46Å
474	P	98.6	Very high	96.3	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-43.4	-179.6	-24.9	35.5	0	0	0	112.6	V476 L477 L478 W489 F606	P474-V476 PolarHBondContact O-N 3.2Å; P474-L477 PolarHBondContact O-N 3.13Å; P474-L478 HydrophobicContact CB-CD1 4.5Å; P474-L478 WeakPolarHBondContact O-CB 3.14Å; P474-L478 VanDerWaalsContact O-CG 3.23Å; P474-L478 WeakPolarHBondContact O-CG 3.15Å; P474-L478 PolarHBondContact O-N 3.31Å; P474-W489 HydrophobicContact CG-CD2 4.4Å; P474-W489 HydrophobicContact CG-CE3 3.97Å; P474-W489 HydrophobicContact CG-CH2 3.46Å; P474-W489 VanDerWaalsContact CG-CH2 3.46Å; P474-W489 HydrophobicContact CG-CZ2 3.94Å; P474-W489 HydrophobicContact CG-CZ3 3.48Å; P474-W489 VanDerWaalsContact CG-CZ3 3.48Å; P474-F606 HydrophobicContact CB-CD1 3.9Å; P474-F606 HydrophobicContact CB-CE1 4.35Å; P474-F606 HydrophobicContact CG-CD1 3.69Å; P474-F606 HydrophobicContact CG-CE1 4.07Å
475	E	98.3	Very high	96.9	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-40.3	179.7	57	-77.6	176.4	0	0	112.8	S473 L478 G479 I480 I486 P608 R611	S473-E475 WeakPolarHBondContact CB-OE1 3.46Å; S473-E475 PolarHBondContact O-N 3.45Å; S473-E475 PolarHBondContact OG-OE1 2.62Å; E475-L478 CarbonylContact O-C 3.58Å; E475-L478 PolarHBondContact O-N 3.14Å; E475-G479 PolarHBondContact O-N 3.16Å; E475-I480 HydrophobicContact CB-CB 3.96Å; E475-I480 HydrophobicContact CB-CD1 4.35Å; E475-I480 PolarHBondContact O-N 3.31Å; E475-I486 HydrophobicContact CG-CG2 4.3Å; E475-I486 WeakPolarHBondContact OE1-CG2 3.23Å; E475-P608 HydrophobicContact CG-CG 4.39Å; E475-R611 IonicContact OE1-CZ 2.78Å; E475-R611 IonicContact OE1-NH1 2.73Å; E475-R611 PolarHBondContact OE1-NH1 2.7Å; E475-R611 IonicContact OE1-NH2 3.79Å; E475-R611 PolarHBondContact OE1-NH2 3.45Å; E475-R611 IonicContact OE2-CZ 3.01Å; E475-R611 IonicContact OE2-NH1 3.74Å; E475-R611 IonicContact OE2-NH2 3.96Å; E475-R611 PolarHBondContact OE2-NH2 3.28Å
476	V	97.9	Very high	97.4	Very high	5 Å²	5	22.5 Å²	22.5	3%	0.03	12%	0.118	C	C	.	.	H	α-helix	trans	-69.4	-40.4	174.7	178.7	0	0	0	0	111.3	I466 R472 S473 P474 L478 G479 Y482 I486	I466-V476 HydrophobicContact CD1-CG2 4.15Å; I466-V476 HydrophobicContact CG1-CG1 3.79Å; I466-V476 HydrophobicContact CG1-CG2 4.03Å; R472-V476 HydrophobicContact CG-CB 3.99Å; R472-V476 HydrophobicContact CG-CG1 3.88Å; S473-V476 PolarHBondContact O-N 2.91Å; P474-V476 PolarHBondContact O-N 3.2Å; V476-L478 VanDerWaalsContact C-N 3.33Å; V476-L478 PolarHBondContact O-N 3.02Å; V476-G479 PolarHBondContact O-N 3.43Å; V476-Y482 HydrophobicContact CG2-CG 4.31Å; V476-I486 HydrophobicContact CG2-CG2 4.04Å
477	L	98.3	Very high	97.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.9	-41.9	173.2	-73.9	167.5	0	0	0	111.5	R472 S473 P474 E510 Q513 M514 I517 K534 F538	R472-L477 HydrophobicContact CG-CD2 4.4Å; R472-L477 HydrophobicContact CG-CG 4.09Å; S473-L477 PolarHBondContact O-N 3.46Å; S473-L477 VanDerWaalsContact O-N 3.07Å; P474-L477 PolarHBondContact O-N 3.13Å; L477-E510 HydrophobicContact CD2-CB 3.9Å; L477-E510 HydrophobicContact CD2-CG 3.93Å; L477-Q513 HydrophobicContact CD1-CB 4.35Å; L477-Q513 HydrophobicContact CD1-CG 3.86Å; L477-Q513 HydrophobicContact CD2-CB 4.41Å; L477-Q513 HydrophobicContact CD2-CG 4.4Å; L477-M514 HydrophobicContact CB-CE 3.74Å; L477-M514 HydrophobicContact CD1-CE 4.03Å; L477-I517 HydrophobicContact CD1-CD1 3.7Å; L477-K534 VanDerWaalsContact O-CD 3.3Å; L477-K534 WeakPolarHBondContact O-CD 3.35Å; L477-K534 WeakPolarHBondContact O-CE 3.24Å; L477-K534 PolarHBondContact O-NZ 3.19Å; L477-F538 WeakPolarHBondContact O-CE2 3.44Å; L477-F538 WeakPolarHBondContact O-CZ 3.37Å
478	L	98	Very high	97.7	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-80.6	-13.2	-178.3	-74.7	172	0	0	0	114.3	P474 E475 V476 I480 M514 L529 A532 H533 K534 F538 F539	P474-L478 HydrophobicContact CB-CD1 4.5Å; P474-L478 WeakPolarHBondContact O-CB 3.14Å; P474-L478 VanDerWaalsContact O-CG 3.23Å; P474-L478 WeakPolarHBondContact O-CG 3.15Å; P474-L478 PolarHBondContact O-N 3.31Å; E475-L478 CarbonylContact O-C 3.58Å; E475-L478 PolarHBondContact O-N 3.14Å; V476-L478 VanDerWaalsContact C-N 3.33Å; V476-L478 PolarHBondContact O-N 3.02Å; L478-I480 VanDerWaalsContact C-N 3.33Å; L478-I480 HydrophobicContact CB-CD1 4.1Å; L478-I480 HydrophobicContact CB-CG1 3.98Å; L478-I480 HydrophobicContact CD1-CD1 4.09Å; L478-M514 HydrophobicContact CD1-CE 4.43Å; L478-M514 HydrophobicContact CD2-CE 4.16Å; L478-M514 HydrophobicContact CG-CE 3.88Å; L478-L529 HydrophobicContact CD1-CD2 4.12Å; L478-L529 HydrophobicContact CD2-CD2 3.95Å; L478-A532 HydrophobicContact CB-CB 3.72Å; L478-A532 HydrophobicContact CD1-CB 4.38Å; L478-A532 HydrophobicContact CD2-CB 4.04Å; L478-A532 HydrophobicContact CG-CB 4.26Å; L478-H533 PolarHBondContact O-N 3.37Å; L478-K534 VanDerWaalsContact O-CB 3.28Å; L478-K534 WeakPolarHBondContact O-CB 3.4Å; L478-K534 PolarHBondContact O-N 2.94Å; L478-F538 HydrophobicContact CD2-CD2 4.1Å; L478-F538 HydrophobicContact CD2-CE2 4.48Å; L478-F539 HydrophobicContact CD2-CE2 4.21Å
479	G	96.1	Very high	97.8	Very high	20 Å²	20	20.7 Å²	20.7	21%	0.206	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	26.2	-179.1	0	0	0	0	0	113.7	E475 V476 H533	E475-G479 PolarHBondContact O-N 3.16Å; V476-G479 PolarHBondContact O-N 3.43Å; G479-H533 PolarHBondContact O-ND1 2.83Å
480	I	95.8	Very high	97.8	Very high	34 Å²	34	19.4 Å²	19.4	17%	0.174	10%	0.101	C	C	.	.			trans	-75.2	159.9	167.8	-51.3	172.1	0	0	0	107.8	E475 L478 L528 A532	E475-I480 HydrophobicContact CB-CB 3.96Å; E475-I480 HydrophobicContact CB-CD1 4.35Å; E475-I480 PolarHBondContact O-N 3.31Å; L478-I480 VanDerWaalsContact C-N 3.33Å; L478-I480 HydrophobicContact CB-CD1 4.1Å; L478-I480 HydrophobicContact CB-CG1 3.98Å; L478-I480 HydrophobicContact CD1-CD1 4.09Å; I480-L528 HydrophobicContact CD1-CB 4.24Å; I480-L528 HydrophobicContact CD1-CD2 4.4Å; I480-A532 HydrophobicContact CD1-CB 4.01Å; I480-A532 HydrophobicContact CG1-CB 3.7Å
481	Q	93.8	Very high	97.8	Very high	151 Å²	151	16.6 Å²	16.6	71%	0.706	9%	0.088	S	C	*	.			trans	-61.9	145.6	167.8	-63.2	-168.3	42.6	0	0	110.7
482	Y	95.6	Very high	97.9	Very high	14 Å²	14	16.2 Å²	16.2	6%	0.055	9%	0.087	C	C	.	.			trans	-129	156.8	-174.6	73.1	-93.6	0	0	0	111.6	I428 R461 Y463 I466 V476 I486	I428-Y482 HydrophobicContact CD1-CD2 4.08Å; I428-Y482 HydrophobicContact CD1-CE2 3.8Å; R461-Y482 VanDerWaalsContact CD-O 3.26Å; R461-Y482 WeakPolarHBondContact CD-O 3.5Å; R461-Y482 HydrophobicContact CG-CE2 4.17Å; R461-Y482 PolarHBondContact NH1-O 3.4Å; Y463-Y482 WeakPolarHBondContact O-CE1 3.47Å; Y463-Y482 PolarHBondContact O-OH 3.34Å; I466-Y482 HydrophobicContact CD1-CD1 4.27Å; I466-Y482 HydrophobicContact CD1-CD2 3.83Å; I466-Y482 HydrophobicContact CD1-CE1 3.91Å; I466-Y482 HydrophobicContact CD1-CE2 3.43Å; I466-Y482 VanDerWaalsContact CD1-CE2 3.43Å; I466-Y482 HydrophobicContact CD1-CG 4.25Å; I466-Y482 VanDerWaalsContact CD1-CZ 3.49Å; V476-Y482 HydrophobicContact CG2-CG 4.31Å; Y482-I486 HydrophobicContact CD2-CD1 3.9Å; Y482-I486 HydrophobicContact CD2-CG2 4.1Å; Y482-I486 HydrophobicContact CE2-CD1 4.24Å; Y482-I486 HydrophobicContact CG-CG2 4.26Å
483	D	96.6	Very high	97.9	Very high	54 Å²	54	16.3 Å²	16.3	29%	0.289	9%	0.088	S	C	.	.			trans	-139.9	-153.4	179.8	56.5	36.7	0	0	0	110.4	L458 A485	L458-D483 HydrophobicContact CD1-CB 3.86Å; D483-A485 PolarHBondContact O-N 3.04Å; D483-A485 WeakPolarHBondContact OD1-CB 3.17Å; D483-A485 PolarHBondContact OD1-N 3.49Å
484	L	97.8	Very high	97.9	Very high	37 Å²	37	16.3 Å²	16.3	19%	0.194	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.1	-178.7	-64.1	81.1	0	0	0	113	S421 I428 L458 I486 D487	S421-L484 VanDerWaalsContact CA-CD2 3.45Å; I428-L484 HydrophobicContact CG1-CD1 4.2Å; I428-L484 HydrophobicContact CG1-CG 4.02Å; L458-L484 HydrophobicContact CB-CD1 4.38Å; L458-L484 HydrophobicContact CD1-CD1 4.2Å; L458-L484 HydrophobicContact CD2-CD1 4.07Å; L458-L484 HydrophobicContact CG-CD1 4.45Å; L484-I486 PolarHBondContact O-N 2.87Å; L484-I486 VanDerWaalsContact O-N 3.14Å; L484-D487 PolarHBondContact O-N 3.4Å
485	A	98.6	Very high	97.9	Very high	14 Å²	14	16.2 Å²	16.2	12%	0.116	9%	0.087	C	C	.	.	H	α-helix	trans	-65.3	-16.3	-179.7	0	0	0	0	0	113.5	D483 D487 M488 W489 P608 R611	D483-A485 PolarHBondContact O-N 3.04Å; D483-A485 WeakPolarHBondContact OD1-CB 3.17Å; D483-A485 PolarHBondContact OD1-N 3.49Å; A485-D487 VanDerWaalsContact C-N 3.27Å; A485-D487 PolarHBondContact O-N 3.01Å; A485-M488 PolarHBondContact O-N 3.34Å; A485-W489 PolarHBondContact O-N 3.3Å; A485-P608 HydrophobicContact CB-CB 3.58Å; A485-R611 WeakPolarHBondContact O-CD 3.5Å; A485-R611 PolarHBondContact O-NH1 2.89Å
486	I	98.8	Very high	97.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64	-34.5	175.7	76.1	177.1	0	0	0	111.9	I428 I466 Q467 E475 V476 Y482 L484 W489 S490	I428-I486 HydrophobicContact CG2-CD1 3.53Å; I428-I486 HydrophobicContact CG2-CG1 3.68Å; I466-I486 HydrophobicContact CD1-CD1 3.41Å; I466-I486 VanDerWaalsContact CD1-CD1 3.41Å; I466-I486 HydrophobicContact CG1-CD1 4.42Å; Q467-I486 HydrophobicContact CG-CD1 4.12Å; Q467-I486 PolarHBondContact NE2-O 3.02Å; E475-I486 HydrophobicContact CG-CG2 4.3Å; E475-I486 WeakPolarHBondContact OE1-CG2 3.23Å; V476-I486 HydrophobicContact CG2-CG2 4.04Å; Y482-I486 HydrophobicContact CD2-CD1 3.9Å; Y482-I486 HydrophobicContact CD2-CG2 4.1Å; Y482-I486 HydrophobicContact CE2-CD1 4.24Å; Y482-I486 HydrophobicContact CG-CG2 4.26Å; L484-I486 PolarHBondContact O-N 2.87Å; L484-I486 VanDerWaalsContact O-N 3.14Å; I486-W489 WeakPolarHBondContact O-CB 3.46Å; I486-W489 PolarHBondContact O-N 2.82Å; I486-S490 PolarHBondContact O-N 3.28Å; I486-S490 PolarHBondContact O-OG 3.41Å
487	D	98.9	Very high	98	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.011	9%	0.086	C	C	.	.	H	α-helix	trans	-78.9	-28.5	-176.5	-70.3	-43.6	0	0	0	111.2	L417 I428 H429 C430 L432 L484 A485 W489 S490 L491	L417-D487 HydrophobicContact CD1-CB 4.34Å; L417-D487 HydrophobicContact CD2-CB 3.82Å; I428-D487 WeakPolarHBondContact CG2-OD2 3.48Å; H429-D487 PolarHBondContact N-OD2 2.79Å; C430-D487 PolarHBondContact N-OD1 3.02Å; L432-D487 HydrophobicContact CD1-CB 3.95Å; L484-D487 PolarHBondContact O-N 3.4Å; A485-D487 VanDerWaalsContact C-N 3.27Å; A485-D487 PolarHBondContact O-N 3.01Å; D487-W489 VanDerWaalsContact C-N 3.33Å; D487-S490 PolarHBondContact O-N 3.19Å; D487-L491 WeakPolarHBondContact O-CB 3.05Å; D487-L491 PolarHBondContact O-N 3.33Å
488	M	98.9	Very high	98	Very high	5 Å²	5	16.1 Å²	16.1	3%	0.025	9%	0.087	C	C	.	.	H	α-helix	trans	-64.9	-36	167.4	-71.7	-57.5	-59.1	0	0	112.1	L417 A485 L491 G492 M603 V612 P614 A617	L417-M488 HydrophobicContact CB-SD 4.42Å; L417-M488 HydrophobicContact CD1-CG 4.4Å; L417-M488 HydrophobicContact CD1-SD 3.53Å; L417-M488 VanDerWaalsContact CD1-SD 3.53Å; A485-M488 PolarHBondContact O-N 3.34Å; M488-L491 HydrophobicContact CE-CD2 4.3Å; M488-L491 PolarHBondContact O-N 3.18Å; M488-L491 HydrophobicContact SD-CD2 4.31Å; M488-G492 PolarHBondContact O-N 3.12Å; M488-M603 HydrophobicContact CE-CE 3.86Å; M488-M603 HydrophobicContact CE-CG 4.04Å; M488-V612 HydrophobicContact CE-CG1 4.13Å; M488-V612 WeakPolarHBondContact CE-O 3.44Å; M488-P614 HydrophobicContact CG-CG 4.33Å; M488-P614 HydrophobicContact SD-CB 4.33Å; M488-P614 HydrophobicContact SD-CG 3.75Å; M488-A617 HydrophobicContact CE-CB 3.97Å
489	W	98.9	Very high	98	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.7	-44.9	171.7	173.5	-78.1	0	0	0	111.7	R472 S473 P474 A485 I486 D487 L491 G492 C493 F505 I517 L521 L604	R472-W489 PolarHBondContact O-NE1 3.41Å; S473-W489 VanDerWaalsContact CA-CD1 3.46Å; P474-W489 HydrophobicContact CG-CD2 4.4Å; P474-W489 HydrophobicContact CG-CE3 3.97Å; P474-W489 HydrophobicContact CG-CH2 3.46Å; P474-W489 VanDerWaalsContact CG-CH2 3.46Å; P474-W489 HydrophobicContact CG-CZ2 3.94Å; P474-W489 HydrophobicContact CG-CZ3 3.48Å; P474-W489 VanDerWaalsContact CG-CZ3 3.48Å; A485-W489 PolarHBondContact O-N 3.3Å; I486-W489 WeakPolarHBondContact O-CB 3.46Å; I486-W489 PolarHBondContact O-N 2.82Å; D487-W489 VanDerWaalsContact C-N 3.33Å; W489-L491 VanDerWaalsContact C-N 3.29Å; W489-L491 PolarHBondContact O-N 3.49Å; W489-G492 PolarHBondContact O-N 2.86Å; W489-C493 PolarHBondContact NE1-SG 3.43Å; W489-C493 PolarHBondContact O-N 3.17Å; W489-C493 VanDerWaalsContact O-N 3.09Å; W489-C493 PolarHBondContact O-SG 2.75Å; W489-F505 HydrophobicContact CH2-CE2 4.36Å; W489-F505 HydrophobicContact CZ2-CD2 4.27Å; W489-F505 AromaticContact CZ2-CE2 3.78Å; W489-F505 HydrophobicContact CZ2-CE2 3.78Å; W489-I517 HydrophobicContact CH2-CD1 4.47Å; W489-I517 HydrophobicContact CH2-CG1 4.5Å; W489-I517 HydrophobicContact CH2-CG2 3.78Å; W489-I517 HydrophobicContact CZ2-CD1 3.82Å; W489-I517 HydrophobicContact CZ2-CG1 4.01Å; W489-I517 HydrophobicContact CZ2-CG2 4.14Å; W489-L521 HydrophobicContact CH2-CD1 3.58Å; W489-L521 HydrophobicContact CZ3-CD1 3.96Å; W489-L604 HydrophobicContact CD2-CD2 3.7Å; W489-L604 HydrophobicContact CE3-CB 4.26Å; W489-L604 HydrophobicContact CE3-CD2 3.79Å; W489-L604 HydrophobicContact CG-CD2 4.21Å; W489-L604 HydrophobicContact CH2-CD2 4.29Å; W489-L604 HydrophobicContact CZ2-CD2 4.21Å; W489-L604 HydrophobicContact CZ3-CB 4.01Å; W489-L604 HydrophobicContact CZ3-CD2 4.1Å; W489-L604 WeakPolarHBondContact CZ3-O 3.48Å
490	S	98.9	Very high	98.2	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-56.3	-45.1	173.2	-66.2	0	0	0	0	111.3	Q467 Y471 I486 D487 G492 C493 I494	Q467-S490 PolarHBondContact NE2-OG 2.74Å; Y471-S490 PolarHBondContact O-OG 2.96Å; I486-S490 PolarHBondContact O-N 3.28Å; I486-S490 PolarHBondContact O-OG 3.41Å; D487-S490 PolarHBondContact O-N 3.19Å; S490-G492 PolarHBondContact O-N 3.09Å; S490-C493 WeakPolarHBondContact O-CB 3.37Å; S490-C493 PolarHBondContact O-N 2.75Å; S490-I494 WeakPolarHBondContact O-CD1 3.31Å; S490-I494 WeakPolarHBondContact O-CG1 3.32Å; S490-I494 PolarHBondContact O-N 3.33Å
491	L	98.9	Very high	98.3	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-59.4	-46.1	176.3	-179.6	58.8	0	0	0	112.3	L413 L417 D487 M488 W489 C493 I494 L495 M603	L413-L491 HydrophobicContact CB-CD1 3.58Å; L413-L491 HydrophobicContact CB-CD2 4.13Å; L413-L491 HydrophobicContact CD1-CD1 3.43Å; L413-L491 VanDerWaalsContact CD1-CD1 3.43Å; L413-L491 HydrophobicContact CG-CD1 4.09Å; L417-L491 HydrophobicContact CD1-CB 4.39Å; L417-L491 HydrophobicContact CD1-CD2 3.98Å; D487-L491 WeakPolarHBondContact O-CB 3.05Å; D487-L491 PolarHBondContact O-N 3.33Å; M488-L491 HydrophobicContact CE-CD2 4.3Å; M488-L491 PolarHBondContact O-N 3.18Å; M488-L491 HydrophobicContact SD-CD2 4.31Å; W489-L491 VanDerWaalsContact C-N 3.29Å; W489-L491 PolarHBondContact O-N 3.49Å; L491-C493 VanDerWaalsContact C-N 3.27Å; L491-C493 PolarHBondContact O-N 3.43Å; L491-I494 PolarHBondContact O-N 2.92Å; L491-L495 HydrophobicContact CD1-CD1 3.88Å; L491-L495 HydrophobicContact CD1-CD2 4.13Å; L491-L495 HydrophobicContact CD1-CG 3.77Å; L491-L495 HydrophobicContact CG-CD1 3.95Å; L491-L495 HydrophobicContact CG-CG 4.26Å; L491-L495 WeakPolarHBondContact O-CG 3.38Å; L491-L495 PolarHBondContact O-N 3.25Å; L491-M603 HydrophobicContact CD2-CE 3.75Å; L491-M603 HydrophobicContact CG-CE 4.05Å; L491-M603 HydrophobicContact CG-SD 4.24Å
492	G	98.9	Very high	98.5	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-57.9	-38.2	175.4	0	0	0	0	0	113.2	M488 W489 S490	M488-G492 PolarHBondContact O-N 3.12Å; W489-G492 PolarHBondContact O-N 2.86Å; S490-G492 PolarHBondContact O-N 3.09Å
493	C	98.9	Very high	98.6	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.014	7%	0.068	C	C	.	.	H	α-helix	trans	-68.1	-46.9	174.3	-61.7	0	0	0	0	112.2	Y471 W489 S490 L491 V496 E497	Y471-C493 HydrophobicContact CD1-CB 3.95Å; W489-C493 PolarHBondContact NE1-SG 3.43Å; W489-C493 PolarHBondContact O-N 3.17Å; W489-C493 VanDerWaalsContact O-N 3.09Å; W489-C493 PolarHBondContact O-SG 2.75Å; S490-C493 WeakPolarHBondContact O-CB 3.37Å; S490-C493 PolarHBondContact O-N 2.75Å; L491-C493 VanDerWaalsContact C-N 3.27Å; L491-C493 PolarHBondContact O-N 3.43Å; C493-V496 PolarHBondContact O-N 2.7Å; C493-E497 PolarHBondContact O-N 3.01Å
494	I	98.9	Very high	98.7	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-60.6	-46.9	-179.1	-70.2	162.8	0	0	0	111.1	L432 P434 I437 Y471 S490 L491 V496 E497 M498	L432-I494 HydrophobicContact CB-CD1 4.11Å; P434-I494 HydrophobicContact CG-CG1 4.33Å; P434-I494 HydrophobicContact CG-CG2 4.36Å; I437-I494 HydrophobicContact CD1-CD1 4.13Å; I437-I494 HydrophobicContact CD1-CG2 4.27Å; Y471-I494 HydrophobicContact CD1-CG1 3.85Å; Y471-I494 HydrophobicContact CE1-CG1 4.12Å; S490-I494 WeakPolarHBondContact O-CD1 3.31Å; S490-I494 WeakPolarHBondContact O-CG1 3.32Å; S490-I494 PolarHBondContact O-N 3.33Å; L491-I494 PolarHBondContact O-N 2.92Å; I494-V496 VanDerWaalsContact C-N 3.31Å; I494-V496 PolarHBondContact O-N 2.89Å; I494-E497 PolarHBondContact O-N 2.82Å; I494-E497 VanDerWaalsContact O-N 3.16Å; I494-M498 HydrophobicContact CG2-CG 4.1Å; I494-M498 WeakPolarHBondContact O-CG 3.41Å; I494-M498 PolarHBondContact O-N 3.19Å
495	L	98.9	Very high	98.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-65.4	-34.1	-175.3	-68.2	176.9	0	0	0	112.9	T406 A410 L491 H499 F596 I600 M603	T406-L495 HydrophobicContact CG2-CB 4.32Å; T406-L495 HydrophobicContact CG2-CD2 4.13Å; A410-L495 HydrophobicContact CB-CD1 3.48Å; A410-L495 VanDerWaalsContact CB-CD1 3.48Å; A410-L495 HydrophobicContact CB-CD2 3.67Å; A410-L495 HydrophobicContact CB-CG 4.22Å; L491-L495 HydrophobicContact CD1-CD1 3.88Å; L491-L495 HydrophobicContact CD1-CD2 4.13Å; L491-L495 HydrophobicContact CD1-CG 3.77Å; L491-L495 HydrophobicContact CG-CD1 3.95Å; L491-L495 HydrophobicContact CG-CG 4.26Å; L491-L495 WeakPolarHBondContact O-CG 3.38Å; L491-L495 PolarHBondContact O-N 3.25Å; L495-H499 PolarHBondContact O-N 3.36Å; L495-F596 HydrophobicContact CB-CE2 4.18Å; L495-F596 HydrophobicContact CB-CZ 4.14Å; L495-I600 HydrophobicContact CB-CD1 3.76Å; L495-I600 HydrophobicContact CD1-CD1 4.19Å; L495-M603 HydrophobicContact CD1-CE 4.04Å; L495-M603 HydrophobicContact CD1-SD 4.01Å
496	V	98.9	Very high	98.7	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-67.4	-47.4	171.9	178.1	0	0	0	0	110.4	C493 I494 M498 H499 T500 L504 L567 I570 L571 I600	C493-V496 PolarHBondContact O-N 2.7Å; I494-V496 VanDerWaalsContact C-N 3.31Å; I494-V496 PolarHBondContact O-N 2.89Å; V496-M498 VanDerWaalsContact C-N 3.32Å; V496-M498 PolarHBondContact O-N 3.16Å; V496-H499 PolarHBondContact O-N 2.83Å; V496-H499 VanDerWaalsContact O-N 3.12Å; V496-T500 HydrophobicContact CG1-CG2 3.82Å; V496-T500 WeakPolarHBondContact O-CG2 3.41Å; V496-T500 PolarHBondContact O-N 3.24Å; V496-T500 PolarHBondContact O-OG1 3.03Å; V496-L504 HydrophobicContact CB-CB 4.4Å; V496-L504 HydrophobicContact CB-CD2 4.28Å; V496-L504 HydrophobicContact CG1-CB 4.23Å; V496-L504 HydrophobicContact CG1-CD1 4.24Å; V496-L504 HydrophobicContact CG1-CD2 4.44Å; V496-L504 HydrophobicContact CG2-CD2 4.2Å; V496-L567 HydrophobicContact CG2-CD1 4.2Å; V496-I570 HydrophobicContact CG1-CG2 4.28Å; V496-L571 HydrophobicContact CG1-CD2 4.2Å; V496-L571 HydrophobicContact CG2-CD2 4.49Å; V496-I600 HydrophobicContact CG2-CB 4.43Å; V496-I600 HydrophobicContact CG2-CD1 4.15Å; V496-I600 HydrophobicContact CG2-CG1 4.02Å; V496-I600 HydrophobicContact CG2-CG2 3.62Å
497	E	98.8	Very high	98.6	Very high	3 Å²	3	10.4 Å²	10.4	1%	0.014	6%	0.059	C	C	.	.	H	α-helix	trans	-59.7	-40.8	178.2	179.2	167.7	170.5	0	0	112.5	L393 Y471 C493 I494 H499 G501 P503	L393-E497 HydrophobicContact CD1-CG 3.82Å; Y471-E497 WeakPolarHBondContact CE1-OE2 3.47Å; Y471-E497 PolarHBondContact OH-OE2 3.29Å; C493-E497 PolarHBondContact O-N 3.01Å; I494-E497 PolarHBondContact O-N 2.82Å; I494-E497 VanDerWaalsContact O-N 3.16Å; E497-H499 VanDerWaalsContact C-N 3.26Å; E497-H499 PolarHBondContact O-N 2.86Å; E497-G501 WeakPolarHBondContact O-CA 3.4Å; E497-G501 PolarHBondContact O-N 3.25Å; E497-P503 WeakPolarHBondContact OE1-CG 3.47Å; E497-P503 WeakPolarHBondContact OE2-CA 3.22Å; E497-P503 VanDerWaalsContact OE2-CB 3.23Å; E497-P503 WeakPolarHBondContact OE2-CB 3.44Å; E497-P503 WeakPolarHBondContact OE2-CG 3.44Å
498	M	98.8	Very high	98.4	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-57.6	-37.9	175.3	-72.6	-48.4	-59.4	0	0	112.5	L389 L392 L393 G400 V401 F409 P434 I494 V496	L389-M498 HydrophobicContact CB-CE 3.94Å; L389-M498 HydrophobicContact CB-SD 3.73Å; L389-M498 HydrophobicContact CD1-CE 4.35Å; L389-M498 HydrophobicContact CD1-SD 4.17Å; L389-M498 HydrophobicContact CD2-CE 4.25Å; L389-M498 HydrophobicContact CG-CE 4.41Å; L389-M498 HydrophobicContact CG-SD 4.49Å; L392-M498 HydrophobicContact CD2-CE 4.06Å; L393-M498 HydrophobicContact CD1-SD 3.78Å; L393-M498 HydrophobicContact CD2-CE 4.3Å; L393-M498 HydrophobicContact CD2-SD 4.45Å; L393-M498 HydrophobicContact CG-CE 4.03Å; L393-M498 HydrophobicContact CG-SD 3.91Å; G400-M498 CarbonylContact C-O 3.48Å; G400-M498 VanDerWaalsContact CA-O 3.28Å; G400-M498 WeakPolarHBondContact CA-O 3.49Å; V401-M498 HydrophobicContact CG1-CE 4.29Å; V401-M498 HydrophobicContact CG2-CB 4.38Å; V401-M498 HydrophobicContact CG2-CE 4.32Å; V401-M498 WeakPolarHBondContact CG2-O 3.45Å; V401-M498 PolarHBondContact N-O 3.18Å; F409-M498 HydrophobicContact CD2-CE 4.34Å; F409-M498 HydrophobicContact CE2-CE 4.06Å; P434-M498 HydrophobicContact CB-SD 4.48Å; I494-M498 HydrophobicContact CG2-CG 4.1Å; I494-M498 WeakPolarHBondContact O-CG 3.41Å; I494-M498 PolarHBondContact O-N 3.19Å; V496-M498 VanDerWaalsContact C-N 3.32Å; V496-M498 PolarHBondContact O-N 3.16Å
499	H	98.8	Very high	98.2	Very high	1 Å²	1	17 Å²	17	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-89.8	-34.1	-177.2	-168.1	47	0	0	0	113.8	V401 L403 T406 L495 V496 E497 H588 Y593 F596	V401-H499 PolarHBondContact O-ND1 3.48Å; L403-H499 PolarHBondContact N-CE1 3.07Å; T406-H499 HydrophobicContact CG2-CB 4.36Å; L495-H499 PolarHBondContact O-N 3.36Å; V496-H499 PolarHBondContact O-N 2.83Å; V496-H499 VanDerWaalsContact O-N 3.12Å; E497-H499 VanDerWaalsContact C-N 3.26Å; E497-H499 PolarHBondContact O-N 2.86Å; H499-H588 AromaticContact CE1-CD2 3.78Å; H499-H588 AromaticContact CE1-NE2 3.86Å; H499-Y593 AromaticContact CD2-CE1 3.81Å; H499-Y593 AromaticContact NE2-CE1 3.27Å; H499-Y593 VanDerWaalsContact NE2-CE1 3.27Å; H499-Y593 WeakPolarHBondContact NE2-CE1 3.18Å; H499-Y593 AromaticContact NE2-CZ 3.52Å; H499-Y593 PolarHBondContact NE2-OH 2.85Å; H499-F596 HydrophobicContact CB-CE1 4.44Å
500	T	98.7	Very high	98.1	Very high	18 Å²	18	17.8 Å²	17.8	11%	0.11	10%	0.103	C	C	.	.	H	α-helix	trans	-85.1	-29.9	179.9	62.7	0	0	0	0	113.4	V496 E502 I570 L571 P578 R581	V496-T500 HydrophobicContact CG1-CG2 3.82Å; V496-T500 WeakPolarHBondContact O-CG2 3.41Å; V496-T500 PolarHBondContact O-N 3.24Å; V496-T500 PolarHBondContact O-OG1 3.03Å; T500-E502 PolarHBondContact OG1-N 2.84Å; T500-E502 PolarHBondContact OG1-O 3.4Å; T500-E502 VanDerWaalsContact OG1-O 3.07Å; T500-I570 HydrophobicContact CG2-CG2 4.25Å; T500-L571 HydrophobicContact CG2-CD2 4.48Å; T500-P578 HydrophobicContact CG2-CB 4.19Å; T500-P578 HydrophobicContact CG2-CG 4.05Å; T500-R581 PolarHBondContact O-NH2 3.09Å
501	G	98.3	Very high	98	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.01	12%	0.115	C	C	.	.	S	Bend	trans	86.5	-1.3	-171.1	0	0	0	0	0	115.7	F398 E497	F398-G501 WeakPolarHBondContact CB-O 3.21Å; F398-G501 WeakPolarHBondContact CD1-O 3.43Å; F398-G501 WeakPolarHBondContact O-CA 3.44Å; E497-G501 WeakPolarHBondContact O-CA 3.4Å; E497-G501 PolarHBondContact O-N 3.25Å
502	E	97.4	Very high	97.8	Very high	95 Å²	95	19.7 Å²	19.7	44%	0.444	12%	0.115	S	C	.	.	S	Bend	trans	-134.8	143.6	176.4	-69.8	-159.8	135.2	0	0	112.7	R78 T500 L504	R78-E502 IonicContact CZ-OE1 2.72Å; R78-E502 IonicContact NH1-OE1 3.83Å; R78-E502 PolarHBondContact NH1-OE1 3.29Å; R78-E502 IonicContact NH2-OE1 3.43Å; R78-E502 PolarHBondContact NH2-OE1 2.86Å; T500-E502 PolarHBondContact OG1-N 2.84Å; T500-E502 PolarHBondContact OG1-O 3.4Å; T500-E502 VanDerWaalsContact OG1-O 3.07Å; E502-L504 PolarHBondContact O-N 2.85Å
503	P	98.6	Very high	97.8	Very high	30 Å²	30	19.7 Å²	19.7	20%	0.195	12%	0.115	C	C	.	.			trans	-57.9	124.6	179.2	-18.8	23	0	0	0	113.8	F470 E497 F505 S506	F470-P503 HydrophobicContact CD2-CB 3.88Å; F470-P503 HydrophobicContact CD2-CG 3.91Å; F470-P503 HydrophobicContact CE2-CB 4.39Å; F470-P503 HydrophobicContact CE2-CG 4.06Å; F470-P503 HydrophobicContact CG-CB 4.34Å; E497-P503 WeakPolarHBondContact OE1-CG 3.47Å; E497-P503 WeakPolarHBondContact OE2-CA 3.22Å; E497-P503 VanDerWaalsContact OE2-CB 3.23Å; E497-P503 WeakPolarHBondContact OE2-CB 3.44Å; E497-P503 WeakPolarHBondContact OE2-CG 3.44Å; P503-F505 VanDerWaalsContact C-N 3.28Å; P503-F505 PolarHBondContact O-N 2.8Å; P503-S506 PolarHBondContact O-OG 3.18Å
504	L	98.6	Very high	97.8	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.021	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-44.3	-179.1	175.4	58.2	0	0	0	112.4	V496 E502 R565 L567 I570 L604	V496-L504 HydrophobicContact CB-CB 4.4Å; V496-L504 HydrophobicContact CB-CD2 4.28Å; V496-L504 HydrophobicContact CG1-CB 4.23Å; V496-L504 HydrophobicContact CG1-CD1 4.24Å; V496-L504 HydrophobicContact CG1-CD2 4.44Å; V496-L504 HydrophobicContact CG2-CD2 4.2Å; E502-L504 PolarHBondContact O-N 2.85Å; L504-R565 PolarHBondContact O-NH1 2.72Å; L504-L567 HydrophobicContact CD1-CD1 4.33Å; L504-I570 HydrophobicContact CD1-CD1 3.83Å; L504-I570 HydrophobicContact CD1-CG2 4.34Å; L504-L604 HydrophobicContact CD2-CD1 3.63Å
505	F	98.6	Very high	97.7	Very high	1 Å²	1	19.8 Å²	19.8	0%	0.004	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124	74.3	-178.1	-54.3	-55	0	0	0	111.4	F470 W489 P503 G507 Q513 K516 I517 V520 L521 L604	F470-F505 WeakPolarHBondContact CA-O 3.35Å; F470-F505 WeakPolarHBondContact CD1-O 3.5Å; W489-F505 HydrophobicContact CH2-CE2 4.36Å; W489-F505 HydrophobicContact CZ2-CD2 4.27Å; W489-F505 AromaticContact CZ2-CE2 3.78Å; W489-F505 HydrophobicContact CZ2-CE2 3.78Å; P503-F505 VanDerWaalsContact C-N 3.28Å; P503-F505 PolarHBondContact O-N 2.8Å; F505-G507 PolarHBondContact O-N 3.43Å; F505-Q513 PolarHBondContact O-NE2 2.74Å; F505-Q513 PolarHBondContact O-OE1 2.64Å; F505-K516 HydrophobicContact CD1-CB 4.4Å; F505-K516 WeakPolarHBondContact CD1-O 3.09Å; F505-I517 HydrophobicContact CB-CG1 4.4Å; F505-I517 HydrophobicContact CD1-CG1 3.94Å; F505-I517 HydrophobicContact CD2-CG1 3.98Å; F505-I517 HydrophobicContact CE1-CB 4.39Å; F505-I517 HydrophobicContact CE1-CG1 4.14Å; F505-I517 HydrophobicContact CE2-CG1 4.17Å; F505-I517 HydrophobicContact CG-CG1 3.86Å; F505-I517 HydrophobicContact CZ-CG1 4.25Å; F505-V520 HydrophobicContact CE1-CB 3.92Å; F505-V520 HydrophobicContact CE1-CG2 3.79Å; F505-L521 HydrophobicContact CZ-CD1 4.42Å; F505-L521 HydrophobicContact CZ-CG 4.47Å; F505-L604 HydrophobicContact CE2-CD1 4.16Å; F505-L604 HydrophobicContact CE2-CD2 4.39Å; F505-L604 HydrophobicContact CZ-CD1 4.29Å
506	S	97.3	Very high	97.6	Very high	55 Å²	55	21.2 Å²	21.2	39%	0.385	12%	0.121	S	C	.	.			trans	-81.1	64.3	-177.4	36	0	0	0	0	114.1	P503 K516	P503-S506 PolarHBondContact O-OG 3.18Å; S506-K516 VanDerWaalsContact O-CE 3.31Å; S506-K516 WeakPolarHBondContact O-CE 3.43Å
507	G	96.8	Very high	97.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.121	C	C	.	.			trans	-82.7	130.3	-178.1	0	0	0	0	0	115.5	R469 F470 F505 N509 D512	R469-G507 WeakPolarHBondContact CD-O 3.48Å; R469-G507 PolarHBondContact NH1-O 3.14Å; F470-G507 WeakPolarHBondContact CE1-O 3.32Å; F505-G507 PolarHBondContact O-N 3.43Å; G507-N509 VanDerWaalsContact C-N 3.34Å; G507-N509 PolarHBondContact O-N 2.96Å; G507-D512 WeakPolarHBondContact CA-OD2 3.34Å
508	C	95.3	Very high	97.6	Very high	74 Å²	74	21.1 Å²	21.1	50%	0.5	12%	0.121	S	C	.	.	S	Bend	trans	-73.8	-22.2	177.6	70.8	0	0	0	0	114	R469 D512	R469-C508 PolarHBondContact NH1-O 3.01Å; C508-D512 PolarHBondContact N-OD2 3.33Å; C508-D512 PolarHBondContact SG-OD2 3.12Å
509	N	95.4	Very high	97.6	Very high	70 Å²	70	22 Å²	22	37%	0.374	13%	0.125	S	C	.	.	S	Bend	trans	-152.7	175.4	175	65.3	62.9	0	0	0	109.9	G507 V511 D512 Q513	G507-N509 VanDerWaalsContact C-N 3.34Å; G507-N509 PolarHBondContact O-N 2.96Å; N509-V511 VanDerWaalsContact C-N 3.26Å; N509-V511 PolarHBondContact O-N 2.59Å; N509-V511 WeakPolarHBondContact OD1-CA 3.28Å; N509-V511 WeakPolarHBondContact OD1-CB 3.47Å; N509-V511 PolarHBondContact OD1-N 2.7Å; N509-D512 PolarHBondContact O-N 2.9Å; N509-D512 PolarHBondContact OD1-N 2.73Å; N509-Q513 WeakPolarHBondContact O-CB 3.42Å; N509-Q513 PolarHBondContact O-N 2.94Å
510	E	96.3	Very high	97.6	Very high	18 Å²	18	22.4 Å²	22.4	8%	0.084	13%	0.128	C	C	.	.	H	α-helix	trans	-57.1	-34.8	-178	-66.9	-163	133.4	0	0	114	Y465 R472 L477 Q513 M514 K534 K537 F538	Y465-E510 HydrophobicContact CE2-CG 4.45Å; R472-E510 IonicContact NH1-OE1 2.72Å; L477-E510 HydrophobicContact CD2-CB 3.9Å; L477-E510 HydrophobicContact CD2-CG 3.93Å; E510-Q513 WeakPolarHBondContact O-CB 3.49Å; E510-Q513 PolarHBondContact O-N 3.03Å; E510-M514 PolarHBondContact O-N 2.86Å; E510-K534 IonicContact OE1-NZ 2.66Å; E510-K534 PolarHBondContact OE1-NZ 3.13Å; E510-K534 IonicContact OE2-NZ 3.51Å; E510-K534 PolarHBondContact OE2-NZ 2.87Å; E510-K534 VanDerWaalsContact OE2-NZ 3.13Å; E510-K537 IonicContact OE2-NZ 3.24Å; E510-K537 PolarHBondContact OE2-NZ 3.49Å; E510-F538 HydrophobicContact CB-CE1 3.97Å; E510-F538 HydrophobicContact CB-CZ 4.19Å; E510-F538 WeakPolarHBondContact O-CE1 3.48Å
511	V	95.8	Very high	97.6	Very high	39 Å²	39	23.5 Å²	23.5	24%	0.236	13%	0.133	C	C	.	.	H	α-helix	trans	-74.4	-42.4	-178.8	179.7	0	0	0	0	110.6	N509 Q513 M514 N515 K537 F538	N509-V511 VanDerWaalsContact C-N 3.26Å; N509-V511 PolarHBondContact O-N 2.59Å; N509-V511 WeakPolarHBondContact OD1-CA 3.28Å; N509-V511 WeakPolarHBondContact OD1-CB 3.47Å; N509-V511 PolarHBondContact OD1-N 2.7Å; V511-Q513 VanDerWaalsContact C-N 3.29Å; V511-Q513 PolarHBondContact O-N 2.87Å; V511-M514 PolarHBondContact O-N 2.83Å; V511-N515 PolarHBondContact O-N 2.84Å; V511-N515 PolarHBondContact O-ND2 3.43Å; V511-K537 HydrophobicContact CG2-CG 4.29Å; V511-F538 HydrophobicContact CB-CD1 4.41Å; V511-F538 HydrophobicContact CG2-CD1 4Å; V511-F538 HydrophobicContact CG2-CE1 3.98Å
512	D	96.5	Very high	97.6	Very high	1 Å²	1	24 Å²	24	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-36.9	172.1	-169.2	41.3	0	0	0	111.6	G507 C508 N509 K516 R557 Y559	G507-D512 WeakPolarHBondContact CA-OD2 3.34Å; C508-D512 PolarHBondContact N-OD2 3.33Å; C508-D512 PolarHBondContact SG-OD2 3.12Å; N509-D512 PolarHBondContact O-N 2.9Å; N509-D512 PolarHBondContact OD1-N 2.73Å; D512-K516 WeakPolarHBondContact O-CB 3.2Å; D512-K516 VanDerWaalsContact O-CG 3.27Å; D512-K516 WeakPolarHBondContact O-CG 3.12Å; D512-K516 PolarHBondContact O-N 2.89Å; D512-R557 IonicContact OD1-CZ 2.66Å; D512-R557 IonicContact OD1-NE 3.04Å; D512-R557 IonicContact OD1-NH1 3.88Å; D512-R557 PolarHBondContact OD1-NH1 3.14Å; D512-R557 IonicContact OD1-NH2 2.67Å; D512-R557 IonicContact OD2-CZ 2.69Å; D512-R557 IonicContact OD2-NH1 3.95Å; D512-R557 PolarHBondContact OD2-NH1 3.38Å; D512-R557 IonicContact OD2-NH2 3.74Å; D512-Y559 WeakPolarHBondContact OD1-CE1 3.47Å; D512-Y559 PolarHBondContact OD1-OH 2.92Å
513	Q	98.1	Very high	97.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.6	-52.2	174.7	-166.9	66.8	23.5	0	0	111.4	R469 F470 L477 F505 N509 E510 V511 N515 K516 I517	R469-Q513 HydrophobicContact CG-CB 4.37Å; R469-Q513 HydrophobicContact CG-CG 4.28Å; R469-Q513 PolarHBondContact O-NE2 2.88Å; R469-Q513 VanDerWaalsContact O-NE2 3.09Å; R469-Q513 PolarHBondContact O-OE1 3.11Å; F470-Q513 PolarHBondContact O-NE2 2.87Å; L477-Q513 HydrophobicContact CD1-CB 4.35Å; L477-Q513 HydrophobicContact CD1-CG 3.86Å; L477-Q513 HydrophobicContact CD2-CB 4.41Å; L477-Q513 HydrophobicContact CD2-CG 4.4Å; F505-Q513 PolarHBondContact O-NE2 2.74Å; F505-Q513 PolarHBondContact O-OE1 2.64Å; N509-Q513 WeakPolarHBondContact O-CB 3.42Å; N509-Q513 PolarHBondContact O-N 2.94Å; E510-Q513 WeakPolarHBondContact O-CB 3.49Å; E510-Q513 PolarHBondContact O-N 3.03Å; V511-Q513 VanDerWaalsContact C-N 3.29Å; V511-Q513 PolarHBondContact O-N 2.87Å; Q513-N515 PolarHBondContact O-N 3.27Å; Q513-K516 PolarHBondContact O-N 3.42Å; Q513-I517 HydrophobicContact CG-CD1 4.28Å; Q513-I517 WeakPolarHBondContact O-CG1 3.36Å; Q513-I517 PolarHBondContact O-N 2.98Å
514	M	98.2	Very high	97.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.7	-41.6	179.2	-177	57.5	71.7	0	0	112.1	L477 L478 E510 V511 K516 I517 V518 F538 F539	L477-M514 HydrophobicContact CB-CE 3.74Å; L477-M514 HydrophobicContact CD1-CE 4.03Å; L478-M514 HydrophobicContact CD1-CE 4.43Å; L478-M514 HydrophobicContact CD2-CE 4.16Å; L478-M514 HydrophobicContact CG-CE 3.88Å; E510-M514 PolarHBondContact O-N 2.86Å; V511-M514 PolarHBondContact O-N 2.83Å; M514-K516 VanDerWaalsContact C-N 3.34Å; M514-K516 PolarHBondContact O-N 3.27Å; M514-I517 PolarHBondContact O-N 2.9Å; M514-V518 VanDerWaalsContact O-CG2 3.31Å; M514-V518 WeakPolarHBondContact O-CG2 3.41Å; M514-V518 PolarHBondContact O-N 3.22Å; M514-V518 HydrophobicContact SD-CG2 4.32Å; M514-F538 HydrophobicContact CB-CB 4.44Å; M514-F538 HydrophobicContact CB-CD1 3.69Å; M514-F538 HydrophobicContact CB-CE1 4.13Å; M514-F538 HydrophobicContact CB-CG 4.13Å; M514-F538 HydrophobicContact CG-CB 3.86Å; M514-F538 HydrophobicContact CG-CD1 4.01Å; M514-F538 HydrophobicContact CG-CG 3.91Å; M514-F539 HydrophobicContact CG-CE2 3.98Å; M514-F539 HydrophobicContact CG-CZ 3.77Å; M514-F539 HydrophobicContact SD-CE2 4.02Å; M514-F539 HydrophobicContact SD-CZ 3.81Å
515	N	97.3	Very high	97.5	Very high	5 Å²	5	23 Å²	23	3%	0.027	14%	0.135	C	C	.	.	H	α-helix	trans	-59.9	-43.9	175.4	-82.2	-95.6	0	0	0	111.3	V511 Q513 I517 V518 E519 Y559	V511-N515 PolarHBondContact O-N 2.84Å; V511-N515 PolarHBondContact O-ND2 3.43Å; Q513-N515 PolarHBondContact O-N 3.27Å; N515-I517 VanDerWaalsContact C-N 3.34Å; N515-I517 PolarHBondContact O-N 3.45Å; N515-V518 CarbonylContact O-C 3.54Å; N515-V518 PolarHBondContact O-N 3.26Å; N515-V518 VanDerWaalsContact O-N 3.16Å; N515-E519 WeakPolarHBondContact O-CG 3.27Å; N515-E519 PolarHBondContact O-N 2.72Å; N515-Y559 HydrophobicContact CB-CD1 3.9Å; N515-Y559 HydrophobicContact CB-CD2 3.81Å; N515-Y559 HydrophobicContact CB-CE1 3.73Å; N515-Y559 HydrophobicContact CB-CE2 3.62Å; N515-Y559 HydrophobicContact CB-CG 3.95Å; N515-Y559 WeakPolarHBondContact OD1-CD2 3.44Å; N515-Y559 WeakPolarHBondContact OD1-CE2 3.26Å
516	K	98	Very high	97.4	Very high	30 Å²	30	28 Å²	28	13%	0.13	16%	0.157	C	C	.	.	H	α-helix	trans	-65.4	-32.6	178.4	-77.5	178.8	175.4	-58.7	0	114.5	F505 S506 D512 Q513 M514 E519	F505-K516 HydrophobicContact CD1-CB 4.4Å; F505-K516 WeakPolarHBondContact CD1-O 3.09Å; S506-K516 VanDerWaalsContact O-CE 3.31Å; S506-K516 WeakPolarHBondContact O-CE 3.43Å; D512-K516 WeakPolarHBondContact O-CB 3.2Å; D512-K516 VanDerWaalsContact O-CG 3.27Å; D512-K516 WeakPolarHBondContact O-CG 3.12Å; D512-K516 PolarHBondContact O-N 2.89Å; Q513-K516 PolarHBondContact O-N 3.42Å; M514-K516 VanDerWaalsContact C-N 3.34Å; M514-K516 PolarHBondContact O-N 3.27Å; K516-E519 IonicContact NZ-OE2 2.65Å
517	I	98.8	Very high	97.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.4	-48.1	171.2	-67.5	165	0	0	0	109.4	L477 W489 F505 Q513 M514 N515 E519 V520 L521 F606	L477-I517 HydrophobicContact CD1-CD1 3.7Å; W489-I517 HydrophobicContact CH2-CD1 4.47Å; W489-I517 HydrophobicContact CH2-CG1 4.5Å; W489-I517 HydrophobicContact CH2-CG2 3.78Å; W489-I517 HydrophobicContact CZ2-CD1 3.82Å; W489-I517 HydrophobicContact CZ2-CG1 4.01Å; W489-I517 HydrophobicContact CZ2-CG2 4.14Å; F505-I517 HydrophobicContact CB-CG1 4.4Å; F505-I517 HydrophobicContact CD1-CG1 3.94Å; F505-I517 HydrophobicContact CD2-CG1 3.98Å; F505-I517 HydrophobicContact CE1-CB 4.39Å; F505-I517 HydrophobicContact CE1-CG1 4.14Å; F505-I517 HydrophobicContact CE2-CG1 4.17Å; F505-I517 HydrophobicContact CG-CG1 3.86Å; F505-I517 HydrophobicContact CZ-CG1 4.25Å; Q513-I517 HydrophobicContact CG-CD1 4.28Å; Q513-I517 WeakPolarHBondContact O-CG1 3.36Å; Q513-I517 PolarHBondContact O-N 2.98Å; M514-I517 PolarHBondContact O-N 2.9Å; N515-I517 VanDerWaalsContact C-N 3.34Å; N515-I517 PolarHBondContact O-N 3.45Å; I517-E519 PolarHBondContact O-N 3.15Å; I517-V520 PolarHBondContact O-N 3.13Å; I517-V520 VanDerWaalsContact O-N 3.13Å; I517-L521 HydrophobicContact CG2-CD1 3.92Å; I517-L521 PolarHBondContact O-N 3.05Å; I517-F606 HydrophobicContact CG2-CE1 3.72Å; I517-F606 HydrophobicContact CG2-CZ 3.92Å
518	V	98.5	Very high	97.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.8	-33.9	179.3	174.3	0	0	0	0	112.8	M514 N515 V520 G522 M523 F539 L550 P562 G563	M514-V518 VanDerWaalsContact O-CG2 3.31Å; M514-V518 WeakPolarHBondContact O-CG2 3.41Å; M514-V518 PolarHBondContact O-N 3.22Å; M514-V518 HydrophobicContact SD-CG2 4.32Å; N515-V518 CarbonylContact O-C 3.54Å; N515-V518 PolarHBondContact O-N 3.26Å; N515-V518 VanDerWaalsContact O-N 3.16Å; V518-V520 PolarHBondContact O-N 3.21Å; V518-G522 WeakPolarHBondContact CA-O 3.15Å; V518-G522 WeakPolarHBondContact O-CA 3.46Å; V518-G522 PolarHBondContact O-N 3.04Å; V518-M523 HydrophobicContact CG1-SD 3.94Å; V518-F539 HydrophobicContact CG2-CE1 4.12Å; V518-F539 HydrophobicContact CG2-CZ 4Å; V518-L550 HydrophobicContact CB-CD1 4.1Å; V518-L550 HydrophobicContact CB-CD2 4.44Å; V518-L550 HydrophobicContact CG1-CD1 3.58Å; V518-L550 HydrophobicContact CG1-CD2 4.46Å; V518-L550 HydrophobicContact CG1-CG 4.03Å; V518-L550 HydrophobicContact CG2-CD2 4.25Å; V518-P562 HydrophobicContact CG1-CB 3.67Å; V518-P562 HydrophobicContact CG1-CG 3.83Å; V518-P562 CarbonylContact O-C 3.48Å; V518-P562 WeakPolarHBondContact O-CA 3.47Å; V518-G563 PolarHBondContact O-N 2.93Å
519	E	98.1	Very high	97.5	Very high	19 Å²	19	27.6 Å²	27.6	9%	0.089	14%	0.138	C	C	.	.	H	α-helix	trans	-53.7	-35.5	172.6	-73.2	-172.5	113.3	0	0	112.3	N515 K516 I517 K560 G563 S564 R565	N515-E519 WeakPolarHBondContact O-CG 3.27Å; N515-E519 PolarHBondContact O-N 2.72Å; K516-E519 IonicContact NZ-OE2 2.65Å; I517-E519 PolarHBondContact O-N 3.15Å; E519-K560 HydrophobicContact CG-CB 4.17Å; E519-K560 WeakPolarHBondContact OE1-CB 3.42Å; E519-K560 PolarHBondContact OE1-N 3.33Å; E519-G563 CarbonylContact O-C 3.5Å; E519-G563 WeakPolarHBondContact O-CA 3.44Å; E519-G563 PolarHBondContact O-N 3.08Å; E519-S564 PolarHBondContact O-N 3.31Å; E519-S564 VanDerWaalsContact O-N 3.1Å; E519-R565 HydrophobicContact CB-CB 4.26Å; E519-R565 WeakPolarHBondContact O-CB 3.18Å; E519-R565 PolarHBondContact O-N 3.43Å
520	V	98.6	Very high	97.5	Very high	11 Å²	11	27.6 Å²	27.6	7%	0.067	14%	0.138	C	C	.	.	H	α-helix	trans	-97.1	-48.7	-174.3	-178.3	0	0	0	0	112.6	F505 I517 V518 R565 L567 I570	F505-V520 HydrophobicContact CE1-CB 3.92Å; F505-V520 HydrophobicContact CE1-CG2 3.79Å; I517-V520 PolarHBondContact O-N 3.13Å; I517-V520 VanDerWaalsContact O-N 3.13Å; V518-V520 PolarHBondContact O-N 3.21Å; V520-R565 WeakPolarHBondContact CA-O 3.48Å; V520-R565 HydrophobicContact CG2-CB 4.23Å; V520-R565 HydrophobicContact CG2-CG 4.28Å; V520-L567 HydrophobicContact CG1-CB 4.32Å; V520-I570 HydrophobicContact CG1-CD1 4.21Å; V520-I570 HydrophobicContact CG2-CD1 3.92Å
521	L	98.6	Very high	97.4	Very high	41 Å²	41	32 Å²	32	22%	0.215	16%	0.158	C	C	.	.	H	α-helix	trans	-96.2	-14.2	-170.2	-56.8	-179.3	0	0	0	113.9	W489 F505 I517 L601 L604 F606	W489-L521 HydrophobicContact CH2-CD1 3.58Å; W489-L521 HydrophobicContact CZ3-CD1 3.96Å; F505-L521 HydrophobicContact CZ-CD1 4.42Å; F505-L521 HydrophobicContact CZ-CG 4.47Å; I517-L521 HydrophobicContact CG2-CD1 3.92Å; I517-L521 PolarHBondContact O-N 3.05Å; L521-L601 HydrophobicContact CD2-CD2 4.22Å; L521-L604 HydrophobicContact CD1-CB 4.18Å; L521-L604 WeakPolarHBondContact CD1-O 3.37Å; L521-L604 HydrophobicContact CD2-CB 4.42Å; L521-F606 HydrophobicContact CB-CE2 3.6Å; L521-F606 HydrophobicContact CB-CZ 3.77Å; L521-F606 HydrophobicContact CD1-CE2 4.29Å; L521-F606 HydrophobicContact CD1-CZ 4.15Å
522	G	98.1	Very high	97.4	Very high	11 Å²	11	30.6 Å²	30.6	11%	0.113	15%	0.151	C	C	.	.			trans	88.4	-167.2	-171.7	0	0	0	0	0	113	V518 F606	V518-G522 WeakPolarHBondContact CA-O 3.15Å; V518-G522 WeakPolarHBondContact O-CA 3.46Å; V518-G522 PolarHBondContact O-N 3.04Å; G522-F606 WeakPolarHBondContact O-CZ 3.18Å
523	M	97.9	Very high	97.4	Very high	63 Å²	63	38.2 Å²	38.2	31%	0.31	19%	0.186	S	C	.	.	S	Bend	trans	-72.7	138.4	-179.6	-68.3	-63.6	-57.9	0	0	110.8	V518 F539 Y548 L550 P562	V518-M523 HydrophobicContact CG1-SD 3.94Å; M523-F539 HydrophobicContact CE-CD1 3.47Å; M523-F539 VanDerWaalsContact CE-CD1 3.47Å; M523-F539 HydrophobicContact CE-CE1 3.47Å; M523-F539 VanDerWaalsContact CE-CE1 3.47Å; M523-F539 HydrophobicContact SD-CD1 4.5Å; M523-F539 HydrophobicContact SD-CE1 4.1Å; M523-Y548 VanDerWaalsContact CE-O 3.27Å; M523-Y548 WeakPolarHBondContact CE-O 3.43Å; M523-L550 HydrophobicContact SD-CG 4.35Å; M523-P562 HydrophobicContact CG-CB 4.17Å; M523-P562 HydrophobicContact CG-CG 4.33Å; M523-P562 HydrophobicContact SD-CB 4.42Å; M523-P562 HydrophobicContact SD-CG 4.11Å
524	P	98	Very high	97.3	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.032	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-61.4	146.1	172.3	-18.9	30.2	0	0	0	111.4	K526 L529 F539 F606	P524-K526 PolarHBondContact O-N 2.92Å; P524-L529 HydrophobicContact CB-CD1 4.33Å; P524-L529 HydrophobicContact CB-CD2 3.94Å; P524-L529 HydrophobicContact CB-CG 4.11Å; P524-L529 HydrophobicContact CG-CD2 4.12Å; P524-F539 HydrophobicContact CG-CE2 4.12Å; P524-F539 HydrophobicContact CG-CZ 3.72Å; P524-F606 HydrophobicContact CB-CD1 3.89Å; P524-F606 HydrophobicContact CB-CE1 3.97Å; P524-F606 HydrophobicContact CB-CG 4.21Å; P524-F606 HydrophobicContact CB-CZ 4.33Å; P524-F606 HydrophobicContact CG-CD1 4.09Å; P524-F606 HydrophobicContact CG-CE1 3.66Å; P524-F606 HydrophobicContact CG-CZ 3.95Å
525	P	97.6	Very high	97.3	Very high	41 Å²	41	41.1 Å²	41.1	27%	0.266	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-50.3	134	176.5	-29.2	33.6	0	0	0	113.6	Y527 L528 L529 F606	P525-Y527 HydrophobicContact CB-CD1 3.85Å; P525-Y527 HydrophobicContact CB-CE1 3.4Å; P525-Y527 HydrophobicContact CG-CE1 4.31Å; P525-Y527 PolarHBondContact O-N 2.87Å; P525-Y527 VanDerWaalsContact O-N 3.12Å; P525-L528 HydrophobicContact CB-CD1 4.4Å; P525-L528 HydrophobicContact CB-CG 4.45Å; P525-L528 HydrophobicContact CG-CD1 4.28Å; P525-L528 WeakPolarHBondContact O-CB 3.4Å; P525-L528 PolarHBondContact O-N 3.31Å; P525-L529 PolarHBondContact O-N 3.36Å; P525-F606 HydrophobicContact CG-CB 4.22Å
526	K	96.9	Very high	97.2	Very high	104 Å²	104	51.3 Å²	51.3	45%	0.452	24%	0.238	S	C	.	.	H	α-helix	trans	-51.1	-40.4	-175.2	177.2	178.8	174.4	-64.2	0	113.2	P524 L528 L529 D530 G546 Y548	P524-K526 PolarHBondContact O-N 2.92Å; K526-L528 VanDerWaalsContact C-N 3.32Å; K526-L528 PolarHBondContact O-N 3Å; K526-L529 PolarHBondContact O-N 3.43Å; K526-L529 VanDerWaalsContact O-N 3.14Å; K526-D530 WeakPolarHBondContact CG-OD2 3.46Å; K526-D530 IonicContact NZ-OD2 3.14Å; K526-D530 PolarHBondContact NZ-OD2 3.45Å; K526-D530 PolarHBondContact O-N 2.93Å; K526-G546 WeakPolarHBondContact CE-O 3.35Å; K526-Y548 HydrophobicContact CG-CD2 4.25Å; K526-Y548 HydrophobicContact CG-CE2 4.19Å
527	Y	96.3	Very high	97.1	Very high	110 Å²	110	54.4 Å²	54.4	43%	0.431	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-29.9	-178.7	65.3	-95.4	0	0	0	113.4	P525 Q531 D607	P525-Y527 HydrophobicContact CB-CD1 3.85Å; P525-Y527 HydrophobicContact CB-CE1 3.4Å; P525-Y527 HydrophobicContact CG-CE1 4.31Å; P525-Y527 PolarHBondContact O-N 2.87Å; P525-Y527 VanDerWaalsContact O-N 3.12Å; Y527-Q531 WeakPolarHBondContact O-CG 3.48Å; Y527-Q531 PolarHBondContact O-N 2.94Å; Y527-Q531 PolarHBondContact O-NE2 3.06Å; Y527-D607 WeakPolarHBondContact CE2-OD2 3.06Å; Y527-D607 WeakPolarHBondContact OH-CB 3.27Å; Y527-D607 PolarHBondContact OH-OD2 3.47Å
528	L	96.8	Very high	97	Very high	9 Å²	9	54.4 Å²	54.4	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-71.7	-39.7	172.5	-62.4	177	0	0	0	110.6	I480 P525 K526 Q531 A532 F606 D607	I480-L528 HydrophobicContact CD1-CB 4.24Å; I480-L528 HydrophobicContact CD1-CD2 4.4Å; P525-L528 HydrophobicContact CB-CD1 4.4Å; P525-L528 HydrophobicContact CB-CG 4.45Å; P525-L528 HydrophobicContact CG-CD1 4.28Å; P525-L528 WeakPolarHBondContact O-CB 3.4Å; P525-L528 PolarHBondContact O-N 3.31Å; K526-L528 VanDerWaalsContact C-N 3.32Å; K526-L528 PolarHBondContact O-N 3Å; L528-Q531 PolarHBondContact O-N 3.21Å; L528-A532 WeakPolarHBondContact O-CB 3.42Å; L528-A532 PolarHBondContact O-N 3.24Å; L528-F606 HydrophobicContact CD1-CB 4Å; L528-F606 WeakPolarHBondContact CD1-O 3.4Å; L528-D607 HydrophobicContact CD1-CB 4.19Å; L528-D607 HydrophobicContact CD2-CB 4.49Å
529	L	97.6	Very high	96.9	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-69.8	-31.8	178	-61.4	-177.5	0	0	0	113	L478 P524 P525 K526 T535 F539 Y548	L478-L529 HydrophobicContact CD1-CD2 4.12Å; L478-L529 HydrophobicContact CD2-CD2 3.95Å; P524-L529 HydrophobicContact CB-CD1 4.33Å; P524-L529 HydrophobicContact CB-CD2 3.94Å; P524-L529 HydrophobicContact CB-CG 4.11Å; P524-L529 HydrophobicContact CG-CD2 4.12Å; P525-L529 PolarHBondContact O-N 3.36Å; K526-L529 PolarHBondContact O-N 3.43Å; K526-L529 VanDerWaalsContact O-N 3.14Å; L529-T535 HydrophobicContact CB-CG2 4.12Å; L529-T535 HydrophobicContact CD2-CG2 4.4Å; L529-T535 WeakPolarHBondContact O-CB 3.42Å; L529-T535 WeakPolarHBondContact O-CG2 3.37Å; L529-T535 PolarHBondContact O-OG1 3.45Å; L529-F539 HydrophobicContact CD1-CD2 4.31Å; L529-F539 HydrophobicContact CD1-CG 4.4Å; L529-F539 HydrophobicContact CD2-CD2 3.62Å; L529-F539 HydrophobicContact CD2-CE2 3.62Å; L529-F539 HydrophobicContact CD2-CG 4.47Å; L529-F539 HydrophobicContact CD2-CZ 4.46Å; L529-Y548 HydrophobicContact CB-CD1 4.4Å; L529-Y548 HydrophobicContact CB-CD2 3.78Å; L529-Y548 HydrophobicContact CB-CE1 4.33Å; L529-Y548 HydrophobicContact CB-CE2 3.72Å; L529-Y548 HydrophobicContact CB-CG 4.13Å; L529-Y548 HydrophobicContact CD1-CD1 4.34Å; L529-Y548 HydrophobicContact CD1-CD2 3.85Å; L529-Y548 HydrophobicContact CD1-CG 3.68Å; L529-Y548 HydrophobicContact CG-CD2 4.48Å
530	D	95.6	Very high	96.8	Very high	70 Å²	70	56.6 Å²	56.6	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-68.7	-34.2	171.3	-78.4	-42.4	0	0	0	112.3	K526 K541 Y548	K526-D530 WeakPolarHBondContact CG-OD2 3.46Å; K526-D530 IonicContact NZ-OD2 3.14Å; K526-D530 PolarHBondContact NZ-OD2 3.45Å; K526-D530 PolarHBondContact O-N 2.93Å; D530-K541 IonicContact OD1-NZ 3.34Å; D530-K541 PolarHBondContact OD1-NZ 3.31Å; D530-Y548 PolarHBondContact OD1-OH 2.86Å
531	Q	94.4	Very high	96.6	Very high	110 Å²	110	60.7 Å²	60.7	51%	0.514	28%	0.28	S	S	.	.	H	α-helix	trans	-83.5	-21.1	178.4	-75.7	169.2	80	0	0	114.1	Y527 L528	Y527-Q531 WeakPolarHBondContact O-CG 3.48Å; Y527-Q531 PolarHBondContact O-N 2.94Å; Y527-Q531 PolarHBondContact O-NE2 3.06Å; L528-Q531 PolarHBondContact O-N 3.21Å
532	A	96.1	Very high	96.3	Very high	10 Å²	10	61.8 Å²	61.8	8%	0.083	29%	0.286	C	S	.	.			trans	-82.3	121.6	-167.5	0	0	0	0	0	115	L478 I480 L528 K534 T535	L478-A532 HydrophobicContact CB-CB 3.72Å; L478-A532 HydrophobicContact CD1-CB 4.38Å; L478-A532 HydrophobicContact CD2-CB 4.04Å; L478-A532 HydrophobicContact CG-CB 4.26Å; I480-A532 HydrophobicContact CD1-CB 4.01Å; I480-A532 HydrophobicContact CG1-CB 3.7Å; L528-A532 WeakPolarHBondContact O-CB 3.42Å; L528-A532 PolarHBondContact O-N 3.24Å; A532-K534 VanDerWaalsContact C-N 3.28Å; A532-K534 PolarHBondContact O-N 3.13Å; A532-T535 WeakPolarHBondContact CB-OG1 3.37Å; A532-T535 PolarHBondContact O-N 3.1Å; A532-T535 PolarHBondContact O-OG1 3.3Å; A532-T535 VanDerWaalsContact O-OG1 3.08Å
533	H	95.9	Very high	96	Very high	161 Å²	161	68.2 Å²	68.2	75%	0.745	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-33	179.6	-56.4	139	0	0	0	114.2	L478 G479	L478-H533 PolarHBondContact O-N 3.37Å; G479-H533 PolarHBondContact O-ND1 2.83Å
534	K	96.5	Very high	95.6	Very high	54 Å²	54	70.1 Å²	70.1	24%	0.235	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	5.5	-177.4	-59.7	165.3	66.8	-165.7	0	113.8	L477 L478 E510 A532 R536 K537 F538	L477-K534 VanDerWaalsContact O-CD 3.3Å; L477-K534 WeakPolarHBondContact O-CD 3.35Å; L477-K534 WeakPolarHBondContact O-CE 3.24Å; L477-K534 PolarHBondContact O-NZ 3.19Å; L478-K534 VanDerWaalsContact O-CB 3.28Å; L478-K534 WeakPolarHBondContact O-CB 3.4Å; L478-K534 PolarHBondContact O-N 2.94Å; E510-K534 IonicContact OE1-NZ 2.66Å; E510-K534 PolarHBondContact OE1-NZ 3.13Å; E510-K534 IonicContact OE2-NZ 3.51Å; E510-K534 PolarHBondContact OE2-NZ 2.87Å; E510-K534 VanDerWaalsContact OE2-NZ 3.13Å; A532-K534 VanDerWaalsContact C-N 3.28Å; A532-K534 PolarHBondContact O-N 3.13Å; K534-R536 VanDerWaalsContact C-N 3.31Å; K534-R536 PolarHBondContact O-N 3.36Å; K534-R536 VanDerWaalsContact O-N 3.14Å; K534-K537 WeakPolarHBondContact O-CB 3.38Å; K534-K537 PolarHBondContact O-N 2.93Å; K534-F538 HydrophobicContact CB-CE2 4.02Å
535	T	97	Very high	95.3	Very high	7 Å²	7	74.8 Å²	74.8	4%	0.043	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-48.4	-47	-175.3	-67.4	0	0	0	0	113.7	L529 A532 K537 F538 F539 Y548	L529-T535 HydrophobicContact CB-CG2 4.12Å; L529-T535 HydrophobicContact CD2-CG2 4.4Å; L529-T535 WeakPolarHBondContact O-CB 3.42Å; L529-T535 WeakPolarHBondContact O-CG2 3.37Å; L529-T535 PolarHBondContact O-OG1 3.45Å; A532-T535 WeakPolarHBondContact CB-OG1 3.37Å; A532-T535 PolarHBondContact O-N 3.1Å; A532-T535 PolarHBondContact O-OG1 3.3Å; A532-T535 VanDerWaalsContact O-OG1 3.08Å; T535-K537 PolarHBondContact O-N 3.39Å; T535-F538 PolarHBondContact O-N 2.92Å; T535-F539 HydrophobicContact CG2-CB 4.11Å; T535-F539 HydrophobicContact CG2-CD2 4.35Å; T535-F539 PolarHBondContact O-N 3.2Å; T535-Y548 HydrophobicContact CG2-CD1 3.91Å; T535-Y548 HydrophobicContact CG2-CE1 3.45Å; T535-Y548 VanDerWaalsContact CG2-CE1 3.45Å
536	R	95.9	Very high	95	Very high	219 Å²	219	73.8 Å²	73.8	83%	0.826	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-61.1	-13.7	-177.8	-61.3	-176.6	-176.2	-174.2	0.9	114.6	K534 K551	K534-R536 VanDerWaalsContact C-N 3.31Å; K534-R536 PolarHBondContact O-N 3.36Å; K534-R536 VanDerWaalsContact O-N 3.14Å; R536-K551 PolarHBondContact O-NZ 2.87Å
537	K	95.9	Very high	94.8	Very high	94 Å²	94	70.5 Å²	70.5	41%	0.409	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-75.2	-29.9	174.1	-173.7	173.7	-179.1	172.7	0	112.8	E510 V511 K534 T535	E510-K537 IonicContact OE2-NZ 3.24Å; E510-K537 PolarHBondContact OE2-NZ 3.49Å; V511-K537 HydrophobicContact CG2-CG 4.29Å; K534-K537 WeakPolarHBondContact O-CB 3.38Å; K534-K537 PolarHBondContact O-N 2.93Å; T535-K537 PolarHBondContact O-N 3.39Å
538	F	96.3	Very high	94.8	Very high	1 Å²	1	66.9 Å²	66.9	0%	0.004	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-28.8	-171	-48.3	-73.1	0	0	0	113.4	L477 L478 E510 V511 M514 K534 T535 K551	L477-F538 WeakPolarHBondContact O-CE2 3.44Å; L477-F538 WeakPolarHBondContact O-CZ 3.37Å; L478-F538 HydrophobicContact CD2-CD2 4.1Å; L478-F538 HydrophobicContact CD2-CE2 4.48Å; E510-F538 HydrophobicContact CB-CE1 3.97Å; E510-F538 HydrophobicContact CB-CZ 4.19Å; E510-F538 WeakPolarHBondContact O-CE1 3.48Å; V511-F538 HydrophobicContact CB-CD1 4.41Å; V511-F538 HydrophobicContact CG2-CD1 4Å; V511-F538 HydrophobicContact CG2-CE1 3.98Å; M514-F538 HydrophobicContact CB-CB 4.44Å; M514-F538 HydrophobicContact CB-CD1 3.69Å; M514-F538 HydrophobicContact CB-CE1 4.13Å; M514-F538 HydrophobicContact CB-CG 4.13Å; M514-F538 HydrophobicContact CG-CB 3.86Å; M514-F538 HydrophobicContact CG-CD1 4.01Å; M514-F538 HydrophobicContact CG-CG 3.91Å; K534-F538 HydrophobicContact CB-CE2 4.02Å; T535-F538 PolarHBondContact O-N 2.92Å; F538-K551 VanDerWaalsContact O-CB 3.24Å; F538-K551 WeakPolarHBondContact O-CB 3.43Å; F538-K551 PolarHBondContact O-N 2.84Å
539	F	96.9	Very high	94.7	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.009	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.2	-173.4	-55.7	-74.4	0	0	0	111	L478 M514 V518 M523 P524 L529 T535 Y548 V549 L550	L478-F539 HydrophobicContact CD2-CE2 4.21Å; M514-F539 HydrophobicContact CG-CE2 3.98Å; M514-F539 HydrophobicContact CG-CZ 3.77Å; M514-F539 HydrophobicContact SD-CE2 4.02Å; M514-F539 HydrophobicContact SD-CZ 3.81Å; V518-F539 HydrophobicContact CG2-CE1 4.12Å; V518-F539 HydrophobicContact CG2-CZ 4Å; M523-F539 HydrophobicContact CE-CD1 3.47Å; M523-F539 VanDerWaalsContact CE-CD1 3.47Å; M523-F539 HydrophobicContact CE-CE1 3.47Å; M523-F539 VanDerWaalsContact CE-CE1 3.47Å; M523-F539 HydrophobicContact SD-CD1 4.5Å; M523-F539 HydrophobicContact SD-CE1 4.1Å; P524-F539 HydrophobicContact CG-CE2 4.12Å; P524-F539 HydrophobicContact CG-CZ 3.72Å; L529-F539 HydrophobicContact CD1-CD2 4.31Å; L529-F539 HydrophobicContact CD1-CG 4.4Å; L529-F539 HydrophobicContact CD2-CD2 3.62Å; L529-F539 HydrophobicContact CD2-CE2 3.62Å; L529-F539 HydrophobicContact CD2-CG 4.47Å; L529-F539 HydrophobicContact CD2-CZ 4.46Å; T535-F539 HydrophobicContact CG2-CB 4.11Å; T535-F539 HydrophobicContact CG2-CD2 4.35Å; T535-F539 PolarHBondContact O-N 3.2Å; F539-Y548 HydrophobicContact CB-CD1 4.04Å; F539-V549 CarbonylContact C-O 3.55Å; F539-V549 WeakPolarHBondContact CA-O 3.43Å; F539-V549 WeakPolarHBondContact CB-O 3.28Å; F539-L550 HydrophobicContact CD1-CD2 4.03Å; F539-L550 HydrophobicContact CD1-CG 4.41Å; F539-L550 HydrophobicContact CE1-CD2 3.54Å; F539-L550 HydrophobicContact CE1-CG 4.06Å; F539-L550 HydrophobicContact CZ-CD2 4.29Å
540	D	95.3	Very high	94.5	Very high	63 Å²	63	71.3 Å²	71.3	34%	0.337	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	143.9	165.9	-63.2	-43.8	0	0	0	108.6	Y548 V549 K551	D540-Y548 WeakPolarHBondContact O-CA 3.32Å; D540-V549 HydrophobicContact CB-CG2 4.42Å; D540-V549 PolarHBondContact N-O 2.93Å; D540-V549 PolarHBondContact O-N 2.9Å; D540-K551 IonicContact OD1-NZ 2.74Å; D540-K551 PolarHBondContact OD1-NZ 3.12Å; D540-K551 WeakPolarHBondContact OD2-CA 3.36Å; D540-K551 WeakPolarHBondContact OD2-CG 3.33Å
541	K	94.8	Very high	94.3	Very high	96 Å²	96	71.7 Å²	71.7	42%	0.417	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.2	178.5	-162.1	174	-167.1	158.8	0	109.5	D530 G546 S547 Y548	D530-K541 IonicContact OD1-NZ 3.34Å; D530-K541 PolarHBondContact OD1-NZ 3.31Å; K541-G546 WeakPolarHBondContact CE-O 3.42Å; K541-S547 CarbonylContact C-O 3.44Å; K541-S547 WeakPolarHBondContact CA-O 3.49Å; K541-S547 VanDerWaalsContact CG-O 3.31Å; K541-S547 WeakPolarHBondContact CG-O 3.4Å; K541-Y548 HydrophobicContact CB-CD1 3.99Å; K541-Y548 HydrophobicContact CB-CE1 3.72Å; K541-Y548 HydrophobicContact CD-CE1 3.98Å; K541-Y548 HydrophobicContact CD-CE2 4.2Å; K541-Y548 HydrophobicContact CG-CD1 4.14Å; K541-Y548 HydrophobicContact CG-CE1 3.79Å; K541-Y548 HydrophobicContact CG-CE2 4.25Å; K541-Y548 PolarHBondContact NZ-OH 3.34Å
542	I	93.6	Very high	93.8	Very high	65 Å²	65	75.7 Å²	75.7	33%	0.333	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-75.1	127.7	172.9	-64.5	-176.2	0	0	0	108	A544 D545 G546 S547 V549	I542-A544 HydrophobicContact CG2-CB 4.22Å; I542-D545 VanDerWaalsContact CB-OD1 3.27Å; I542-D545 WeakPolarHBondContact CB-OD1 3.35Å; I542-D545 WeakPolarHBondContact CG2-OD1 3.34Å; I542-G546 WeakPolarHBondContact O-CA 3.41Å; I542-G546 PolarHBondContact O-N 2.74Å; I542-S547 PolarHBondContact N-O 3.5Å; I542-V549 HydrophobicContact CD1-CG1 3.71Å; I542-V549 HydrophobicContact CD1-CG2 4.4Å; I542-V549 HydrophobicContact CG1-CG1 4.3Å; I542-V549 HydrophobicContact CG1-CG2 4.2Å
543	V	90.3	Very high	92.9	Very high	145 Å²	145	77.4 Å²	77.4	88%	0.879	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-29.3	-174.5	-179	0	0	0	0	111.9
544	A	90.2	Very high	91.7	Very high	103 Å²	103	78.7 Å²	78.7	85%	0.851	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-36	-173.5	0	0	0	0	0	114.5	I542	I542-A544 HydrophobicContact CG2-CB 4.22Å
545	D	92	Very high	90.5	Very high	104 Å²	104	82.4 Å²	82.4	56%	0.556	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	-6.5	-175.7	65.5	-9.2	0	0	0	113.1	I542 S547	I542-D545 VanDerWaalsContact CB-OD1 3.27Å; I542-D545 WeakPolarHBondContact CB-OD1 3.35Å; I542-D545 WeakPolarHBondContact CG2-OD1 3.34Å; D545-S547 PolarHBondContact O-N 3.39Å; D545-S547 WeakPolarHBondContact OD1-CB 3.47Å; D545-S547 PolarHBondContact OD1-N 3.31Å; D545-S547 PolarHBondContact OD1-OG 3.41Å; D545-S547 WeakPolarHBondContact OD2-CB 3.3Å; D545-S547 PolarHBondContact OD2-OG 3.35Å
546	G	90.3	Very high	89.4	Confident	19 Å²	19	85 Å²	85	20%	0.196	45%	0.45	C	S	.	.			trans	69.6	12.5	-174.3	0	0	0	0	0	114.6	K526 K541 I542	K526-G546 WeakPolarHBondContact CE-O 3.35Å; K541-G546 WeakPolarHBondContact CE-O 3.42Å; I542-G546 WeakPolarHBondContact O-CA 3.41Å; I542-G546 PolarHBondContact O-N 2.74Å
547	S	93.8	Very high	88.7	Confident	35 Å²	35	80 Å²	80	25%	0.245	43%	0.431	C	S	.	.			trans	-75.4	175.6	176.1	74.7	0	0	0	0	111.8	K541 I542 D545	K541-S547 CarbonylContact C-O 3.44Å; K541-S547 WeakPolarHBondContact CA-O 3.49Å; K541-S547 VanDerWaalsContact CG-O 3.31Å; K541-S547 WeakPolarHBondContact CG-O 3.4Å; I542-S547 PolarHBondContact N-O 3.5Å; D545-S547 PolarHBondContact O-N 3.39Å; D545-S547 WeakPolarHBondContact OD1-CB 3.47Å; D545-S547 PolarHBondContact OD1-N 3.31Å; D545-S547 PolarHBondContact OD1-OG 3.41Å; D545-S547 WeakPolarHBondContact OD2-CB 3.3Å; D545-S547 PolarHBondContact OD2-OG 3.35Å
548	Y	95.8	Very high	88.3	Confident	35 Å²	35	84.8 Å²	84.8	14%	0.137	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.2	-179.3	-73.8	-86.6	0	0	0	110.9	M523 K526 L529 D530 T535 F539 D540 K541	M523-Y548 VanDerWaalsContact CE-O 3.27Å; M523-Y548 WeakPolarHBondContact CE-O 3.43Å; K526-Y548 HydrophobicContact CG-CD2 4.25Å; K526-Y548 HydrophobicContact CG-CE2 4.19Å; L529-Y548 HydrophobicContact CB-CD1 4.4Å; L529-Y548 HydrophobicContact CB-CD2 3.78Å; L529-Y548 HydrophobicContact CB-CE1 4.33Å; L529-Y548 HydrophobicContact CB-CE2 3.72Å; L529-Y548 HydrophobicContact CB-CG 4.13Å; L529-Y548 HydrophobicContact CD1-CD1 4.34Å; L529-Y548 HydrophobicContact CD1-CD2 3.85Å; L529-Y548 HydrophobicContact CD1-CG 3.68Å; L529-Y548 HydrophobicContact CG-CD2 4.48Å; D530-Y548 PolarHBondContact OD1-OH 2.86Å; T535-Y548 HydrophobicContact CG2-CD1 3.91Å; T535-Y548 HydrophobicContact CG2-CE1 3.45Å; T535-Y548 VanDerWaalsContact CG2-CE1 3.45Å; F539-Y548 HydrophobicContact CB-CD1 4.04Å; D540-Y548 WeakPolarHBondContact O-CA 3.32Å; K541-Y548 HydrophobicContact CB-CD1 3.99Å; K541-Y548 HydrophobicContact CB-CE1 3.72Å; K541-Y548 HydrophobicContact CD-CE1 3.98Å; K541-Y548 HydrophobicContact CD-CE2 4.2Å; K541-Y548 HydrophobicContact CG-CD1 4.14Å; K541-Y548 HydrophobicContact CG-CE1 3.79Å; K541-Y548 HydrophobicContact CG-CE2 4.25Å; K541-Y548 PolarHBondContact NZ-OH 3.34Å
549	V	94.4	Very high	88	Confident	65 Å²	65	87.2 Å²	87.2	39%	0.394	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.7	173.1	-70.1	0	0	0	0	110.7	F539 D540 I542 K551	F539-V549 CarbonylContact C-O 3.55Å; F539-V549 WeakPolarHBondContact CA-O 3.43Å; F539-V549 WeakPolarHBondContact CB-O 3.28Å; D540-V549 HydrophobicContact CB-CG2 4.42Å; D540-V549 PolarHBondContact N-O 2.93Å; D540-V549 PolarHBondContact O-N 2.9Å; I542-V549 HydrophobicContact CD1-CG1 3.71Å; I542-V549 HydrophobicContact CD1-CG2 4.4Å; I542-V549 HydrophobicContact CG1-CG1 4.3Å; I542-V549 HydrophobicContact CG1-CG2 4.2Å; V549-K551 PolarHBondContact O-N 3.5Å
550	L	93.4	Very high	87.9	Confident	39 Å²	39	92.5 Å²	92.5	20%	0.204	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	130.1	172.7	-85.2	172.4	0	0	0	110.7	V518 M523 F539 K552	V518-L550 HydrophobicContact CB-CD1 4.1Å; V518-L550 HydrophobicContact CB-CD2 4.44Å; V518-L550 HydrophobicContact CG1-CD1 3.58Å; V518-L550 HydrophobicContact CG1-CD2 4.46Å; V518-L550 HydrophobicContact CG1-CG 4.03Å; V518-L550 HydrophobicContact CG2-CD2 4.25Å; M523-L550 HydrophobicContact SD-CG 4.35Å; F539-L550 HydrophobicContact CD1-CD2 4.03Å; F539-L550 HydrophobicContact CD1-CG 4.41Å; F539-L550 HydrophobicContact CE1-CD2 3.54Å; F539-L550 HydrophobicContact CE1-CG 4.06Å; F539-L550 HydrophobicContact CZ-CD2 4.29Å; L550-K552 PolarHBondContact O-N 3.39Å
551	K	91.7	Very high	87.9	Confident	78 Å²	78	93.6 Å²	93.6	34%	0.339	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-62.2	130.2	177.6	-172.5	175.4	-147.9	87.1	0	110	R536 F538 D540 V549 N553	R536-K551 PolarHBondContact O-NZ 2.87Å; F538-K551 VanDerWaalsContact O-CB 3.24Å; F538-K551 WeakPolarHBondContact O-CB 3.43Å; F538-K551 PolarHBondContact O-N 2.84Å; D540-K551 IonicContact OD1-NZ 2.74Å; D540-K551 PolarHBondContact OD1-NZ 3.12Å; D540-K551 WeakPolarHBondContact OD2-CA 3.36Å; D540-K551 WeakPolarHBondContact OD2-CG 3.33Å; V549-K551 PolarHBondContact O-N 3.5Å; K551-N553 PolarHBondContact O-N 2.97Å; K551-N553 VanDerWaalsContact O-N 3.16Å
552	K	83.4	Confident	88	Confident	194 Å²	194	92.1 Å²	92.1	84%	0.843	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-59.6	120.6	-178	-71	-177.2	-179.6	176.5	0	110.5	L550 Q554	L550-K552 PolarHBondContact O-N 3.39Å; K552-Q554 PolarHBondContact O-N 3.11Å
553	N	76.9	Confident	88.2	Confident	47 Å²	47	89.5 Å²	89.5	25%	0.251	49%	0.485	S	S	.	.			trans	-74.5	113.9	-175	-171.6	5.8	0	0	0	111	K551 N555 G556 R557 Y559	K551-N553 PolarHBondContact O-N 2.97Å; K551-N553 VanDerWaalsContact O-N 3.16Å; N553-N555 PolarHBondContact O-N 3.5Å; N553-N555 PolarHBondContact OD1-N 3.02Å; N553-G556 PolarHBondContact O-N 3.35Å; N553-R557 PolarHBondContact ND2-O 3.33Å; N553-Y559 HydrophobicContact CB-CE2 4.3Å; N553-Y559 WeakPolarHBondContact ND2-CE2 3.4Å; N553-Y559 PolarHBondContact ND2-OH 2.92Å
554	Q	71.4	Confident	88.5	Confident	188 Å²	188	85 Å²	85	88%	0.879	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.9	-178.6	-64	178.7	-1	0	0	112.5	K552 G556	K552-Q554 PolarHBondContact O-N 3.11Å; Q554-G556 PolarHBondContact O-N 3.39Å; Q554-G556 VanDerWaalsContact O-N 3.16Å
555	N	70.9	Confident	88.9	Confident	132 Å²	132	83.2 Å²	83.2	71%	0.706	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	12.7	-171.9	-56.5	36.5	0	0	0	113.7	N553 R557	N553-N555 PolarHBondContact O-N 3.5Å; N553-N555 PolarHBondContact OD1-N 3.02Å; N555-R557 PolarHBondContact O-N 2.82Å
556	G	74.1	Confident	89.2	Confident	62 Å²	62	83.6 Å²	83.6	64%	0.639	43%	0.427	S	S	*	.			trans	66.5	-8.4	178.9	0	0	0	0	0	116.5	N553 Q554 K558	N553-G556 PolarHBondContact O-N 3.35Å; Q554-G556 PolarHBondContact O-N 3.39Å; Q554-G556 VanDerWaalsContact O-N 3.16Å; G556-K558 PolarHBondContact O-N 3.28Å
557	R	82.1	Confident	89.6	Confident	112 Å²	112	83 Å²	83	42%	0.423	42%	0.42	S	S	.	.			trans	-68.6	113.8	-178.1	-169.7	-175.9	-164.5	-178	-0.4	110.6	D512 N553 N555	D512-R557 IonicContact OD1-CZ 2.66Å; D512-R557 IonicContact OD1-NE 3.04Å; D512-R557 IonicContact OD1-NH1 3.88Å; D512-R557 PolarHBondContact OD1-NH1 3.14Å; D512-R557 IonicContact OD1-NH2 2.67Å; D512-R557 IonicContact OD2-CZ 2.69Å; D512-R557 IonicContact OD2-NH1 3.95Å; D512-R557 PolarHBondContact OD2-NH1 3.38Å; D512-R557 IonicContact OD2-NH2 3.74Å; N553-R557 PolarHBondContact ND2-O 3.33Å; N555-R557 PolarHBondContact O-N 2.82Å
558	K	86.1	Confident	89.8	Confident	195 Å²	195	83.6 Å²	83.6	85%	0.848	42%	0.418	S	S	*	.			trans	-76.5	142.7	176.3	-58.8	-178.7	-179	-179.5	0	110.9	G556	G556-K558 PolarHBondContact O-N 3.28Å
559	Y	90.9	Very high	89.9	Confident	52 Å²	52	86.7 Å²	86.7	20%	0.204	44%	0.438	C	S	.	.			trans	-118.5	162.9	170.1	-56.6	-73.9	0	0	0	109.4	D512 N515 N553	D512-Y559 WeakPolarHBondContact OD1-CE1 3.47Å; D512-Y559 PolarHBondContact OD1-OH 2.92Å; N515-Y559 HydrophobicContact CB-CD1 3.9Å; N515-Y559 HydrophobicContact CB-CD2 3.81Å; N515-Y559 HydrophobicContact CB-CE1 3.73Å; N515-Y559 HydrophobicContact CB-CE2 3.62Å; N515-Y559 HydrophobicContact CB-CG 3.95Å; N515-Y559 WeakPolarHBondContact OD1-CD2 3.44Å; N515-Y559 WeakPolarHBondContact OD1-CE2 3.26Å; N553-Y559 HydrophobicContact CB-CE2 4.3Å; N553-Y559 WeakPolarHBondContact ND2-CE2 3.4Å; N553-Y559 PolarHBondContact ND2-OH 2.92Å
560	K	94.1	Very high	90.1	Very high	113 Å²	113	85.1 Å²	85.1	49%	0.491	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-66.3	154.3	166.5	-74.6	171.9	172.1	-79.3	0	110.7	E519 R565	E519-K560 HydrophobicContact CG-CB 4.17Å; E519-K560 WeakPolarHBondContact OE1-CB 3.42Å; E519-K560 PolarHBondContact OE1-N 3.33Å; K560-R565 HydrophobicContact CD-CB 3.82Å; K560-R565 HydrophobicContact CD-CG 4.19Å
561	P	95.5	Very high	90.4	Very high	86 Å²	86	83.2 Å²	83.2	56%	0.558	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-55.3	153.9	172	-25.7	34.4	0	0	0	112.9	G563 S564	P561-G563 PolarHBondContact O-N 2.77Å; P561-S564 WeakPolarHBondContact O-CB 3.48Å; P561-S564 PolarHBondContact O-N 3.23Å; P561-S564 VanDerWaalsContact O-N 3.13Å
562	P	97	Very high	90.7	Very high	65 Å²	65	79.6 Å²	79.6	42%	0.422	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	128.2	177.9	-29.1	36.2	0	0	0	113	V518 M523 S564	V518-P562 HydrophobicContact CG1-CB 3.67Å; V518-P562 HydrophobicContact CG1-CG 3.83Å; V518-P562 CarbonylContact O-C 3.48Å; V518-P562 WeakPolarHBondContact O-CA 3.47Å; M523-P562 HydrophobicContact CG-CB 4.17Å; M523-P562 HydrophobicContact CG-CG 4.33Å; M523-P562 HydrophobicContact SD-CB 4.42Å; M523-P562 HydrophobicContact SD-CG 4.11Å; P562-S564 PolarHBondContact O-N 3.34Å
563	G	97.4	Very high	91.4	Very high	11 Å²	11	70.4 Å²	70.4	11%	0.113	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	16.3	176.7	0	0	0	0	0	114.8	V518 E519 P561 K566	V518-G563 PolarHBondContact O-N 2.93Å; E519-G563 CarbonylContact O-C 3.5Å; E519-G563 WeakPolarHBondContact O-CA 3.44Å; E519-G563 PolarHBondContact O-N 3.08Å; P561-G563 PolarHBondContact O-N 2.77Å; G563-K566 WeakPolarHBondContact O-CD 3.31Å; G563-K566 VanDerWaalsContact O-CE 3.3Å; G563-K566 WeakPolarHBondContact O-CE 3.29Å; G563-K566 PolarHBondContact O-NZ 2.87Å
564	S	97.8	Very high	92.4	Very high	50 Å²	50	74.4 Å²	74.4	35%	0.35	38%	0.379	S	S	.	.			trans	-96.4	-5.7	-177.4	113.9	0	0	0	0	114.4	E519 P561 P562	E519-S564 PolarHBondContact O-N 3.31Å; E519-S564 VanDerWaalsContact O-N 3.1Å; P561-S564 WeakPolarHBondContact O-CB 3.48Å; P561-S564 PolarHBondContact O-N 3.23Å; P561-S564 VanDerWaalsContact O-N 3.13Å; P562-S564 PolarHBondContact O-N 3.34Å
565	R	97.7	Very high	93.6	Very high	66 Å²	66	69.9 Å²	69.9	25%	0.249	36%	0.364	C	S	.	.	S	Bend	trans	-101.2	77.1	171.5	-173.5	-166.1	166	-141.8	-1	108.1	L504 E519 V520 K560 I570	L504-R565 PolarHBondContact O-NH1 2.72Å; E519-R565 HydrophobicContact CB-CB 4.26Å; E519-R565 WeakPolarHBondContact O-CB 3.18Å; E519-R565 PolarHBondContact O-N 3.43Å; V520-R565 WeakPolarHBondContact CA-O 3.48Å; V520-R565 HydrophobicContact CG2-CB 4.23Å; V520-R565 HydrophobicContact CG2-CG 4.28Å; K560-R565 HydrophobicContact CD-CB 3.82Å; K560-R565 HydrophobicContact CD-CG 4.19Å; R565-I570 HydrophobicContact CG-CD1 4.04Å; R565-I570 HydrophobicContact CG-CG1 4.33Å
566	K	98.4	Very high	94.8	Very high	111 Å²	111	64.1 Å²	64.1	48%	0.483	34%	0.336	S	S	.	.			trans	-63.1	141.5	-167.8	-52.7	-62.8	-173.4	-174.5	0	111.1	G563 H568 D569 I570	G563-K566 WeakPolarHBondContact O-CD 3.31Å; G563-K566 VanDerWaalsContact O-CE 3.3Å; G563-K566 WeakPolarHBondContact O-CE 3.29Å; G563-K566 PolarHBondContact O-NZ 2.87Å; K566-H568 HydrophobicContact CB-CB 4.26Å; K566-H568 PolarHBondContact O-N 3.08Å; K566-D569 WeakPolarHBondContact CB-OD2 3.3Å; K566-D569 PolarHBondContact N-OD2 2.69Å; K566-D569 PolarHBondContact O-N 3.34Å; K566-I570 WeakPolarHBondContact O-CG1 3.27Å; K566-I570 PolarHBondContact O-N 3.19Å; K566-I570 VanDerWaalsContact O-N 3.15Å
567	L	98.5	Very high	96	Very high	7 Å²	7	61.2 Å²	61.2	4%	0.037	31%	0.306	C	S	.	.	H	α-helix	trans	-60.6	-29.7	171.4	-176.5	65.5	0	0	0	112	V496 L504 V520 I570 L571 K597 I600 L601	V496-L567 HydrophobicContact CG2-CD1 4.2Å; L504-L567 HydrophobicContact CD1-CD1 4.33Å; V520-L567 HydrophobicContact CG1-CB 4.32Å; L567-I570 HydrophobicContact CD1-CB 4.45Å; L567-I570 PolarHBondContact O-N 2.6Å; L567-L571 HydrophobicContact CD1-CD1 4.23Å; L567-L571 HydrophobicContact CD1-CG 4.12Å; L567-L571 HydrophobicContact CD2-CD1 4.38Å; L567-L571 HydrophobicContact CG-CD1 3.92Å; L567-L571 HydrophobicContact CG-CG 4.24Å; L567-L571 WeakPolarHBondContact O-CB 3.41Å; L567-L571 WeakPolarHBondContact O-CG 3.43Å; L567-L571 PolarHBondContact O-N 3.04Å; L567-K597 HydrophobicContact CD2-CG 4.3Å; L567-I600 HydrophobicContact CD2-CB 4.01Å; L567-I600 HydrophobicContact CD2-CG2 3.58Å; L567-L601 HydrophobicContact CD2-CD2 3.87Å; L567-L601 HydrophobicContact CD2-CG 3.94Å
568	H	98.6	Very high	96.7	Very high	47 Å²	47	56.1 Å²	56.1	22%	0.218	29%	0.287	C	S	.	.	H	α-helix	trans	-54.2	-51.4	172.4	-177.3	109	0	0	0	111.4	K566 L571 G572 V573 E574 K597	K566-H568 HydrophobicContact CB-CB 4.26Å; K566-H568 PolarHBondContact O-N 3.08Å; H568-L571 PolarHBondContact O-N 3.17Å; H568-G572 PolarHBondContact O-N 3.49Å; H568-V573 HydrophobicContact CB-CG2 4.36Å; H568-V573 WeakPolarHBondContact O-CG2 3.43Å; H568-V573 PolarHBondContact O-N 2.91Å; H568-E574 IonicContact CE1-OE1 2.58Å; H568-E574 PolarHBondContact CE1-OE1 3.46Å; H568-E574 VanDerWaalsContact CE1-OE1 3.23Å; H568-E574 IonicContact NE2-OE1 2.73Å; H568-E574 IonicContact NE2-OE2 2.63Å; H568-K597 HydrophobicContact CB-CD 4.28Å
569	D	98.3	Very high	97.2	Very high	101 Å²	101	50.3 Å²	50.3	54%	0.54	28%	0.282	S	S	.	.	H	α-helix	trans	-68.5	-38	179.9	-30.6	-25.1	0	0	0	111.7	K566 L571 G572	K566-D569 WeakPolarHBondContact CB-OD2 3.3Å; K566-D569 PolarHBondContact N-OD2 2.69Å; K566-D569 PolarHBondContact O-N 3.34Å; D569-L571 VanDerWaalsContact C-N 3.31Å; D569-L571 PolarHBondContact O-N 3.35Å; D569-G572 PolarHBondContact O-N 3.29Å
570	I	98.5	Very high	97.5	Very high	31 Å²	31	49.6 Å²	49.6	16%	0.159	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-39.6	177.4	-66.6	166.3	0	0	0	111.3	V496 T500 L504 V520 R565 K566 L567	V496-I570 HydrophobicContact CG1-CG2 4.28Å; T500-I570 HydrophobicContact CG2-CG2 4.25Å; L504-I570 HydrophobicContact CD1-CD1 3.83Å; L504-I570 HydrophobicContact CD1-CG2 4.34Å; V520-I570 HydrophobicContact CG1-CD1 4.21Å; V520-I570 HydrophobicContact CG2-CD1 3.92Å; R565-I570 HydrophobicContact CG-CD1 4.04Å; R565-I570 HydrophobicContact CG-CG1 4.33Å; K566-I570 WeakPolarHBondContact O-CG1 3.27Å; K566-I570 PolarHBondContact O-N 3.19Å; K566-I570 VanDerWaalsContact O-N 3.15Å; L567-I570 HydrophobicContact CD1-CB 4.45Å; L567-I570 PolarHBondContact O-N 2.6Å
571	L	98.6	Very high	97.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-82.1	-15.9	177.4	-66.9	176.1	0	0	0	112.9	V496 T500 L567 H568 D569 V573 G577 P578 Y593 F596 K597	V496-L571 HydrophobicContact CG1-CD2 4.2Å; V496-L571 HydrophobicContact CG2-CD2 4.49Å; T500-L571 HydrophobicContact CG2-CD2 4.48Å; L567-L571 HydrophobicContact CD1-CD1 4.23Å; L567-L571 HydrophobicContact CD1-CG 4.12Å; L567-L571 HydrophobicContact CD2-CD1 4.38Å; L567-L571 HydrophobicContact CG-CD1 3.92Å; L567-L571 HydrophobicContact CG-CG 4.24Å; L567-L571 WeakPolarHBondContact O-CB 3.41Å; L567-L571 WeakPolarHBondContact O-CG 3.43Å; L567-L571 PolarHBondContact O-N 3.04Å; H568-L571 PolarHBondContact O-N 3.17Å; D569-L571 VanDerWaalsContact C-N 3.31Å; D569-L571 PolarHBondContact O-N 3.35Å; L571-V573 HydrophobicContact CB-CG2 4Å; L571-G577 CarbonylContact O-C 3.27Å; L571-G577 VanDerWaalsContact O-C 3.27Å; L571-G577 VanDerWaalsContact O-CA 3.27Å; L571-G577 WeakPolarHBondContact O-CA 3.39Å; L571-P578 VanDerWaalsContact O-CD 3.29Å; L571-P578 WeakPolarHBondContact O-CD 3.38Å; L571-Y593 HydrophobicContact CB-CD1 4.46Å; L571-F596 HydrophobicContact CD1-CD1 3.98Å; L571-F596 HydrophobicContact CD1-CE1 4.37Å; L571-F596 HydrophobicContact CD2-CD1 4.02Å; L571-F596 HydrophobicContact CD2-CE1 3.7Å; L571-K597 HydrophobicContact CD1-CB 3.99Å; L571-K597 HydrophobicContact CD1-CG 4.4Å
572	G	98.4	Very high	97.7	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.01	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	38.8	-175.6	0	0	0	0	0	113.4	H568 D569 E574 T575 G577	H568-G572 PolarHBondContact O-N 3.49Å; D569-G572 PolarHBondContact O-N 3.29Å; G572-E574 PolarHBondContact O-N 3Å; G572-E574 VanDerWaalsContact O-N 3.12Å; G572-T575 WeakPolarHBondContact CA-OG1 3.3Å; G572-T575 PolarHBondContact O-N 2.98Å; G572-T575 PolarHBondContact O-OG1 3.2Å; G572-G577 WeakPolarHBondContact O-CA 3.44Å; G572-G577 PolarHBondContact O-N 3.17Å
573	V	98.1	Very high	97.6	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-41.1	-169.1	173.2	0	0	0	0	113.4	H568 L571 V590 L594 K597	H568-V573 HydrophobicContact CB-CG2 4.36Å; H568-V573 WeakPolarHBondContact O-CG2 3.43Å; H568-V573 PolarHBondContact O-N 2.91Å; L571-V573 HydrophobicContact CB-CG2 4Å; V573-V590 HydrophobicContact CG1-CG1 4.11Å; V573-L594 HydrophobicContact CG1-CD2 3.88Å; V573-L594 HydrophobicContact CG1-CG 3.94Å; V573-K597 HydrophobicContact CG2-CD 4.43Å
574	E	97.6	Very high	97.3	Very high	131 Å²	131	55.1 Å²	55.1	61%	0.612	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	1.8	180	-69.5	170.4	-163	0	0	112.8	H568 G572 V590	H568-E574 IonicContact CE1-OE1 2.58Å; H568-E574 PolarHBondContact CE1-OE1 3.46Å; H568-E574 VanDerWaalsContact CE1-OE1 3.23Å; H568-E574 IonicContact NE2-OE1 2.73Å; H568-E574 IonicContact NE2-OE2 2.63Å; G572-E574 PolarHBondContact O-N 3Å; G572-E574 VanDerWaalsContact O-N 3.12Å; E574-V590 HydrophobicContact CG-CG1 3.9Å
575	T	97.6	Very high	97.2	Very high	92 Å²	92	56 Å²	56	56%	0.564	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	31.1	-169.8	69.4	0	0	0	0	113	G572 G580	G572-T575 WeakPolarHBondContact CA-OG1 3.3Å; G572-T575 PolarHBondContact O-N 2.98Å; G572-T575 PolarHBondContact O-OG1 3.2Å; T575-G580 WeakPolarHBondContact O-CA 3.15Å
576	G	96.4	Very high	97	Very high	12 Å²	12	58.1 Å²	58.1	12%	0.124	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	35.9	-178.1	0	0	0	0	0	114	G580 R581 R582 L583	G576-G580 CarbonylContact O-C 3.08Å; G576-G580 VanDerWaalsContact O-CA 3.29Å; G576-G580 WeakPolarHBondContact O-CA 3.44Å; G576-R581 PolarHBondContact O-N 2.77Å; G576-R582 CarbonylContact O-C 3.3Å; G576-R582 VanDerWaalsContact O-C 3.3Å; G576-R582 VanDerWaalsContact O-CA 3.28Å; G576-R582 WeakPolarHBondContact O-CA 3.23Å; G576-R582 WeakPolarHBondContact O-CB 3.42Å; G576-R582 PolarHBondContact O-N 3.27Å; G576-L583 PolarHBondContact O-N 3.1Å
577	G	98.1	Very high	96.6	Very high	0 Å²	0	54 Å²	54	0%	0	32%	0.315	C	S	.	.	S	Bend	trans	73.4	-167.9	175.4	0	0	0	0	0	115.2	L571 G572 G579 G580 Y593	L571-G577 CarbonylContact O-C 3.27Å; L571-G577 VanDerWaalsContact O-C 3.27Å; L571-G577 VanDerWaalsContact O-CA 3.27Å; L571-G577 WeakPolarHBondContact O-CA 3.39Å; G572-G577 WeakPolarHBondContact O-CA 3.44Å; G572-G577 PolarHBondContact O-N 3.17Å; G577-G579 PolarHBondContact O-N 3.44Å; G577-G580 PolarHBondContact O-N 3.17Å; G577-Y593 VanDerWaalsContact CA-OH 3.29Å; G577-Y593 WeakPolarHBondContact CA-OH 3.48Å
578	P	97.7	Very high	96.6	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.039	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-58.5	104.5	-172.6	-28.2	37	0	0	0	113.3	T500 L571 R581 Y593	T500-P578 HydrophobicContact CG2-CB 4.19Å; T500-P578 HydrophobicContact CG2-CG 4.05Å; L571-P578 VanDerWaalsContact O-CD 3.29Å; L571-P578 WeakPolarHBondContact O-CD 3.38Å; P578-R581 WeakPolarHBondContact O-CG 3.31Å; P578-R581 VanDerWaalsContact O-CZ 3.24Å; P578-R581 PolarHBondContact O-NE 3.09Å; P578-Y593 WeakPolarHBondContact CD-OH 3.29Å
579	G	96.3	Very high	96.4	Very high	72 Å²	72	54.6 Å²	54.6	74%	0.742	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	68.2	28.1	-176.8	0	0	0	0	0	114.5	G577 R581	G577-G579 PolarHBondContact O-N 3.44Å; G579-R581 PolarHBondContact O-N 2.66Å
580	G	97.4	Very high	96.4	Very high	37 Å²	37	53 Å²	53	38%	0.381	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	73.2	4.1	-180	0	0	0	0	0	115	T575 G576 G577 R582 L583	T575-G580 WeakPolarHBondContact O-CA 3.15Å; G576-G580 CarbonylContact O-C 3.08Å; G576-G580 VanDerWaalsContact O-CA 3.29Å; G576-G580 WeakPolarHBondContact O-CA 3.44Å; G577-G580 PolarHBondContact O-N 3.17Å; G580-R582 PolarHBondContact O-N 3.31Å; G580-L583 PolarHBondContact O-N 2.99Å
581	R	96.8	Very high	96.3	Very high	89 Å²	89	54.6 Å²	54.6	34%	0.336	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	2.8	-171.2	-56.3	-171.2	-58.6	-106.4	3	114.7	R399 T500 G576 P578 G579	R399-R581 PolarHBondContact O-NH2 3.42Å; T500-R581 PolarHBondContact O-NH2 3.09Å; G576-R581 PolarHBondContact O-N 2.77Å; P578-R581 WeakPolarHBondContact O-CG 3.31Å; P578-R581 VanDerWaalsContact O-CZ 3.24Å; P578-R581 PolarHBondContact O-NE 3.09Å; G579-R581 PolarHBondContact O-N 2.66Å
582	R	97.5	Very high	96.2	Very high	39 Å²	39	55 Å²	55	15%	0.147	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	14	-177.7	-54.8	-64.1	176	-164.9	-6.3	112.1	G400 G576 G580 D584 E585 H588	G400-R582 PolarHBondContact O-NH2 2.85Å; G576-R582 CarbonylContact O-C 3.3Å; G576-R582 VanDerWaalsContact O-C 3.3Å; G576-R582 VanDerWaalsContact O-CA 3.28Å; G576-R582 WeakPolarHBondContact O-CA 3.23Å; G576-R582 WeakPolarHBondContact O-CB 3.42Å; G576-R582 PolarHBondContact O-N 3.27Å; G580-R582 PolarHBondContact O-N 3.31Å; R582-D584 PolarHBondContact O-N 2.98Å; R582-E585 WeakPolarHBondContact CD-OE1 3.36Å; R582-E585 WeakPolarHBondContact CD-OE2 3.28Å; R582-E585 IonicContact CZ-OE1 3.03Å; R582-E585 IonicContact CZ-OE2 2.97Å; R582-E585 IonicContact NE-OE1 2.67Å; R582-E585 IonicContact NE-OE2 2.81Å; R582-E585 IonicContact NH1-OE1 3.27Å; R582-E585 PolarHBondContact NH1-OE1 3.43Å; R582-E585 IonicContact NH1-OE2 3.31Å; R582-E585 PolarHBondContact NH1-OE2 3.46Å; R582-E585 PolarHBondContact O-N 2.97Å; R582-H588 HydrophobicContact CB-CB 4Å
583	L	94.9	Very high	96.2	Very high	112 Å²	112	55 Å²	55	59%	0.586	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	132.8	172.1	-168.3	66.8	0	0	0	108.9	G576 G580 E585	G576-L583 PolarHBondContact O-N 3.1Å; G580-L583 PolarHBondContact O-N 2.99Å; L583-E585 PolarHBondContact O-N 3.14Å
584	D	91.1	Very high	96.2	Very high	151 Å²	151	58.3 Å²	58.3	81%	0.807	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	9.7	-178.1	-49	-37.8	0	0	0	116.3	R582 P586	R582-D584 PolarHBondContact O-N 2.98Å; D584-P586 WeakPolarHBondContact O-CD 3.44Å
585	E	94.6	Very high	96.3	Very high	68 Å²	68	54.2 Å²	54.2	32%	0.318	33%	0.33	S	S	.	.			trans	-76.1	125.1	172.5	-78.6	-166.1	-159.1	0	0	111.5	R582 L583 G587 H588	R582-E585 WeakPolarHBondContact CD-OE1 3.36Å; R582-E585 WeakPolarHBondContact CD-OE2 3.28Å; R582-E585 IonicContact CZ-OE1 3.03Å; R582-E585 IonicContact CZ-OE2 2.97Å; R582-E585 IonicContact NE-OE1 2.67Å; R582-E585 IonicContact NE-OE2 2.81Å; R582-E585 IonicContact NH1-OE1 3.27Å; R582-E585 PolarHBondContact NH1-OE1 3.43Å; R582-E585 IonicContact NH1-OE2 3.31Å; R582-E585 PolarHBondContact NH1-OE2 3.46Å; R582-E585 PolarHBondContact O-N 2.97Å; L583-E585 PolarHBondContact O-N 3.14Å; E585-G587 PolarHBondContact O-N 2.67Å; E585-H588 HydrophobicContact CB-CB 4.49Å; E585-H588 VanDerWaalsContact CB-ND1 3.35Å; E585-H588 WeakPolarHBondContact CB-ND1 3.35Å; E585-H588 WeakPolarHBondContact O-CB 3.48Å; E585-H588 PolarHBondContact O-N 3.4Å; E585-H588 PolarHBondContact O-ND1 3.28Å; E585-H588 IonicContact OE2-CE1 3.13Å; E585-H588 PolarHBondContact OE2-CE1 3.32Å; E585-H588 IonicContact OE2-ND1 2.87Å; E585-H588 PolarHBondContact OE2-ND1 3.15Å; E585-H588 IonicContact OE2-NE2 2.67Å
586	P	92.9	Very high	96.3	Very high	111 Å²	111	49.9 Å²	49.9	72%	0.721	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	138.8	174.7	-28.2	36.2	0	0	0	113.5	D584 H588	D584-P586 WeakPolarHBondContact O-CD 3.44Å; P586-H588 VanDerWaalsContact C-N 3.34Å; P586-H588 PolarHBondContact O-ND1 3.17Å
587	G	91.8	Very high	96.4	Very high	26 Å²	26	51.7 Å²	51.7	27%	0.268	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	7.8	-177	0	0	0	0	0	115.7	E585	E585-G587 PolarHBondContact O-N 2.67Å
588	H	97	Very high	96.5	Very high	15 Å²	15	54.4 Å²	54.4	7%	0.069	32%	0.323	C	S	.	.			trans	-117.2	37.9	176	-57.6	93.7	0	0	0	112.2	S402 L403 H499 R582 E585 P586 Y593	S402-H588 WeakPolarHBondContact CA-NE2 3.28Å; L403-H588 VanDerWaalsContact CB-CD2 3.49Å; L403-H588 WeakPolarHBondContact CB-CD2 3.45Å; L403-H588 PolarHBondContact N-NE2 2.96Å; H499-H588 AromaticContact CE1-CD2 3.78Å; H499-H588 AromaticContact CE1-NE2 3.86Å; R582-H588 HydrophobicContact CB-CB 4Å; E585-H588 HydrophobicContact CB-CB 4.49Å; E585-H588 VanDerWaalsContact CB-ND1 3.35Å; E585-H588 WeakPolarHBondContact CB-ND1 3.35Å; E585-H588 WeakPolarHBondContact O-CB 3.48Å; E585-H588 PolarHBondContact O-N 3.4Å; E585-H588 PolarHBondContact O-ND1 3.28Å; E585-H588 IonicContact OE2-CE1 3.13Å; E585-H588 PolarHBondContact OE2-CE1 3.32Å; E585-H588 IonicContact OE2-ND1 2.87Å; E585-H588 PolarHBondContact OE2-ND1 3.15Å; E585-H588 IonicContact OE2-NE2 2.67Å; P586-H588 VanDerWaalsContact C-N 3.34Å; P586-H588 PolarHBondContact O-ND1 3.17Å; H588-Y593 HydrophobicContact CB-CE2 3.84Å; H588-Y593 PolarHBondContact CD2-OH 3.33Å; H588-Y593 WeakPolarHBondContact O-CD2 3.49Å; H588-Y593 VanDerWaalsContact O-CE2 3.24Å; H588-Y593 WeakPolarHBondContact O-CE2 3.38Å
589	S	96.1	Very high	96.5	Very high	51 Å²	51	54.1 Å²	54.1	36%	0.357	32%	0.321	S	S	.	.			trans	-66.8	155.3	179.2	80.4	0	0	0	0	112	S591 D592 Y593	S589-S591 PolarHBondContact O-N 3.22Å; S589-S591 WeakPolarHBondContact OG-CB 3.44Å; S589-S591 PolarHBondContact OG-N 3.19Å; S589-D592 WeakPolarHBondContact CB-OD2 3.39Å; S589-D592 PolarHBondContact O-N 2.99Å; S589-D592 VanDerWaalsContact OG-CG 3.26Å; S589-D592 PolarHBondContact OG-N 3.45Å; S589-D592 VanDerWaalsContact OG-N 3.08Å; S589-D592 PolarHBondContact OG-OD2 3.4Å; S589-Y593 WeakPolarHBondContact O-CD2 3.48Å; S589-Y593 PolarHBondContact O-N 2.98Å
590	V	97.1	Very high	96.7	Very high	68 Å²	68	50.7 Å²	50.7	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-53.3	-36.9	171.6	-175	0	0	0	0	110.9	V573 E574 Y593 L594	V573-V590 HydrophobicContact CG1-CG1 4.11Å; E574-V590 HydrophobicContact CG-CG1 3.9Å; V590-Y593 PolarHBondContact O-N 3.35Å; V590-L594 HydrophobicContact CG1-CD1 4.2Å; V590-L594 HydrophobicContact CG1-CG 4.45Å; V590-L594 WeakPolarHBondContact O-CB 3.27Å; V590-L594 VanDerWaalsContact O-CG 3.24Å; V590-L594 WeakPolarHBondContact O-CG 3.29Å; V590-L594 PolarHBondContact O-N 2.96Å
591	S	96.6	Very high	96.7	Very high	63 Å²	63	52.4 Å²	52.4	44%	0.441	29%	0.285	S	S	.	.	H	α-helix	trans	-62.2	-43.2	175.6	-174.2	0	0	0	0	112.3	S589 L594 K595	S589-S591 PolarHBondContact O-N 3.22Å; S589-S591 WeakPolarHBondContact OG-CB 3.44Å; S589-S591 PolarHBondContact OG-N 3.19Å; S591-L594 PolarHBondContact O-N 3.41Å; S591-K595 WeakPolarHBondContact O-CE 3.49Å; S591-K595 VanDerWaalsContact O-CG 3.27Å; S591-K595 WeakPolarHBondContact O-CG 3.27Å; S591-K595 PolarHBondContact O-N 3.12Å; S591-K595 VanDerWaalsContact OG-CE 3.24Å; S591-K595 WeakPolarHBondContact OG-CE 3.35Å
592	D	96.6	Very high	96.8	Very high	9 Å²	9	54 Å²	54	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-71.3	-37.3	178.5	-60.8	-53.3	0	0	0	112.3	L403 S589 K595 F596	L403-D592 HydrophobicContact CD2-CB 3.79Å; S589-D592 WeakPolarHBondContact CB-OD2 3.39Å; S589-D592 PolarHBondContact O-N 2.99Å; S589-D592 VanDerWaalsContact OG-CG 3.26Å; S589-D592 PolarHBondContact OG-N 3.45Å; S589-D592 VanDerWaalsContact OG-N 3.08Å; S589-D592 PolarHBondContact OG-OD2 3.4Å; D592-K595 PolarHBondContact O-N 2.89Å; D592-K595 IonicContact OD1-NZ 3.18Å; D592-K595 PolarHBondContact OD1-NZ 3.49Å; D592-F596 WeakPolarHBondContact O-CB 3.29Å; D592-F596 PolarHBondContact O-N 2.9Å
593	Y	98.4	Very high	96.9	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-38.4	170.6	-83.4	-61.4	0	0	0	112.8	L403 H499 L571 G577 P578 H588 S589 V590 F596 K597	L403-Y593 HydrophobicContact CD2-CD1 4.31Å; L403-Y593 HydrophobicContact CD2-CE1 4.33Å; H499-Y593 AromaticContact CD2-CE1 3.81Å; H499-Y593 AromaticContact NE2-CE1 3.27Å; H499-Y593 VanDerWaalsContact NE2-CE1 3.27Å; H499-Y593 WeakPolarHBondContact NE2-CE1 3.18Å; H499-Y593 AromaticContact NE2-CZ 3.52Å; H499-Y593 PolarHBondContact NE2-OH 2.85Å; L571-Y593 HydrophobicContact CB-CD1 4.46Å; G577-Y593 VanDerWaalsContact CA-OH 3.29Å; G577-Y593 WeakPolarHBondContact CA-OH 3.48Å; P578-Y593 WeakPolarHBondContact CD-OH 3.29Å; H588-Y593 HydrophobicContact CB-CE2 3.84Å; H588-Y593 PolarHBondContact CD2-OH 3.33Å; H588-Y593 WeakPolarHBondContact O-CD2 3.49Å; H588-Y593 VanDerWaalsContact O-CE2 3.24Å; H588-Y593 WeakPolarHBondContact O-CE2 3.38Å; S589-Y593 WeakPolarHBondContact O-CD2 3.48Å; S589-Y593 PolarHBondContact O-N 2.98Å; V590-Y593 PolarHBondContact O-N 3.35Å; Y593-F596 PolarHBondContact O-N 2.97Å; Y593-K597 WeakPolarHBondContact O-CB 3.42Å; Y593-K597 PolarHBondContact O-N 3.43Å
594	L	98.5	Very high	97.1	Very high	70 Å²	70	47 Å²	47	37%	0.366	26%	0.258	S	S	.	.	H	α-helix	trans	-65.7	-43.3	174.2	-74.3	171.2	0	0	0	111.9	V573 V590 S591 F596 K597 D598	V573-L594 HydrophobicContact CG1-CD2 3.88Å; V573-L594 HydrophobicContact CG1-CG 3.94Å; V590-L594 HydrophobicContact CG1-CD1 4.2Å; V590-L594 HydrophobicContact CG1-CG 4.45Å; V590-L594 WeakPolarHBondContact O-CB 3.27Å; V590-L594 VanDerWaalsContact O-CG 3.24Å; V590-L594 WeakPolarHBondContact O-CG 3.29Å; V590-L594 PolarHBondContact O-N 2.96Å; S591-L594 PolarHBondContact O-N 3.41Å; L594-F596 VanDerWaalsContact C-N 3.35Å; L594-F596 PolarHBondContact O-N 2.94Å; L594-K597 VanDerWaalsContact CD2-NZ 3.3Å; L594-D598 PolarHBondContact O-N 3.46Å
595	K	98.5	Very high	97.5	Very high	46 Å²	46	42.3 Å²	42.3	20%	0.2	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-43.2	172.8	-63.9	162.2	-147.8	165.1	0	111.5	S591 D592 L599 H620 F622 T626	S591-K595 WeakPolarHBondContact O-CE 3.49Å; S591-K595 VanDerWaalsContact O-CG 3.27Å; S591-K595 WeakPolarHBondContact O-CG 3.27Å; S591-K595 PolarHBondContact O-N 3.12Å; S591-K595 VanDerWaalsContact OG-CE 3.24Å; S591-K595 WeakPolarHBondContact OG-CE 3.35Å; D592-K595 PolarHBondContact O-N 2.89Å; D592-K595 IonicContact OD1-NZ 3.18Å; D592-K595 PolarHBondContact OD1-NZ 3.49Å; K595-L599 PolarHBondContact O-N 3.4Å; K595-H620 PolarHBondContact O-CE1 3.13Å; K595-H620 VanDerWaalsContact O-CE1 3.23Å; K595-F622 HydrophobicContact CB-CB 4.12Å; K595-F622 HydrophobicContact CB-CD2 4.19Å; K595-T626 VanDerWaalsContact NZ-CG2 3.32Å
596	F	98.8	Very high	97.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.7	-48.6	179.4	-175.5	-128.1	0	0	0	111.6	L403 T406 L495 H499 L571 D592 Y593 L594 D598 L599 I600 F622	L403-F596 HydrophobicContact CD1-CB 4.07Å; L403-F596 HydrophobicContact CD1-CD1 3.72Å; L403-F596 HydrophobicContact CD1-CD2 4.12Å; L403-F596 HydrophobicContact CD1-CE1 4.16Å; L403-F596 HydrophobicContact CD1-CG 3.71Å; T406-F596 HydrophobicContact CG2-CE2 3.93Å; T406-F596 HydrophobicContact CG2-CZ 3.82Å; L495-F596 HydrophobicContact CB-CE2 4.18Å; L495-F596 HydrophobicContact CB-CZ 4.14Å; H499-F596 HydrophobicContact CB-CE1 4.44Å; L571-F596 HydrophobicContact CD1-CD1 3.98Å; L571-F596 HydrophobicContact CD1-CE1 4.37Å; L571-F596 HydrophobicContact CD2-CD1 4.02Å; L571-F596 HydrophobicContact CD2-CE1 3.7Å; D592-F596 WeakPolarHBondContact O-CB 3.29Å; D592-F596 PolarHBondContact O-N 2.9Å; Y593-F596 PolarHBondContact O-N 2.97Å; L594-F596 VanDerWaalsContact C-N 3.35Å; L594-F596 PolarHBondContact O-N 2.94Å; F596-D598 VanDerWaalsContact C-N 3.29Å; F596-D598 PolarHBondContact O-N 3.5Å; F596-L599 PolarHBondContact O-N 3.29Å; F596-I600 HydrophobicContact CD2-CD1 4.46Å; F596-I600 HydrophobicContact CD2-CG1 4.11Å; F596-I600 HydrophobicContact CE1-CG1 4.3Å; F596-I600 HydrophobicContact CE2-CD1 3.77Å; F596-I600 HydrophobicContact CE2-CG1 3.81Å; F596-I600 HydrophobicContact CG-CG1 4.48Å; F596-I600 HydrophobicContact CZ-CD1 3.96Å; F596-I600 HydrophobicContact CZ-CG1 3.91Å; F596-I600 WeakPolarHBondContact O-CG1 3.28Å; F596-I600 PolarHBondContact O-N 3.17Å; F596-F622 HydrophobicContact CB-CD2 3.87Å; F596-F622 HydrophobicContact CB-CE2 3.66Å; F596-F622 HydrophobicContact CB-CZ 4.28Å; F596-F622 HydrophobicContact CD2-CD1 4.32Å; F596-F622 HydrophobicContact CD2-CD2 4.28Å; F596-F622 AromaticContact CD2-CE1 3.76Å; F596-F622 HydrophobicContact CD2-CE1 3.76Å; F596-F622 AromaticContact CD2-CE2 3.75Å; F596-F622 HydrophobicContact CD2-CE2 3.75Å; F596-F622 AromaticContact CD2-CZ 3.45Å; F596-F622 HydrophobicContact CD2-CZ 3.45Å; F596-F622 VanDerWaalsContact CD2-CZ 3.45Å; F596-F622 HydrophobicContact CE2-CE1 4.25Å; F596-F622 HydrophobicContact CE2-CZ 4.1Å; F596-F622 HydrophobicContact CG-CE2 4.02Å; F596-F622 HydrophobicContact CG-CZ 4.13Å
597	K	98.8	Very high	97.9	Very high	50 Å²	50	35.2 Å²	35.2	22%	0.217	19%	0.19	C	C	.	.	H	α-helix	trans	-53.6	-44.5	175.6	-176.3	-160.1	72.8	-177.8	0	111.7	L567 H568 L571 V573 Y593 L594 I600 L601	L567-K597 HydrophobicContact CD2-CG 4.3Å; H568-K597 HydrophobicContact CB-CD 4.28Å; L571-K597 HydrophobicContact CD1-CB 3.99Å; L571-K597 HydrophobicContact CD1-CG 4.4Å; V573-K597 HydrophobicContact CG2-CD 4.43Å; Y593-K597 WeakPolarHBondContact O-CB 3.42Å; Y593-K597 PolarHBondContact O-N 3.43Å; L594-K597 VanDerWaalsContact CD2-NZ 3.3Å; K597-I600 PolarHBondContact O-N 2.81Å; K597-L601 HydrophobicContact CG-CD1 4.2Å; K597-L601 VanDerWaalsContact O-CG 3.31Å; K597-L601 WeakPolarHBondContact O-CG 3.35Å; K597-L601 PolarHBondContact O-N 3.43Å
598	D	98.8	Very high	98.2	Very high	58 Å²	58	34.9 Å²	34.9	31%	0.31	18%	0.183	S	C	.	.	H	α-helix	trans	-64.4	-45.5	178.7	-167.1	63.8	0	0	0	112.2	L594 F596 I600 L601 R602 H620	L594-D598 PolarHBondContact O-N 3.46Å; F596-D598 VanDerWaalsContact C-N 3.29Å; F596-D598 PolarHBondContact O-N 3.5Å; D598-I600 PolarHBondContact O-N 3.04Å; D598-L601 PolarHBondContact O-N 3.39Å; D598-R602 VanDerWaalsContact O-CG 3.32Å; D598-R602 WeakPolarHBondContact O-CG 3.09Å; D598-R602 PolarHBondContact O-N 3.28Å; D598-R602 VanDerWaalsContact O-N 3.09Å; D598-R602 IonicContact OD1-NE 3.19Å; D598-R602 IonicContact OD1-NH2 3.23Å; D598-R602 IonicContact OD2-CZ 2.59Å; D598-R602 IonicContact OD2-NE 3.62Å; D598-R602 PolarHBondContact OD2-NE 3.47Å; D598-R602 IonicContact OD2-NH2 2.69Å; D598-R602 PolarHBondContact OD2-NH2 3.19Å; D598-H620 IonicContact OD2-CE1 3.53Å; D598-H620 IonicContact OD2-NE2 3.59Å; D598-H620 PolarHBondContact OD2-NE2 2.78Å
599	L	98.9	Very high	98.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59	-46.3	175.5	-177.9	59.2	0	0	0	111.9	K595 F596 R602 M603 A617 H620 F622 F623	K595-L599 PolarHBondContact O-N 3.4Å; F596-L599 PolarHBondContact O-N 3.29Å; L599-R602 PolarHBondContact O-N 2.97Å; L599-M603 HydrophobicContact CD1-CE 4.03Å; L599-M603 HydrophobicContact CD2-CE 4.13Å; L599-M603 HydrophobicContact CG-CE 3.94Å; L599-M603 HydrophobicContact CG-SD 4.29Å; L599-M603 WeakPolarHBondContact O-CG 3.42Å; L599-M603 PolarHBondContact O-N 3.38Å; L599-A617 HydrophobicContact CD1-CB 4.25Å; L599-H620 HydrophobicContact CD1-CB 3.95Å; L599-F622 HydrophobicContact CD2-CB 4.16Å; L599-F622 HydrophobicContact CD2-CD1 3.6Å; L599-F622 HydrophobicContact CD2-CE1 4.41Å; L599-F622 HydrophobicContact CD2-CG 4.22Å; L599-F623 HydrophobicContact CD2-CE2 3.81Å; L599-F623 HydrophobicContact CD2-CZ 3.97Å
600	I	98.9	Very high	98.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-40.5	179.8	-63.3	-59.9	0	0	0	111.5	L495 V496 L567 F596 K597 D598 R602 M603 L604	L495-I600 HydrophobicContact CB-CD1 3.76Å; L495-I600 HydrophobicContact CD1-CD1 4.19Å; V496-I600 HydrophobicContact CG2-CB 4.43Å; V496-I600 HydrophobicContact CG2-CD1 4.15Å; V496-I600 HydrophobicContact CG2-CG1 4.02Å; V496-I600 HydrophobicContact CG2-CG2 3.62Å; L567-I600 HydrophobicContact CD2-CB 4.01Å; L567-I600 HydrophobicContact CD2-CG2 3.58Å; F596-I600 HydrophobicContact CD2-CD1 4.46Å; F596-I600 HydrophobicContact CD2-CG1 4.11Å; F596-I600 HydrophobicContact CE1-CG1 4.3Å; F596-I600 HydrophobicContact CE2-CD1 3.77Å; F596-I600 HydrophobicContact CE2-CG1 3.81Å; F596-I600 HydrophobicContact CG-CG1 4.48Å; F596-I600 HydrophobicContact CZ-CD1 3.96Å; F596-I600 HydrophobicContact CZ-CG1 3.91Å; F596-I600 WeakPolarHBondContact O-CG1 3.28Å; F596-I600 PolarHBondContact O-N 3.17Å; K597-I600 PolarHBondContact O-N 2.81Å; D598-I600 PolarHBondContact O-N 3.04Å; I600-R602 VanDerWaalsContact C-N 3.3Å; I600-R602 PolarHBondContact O-N 3.48Å; I600-M603 HydrophobicContact CD1-SD 4.12Å; I600-M603 PolarHBondContact O-N 3.5Å; I600-L604 HydrophobicContact CG2-CD1 3.69Å; I600-L604 HydrophobicContact CG2-CG 4.21Å; I600-L604 WeakPolarHBondContact O-CB 3.32Å; I600-L604 WeakPolarHBondContact O-CG 3.09Å; I600-L604 PolarHBondContact O-N 3.41Å
601	L	98.9	Very high	98.4	Very high	73 Å²	73	41 Å²	41	38%	0.382	21%	0.205	S	C	.	.	H	α-helix	trans	-63.4	-36.5	176.2	-71.8	172.2	0	0	0	112.1	L521 L567 K597 D598 L604 D605	L521-L601 HydrophobicContact CD2-CD2 4.22Å; L567-L601 HydrophobicContact CD2-CD2 3.87Å; L567-L601 HydrophobicContact CD2-CG 3.94Å; K597-L601 HydrophobicContact CG-CD1 4.2Å; K597-L601 VanDerWaalsContact O-CG 3.31Å; K597-L601 WeakPolarHBondContact O-CG 3.35Å; K597-L601 PolarHBondContact O-N 3.43Å; D598-L601 PolarHBondContact O-N 3.39Å; L601-L604 CarbonylContact O-C 3.56Å; L601-L604 PolarHBondContact O-N 3.01Å; L601-D605 PolarHBondContact O-N 3.23Å
602	R	98.9	Very high	98.5	Very high	123 Å²	123	38.8 Å²	38.8	46%	0.464	19%	0.189	S	C	.	.	H	α-helix	trans	-69.8	-30.8	173.5	-63.1	171.1	-168.2	-97	-1.9	113.4	D598 L599 I600 L604 V612	D598-R602 VanDerWaalsContact O-CG 3.32Å; D598-R602 WeakPolarHBondContact O-CG 3.09Å; D598-R602 PolarHBondContact O-N 3.28Å; D598-R602 VanDerWaalsContact O-N 3.09Å; D598-R602 IonicContact OD1-NE 3.19Å; D598-R602 IonicContact OD1-NH2 3.23Å; D598-R602 IonicContact OD2-CZ 2.59Å; D598-R602 IonicContact OD2-NE 3.62Å; D598-R602 PolarHBondContact OD2-NE 3.47Å; D598-R602 IonicContact OD2-NH2 2.69Å; D598-R602 PolarHBondContact OD2-NH2 3.19Å; L599-R602 PolarHBondContact O-N 2.97Å; I600-R602 VanDerWaalsContact C-N 3.3Å; I600-R602 PolarHBondContact O-N 3.48Å; R602-L604 VanDerWaalsContact C-N 3.35Å; R602-V612 HydrophobicContact CB-CB 3.9Å; R602-V612 HydrophobicContact CB-CG1 3.8Å; R602-V612 PolarHBondContact O-N 3.02Å
603	M	98.9	Very high	98.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-73.6	-26.9	172.2	-71.1	177	167.3	0	0	112.5	M488 L491 L495 L599 I600 R611 V612 A617	M488-M603 HydrophobicContact CE-CE 3.86Å; M488-M603 HydrophobicContact CE-CG 4.04Å; L491-M603 HydrophobicContact CD2-CE 3.75Å; L491-M603 HydrophobicContact CG-CE 4.05Å; L491-M603 HydrophobicContact CG-SD 4.24Å; L495-M603 HydrophobicContact CD1-CE 4.04Å; L495-M603 HydrophobicContact CD1-SD 4.01Å; L599-M603 HydrophobicContact CD1-CE 4.03Å; L599-M603 HydrophobicContact CD2-CE 4.13Å; L599-M603 HydrophobicContact CG-CE 3.94Å; L599-M603 HydrophobicContact CG-SD 4.29Å; L599-M603 WeakPolarHBondContact O-CG 3.42Å; L599-M603 PolarHBondContact O-N 3.38Å; I600-M603 HydrophobicContact CD1-SD 4.12Å; I600-M603 PolarHBondContact O-N 3.5Å; M603-R611 VanDerWaalsContact O-CD 3.24Å; M603-R611 WeakPolarHBondContact O-CD 3.43Å; M603-R611 WeakPolarHBondContact O-CG 3.4Å; M603-V612 HydrophobicContact CG-CG1 3.87Å; M603-A617 HydrophobicContact CE-CB 4.46Å
604	L	98.9	Very high	98.6	Very high	4 Å²	4	42 Å²	42	2%	0.021	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	27.6	-178.7	-60.6	-179.9	0	0	0	112.9	W489 L504 F505 L521 I600 L601 R602	W489-L604 HydrophobicContact CD2-CD2 3.7Å; W489-L604 HydrophobicContact CE3-CB 4.26Å; W489-L604 HydrophobicContact CE3-CD2 3.79Å; W489-L604 HydrophobicContact CG-CD2 4.21Å; W489-L604 HydrophobicContact CH2-CD2 4.29Å; W489-L604 HydrophobicContact CZ2-CD2 4.21Å; W489-L604 HydrophobicContact CZ3-CB 4.01Å; W489-L604 HydrophobicContact CZ3-CD2 4.1Å; W489-L604 WeakPolarHBondContact CZ3-O 3.48Å; L504-L604 HydrophobicContact CD2-CD1 3.63Å; F505-L604 HydrophobicContact CE2-CD1 4.16Å; F505-L604 HydrophobicContact CE2-CD2 4.39Å; F505-L604 HydrophobicContact CZ-CD1 4.29Å; L521-L604 HydrophobicContact CD1-CB 4.18Å; L521-L604 WeakPolarHBondContact CD1-O 3.37Å; L521-L604 HydrophobicContact CD2-CB 4.42Å; I600-L604 HydrophobicContact CG2-CD1 3.69Å; I600-L604 HydrophobicContact CG2-CG 4.21Å; I600-L604 WeakPolarHBondContact O-CB 3.32Å; I600-L604 WeakPolarHBondContact O-CG 3.09Å; I600-L604 PolarHBondContact O-N 3.41Å; L601-L604 CarbonylContact O-C 3.56Å; L601-L604 PolarHBondContact O-N 3.01Å; R602-L604 VanDerWaalsContact C-N 3.35Å
605	D	98.8	Very high	98.6	Very high	52 Å²	52	44.5 Å²	44.5	28%	0.278	22%	0.215	S	C	.	.			trans	-63.8	141.4	169.5	-164.2	-15.8	0	0	0	110.4	L601 D607 T610 R611	L601-D605 PolarHBondContact O-N 3.23Å; D605-D607 PolarHBondContact OD1-N 2.78Å; D605-T610 VanDerWaalsContact OD2-CB 3.3Å; D605-T610 WeakPolarHBondContact OD2-CB 3.24Å; D605-T610 PolarHBondContact OD2-OG1 3.05Å; D605-R611 HydrophobicContact CB-CB 3.98Å; D605-R611 HydrophobicContact CB-CG 4.28Å; D605-R611 VanDerWaalsContact O-CZ 3.3Å; D605-R611 PolarHBondContact O-NE 3.22Å; D605-R611 PolarHBondContact O-NH2 3.39Å
606	F	98.6	Very high	98.6	Very high	16 Å²	16	49.3 Å²	49.3	7%	0.07	23%	0.232	C	C	.	.	S	Bend	trans	-70.9	-35.4	178.5	-82.7	-66.6	0	0	0	112.7	P474 I517 L521 G522 P524 P525 L528 P608	P474-F606 HydrophobicContact CB-CD1 3.9Å; P474-F606 HydrophobicContact CB-CE1 4.35Å; P474-F606 HydrophobicContact CG-CD1 3.69Å; P474-F606 HydrophobicContact CG-CE1 4.07Å; I517-F606 HydrophobicContact CG2-CE1 3.72Å; I517-F606 HydrophobicContact CG2-CZ 3.92Å; L521-F606 HydrophobicContact CB-CE2 3.6Å; L521-F606 HydrophobicContact CB-CZ 3.77Å; L521-F606 HydrophobicContact CD1-CE2 4.29Å; L521-F606 HydrophobicContact CD1-CZ 4.15Å; G522-F606 WeakPolarHBondContact O-CZ 3.18Å; P524-F606 HydrophobicContact CB-CD1 3.89Å; P524-F606 HydrophobicContact CB-CE1 3.97Å; P524-F606 HydrophobicContact CB-CG 4.21Å; P524-F606 HydrophobicContact CB-CZ 4.33Å; P524-F606 HydrophobicContact CG-CD1 4.09Å; P524-F606 HydrophobicContact CG-CE1 3.66Å; P524-F606 HydrophobicContact CG-CZ 3.95Å; P525-F606 HydrophobicContact CG-CB 4.22Å; L528-F606 HydrophobicContact CD1-CB 4Å; L528-F606 WeakPolarHBondContact CD1-O 3.4Å; F606-P608 WeakPolarHBondContact O-CD 3.21Å
607	D	98.4	Very high	98.6	Very high	13 Å²	13	49.3 Å²	49.3	7%	0.07	23%	0.232	C	C	.	.	S	Bend	trans	-88	117.3	174.9	-169.3	-18.2	0	0	0	109.8	Y527 L528 D605 K609 T610 R611	Y527-D607 WeakPolarHBondContact CE2-OD2 3.06Å; Y527-D607 WeakPolarHBondContact OH-CB 3.27Å; Y527-D607 PolarHBondContact OH-OD2 3.47Å; L528-D607 HydrophobicContact CD1-CB 4.19Å; L528-D607 HydrophobicContact CD2-CB 4.49Å; D605-D607 PolarHBondContact OD1-N 2.78Å; D607-K609 PolarHBondContact O-N 3.02Å; D607-K609 VanDerWaalsContact O-N 3.08Å; D607-K609 VanDerWaalsContact OD1-CB 3.29Å; D607-K609 WeakPolarHBondContact OD1-CB 3.19Å; D607-K609 VanDerWaalsContact OD1-CG 3.31Å; D607-K609 WeakPolarHBondContact OD1-CG 3.2Å; D607-K609 PolarHBondContact OD1-N 2.73Å; D607-T610 PolarHBondContact O-N 3.19Å; D607-T610 PolarHBondContact O-OG1 2.85Å; D607-R611 PolarHBondContact O-N 3.19Å
608	P	98	Very high	98.6	Very high	19 Å²	19	49.1 Å²	49.1	12%	0.123	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.4	175.1	24.2	-34.6	0	0	0	113.7	E475 A485 F606	E475-P608 HydrophobicContact CG-CG 4.39Å; A485-P608 HydrophobicContact CB-CB 3.58Å; F606-P608 WeakPolarHBondContact O-CD 3.21Å
609	K	97.6	Very high	98.5	Very high	165 Å²	165	51.2 Å²	51.2	72%	0.717	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-26.9	178.2	-60.4	172	-175.7	174.7	0	114.2	D607	D607-K609 PolarHBondContact O-N 3.02Å; D607-K609 VanDerWaalsContact O-N 3.08Å; D607-K609 VanDerWaalsContact OD1-CB 3.29Å; D607-K609 WeakPolarHBondContact OD1-CB 3.19Å; D607-K609 VanDerWaalsContact OD1-CG 3.31Å; D607-K609 WeakPolarHBondContact OD1-CG 3.2Å; D607-K609 PolarHBondContact OD1-N 2.73Å
610	T	98.3	Very high	98.5	Very high	90 Å²	90	52.1 Å²	52.1	55%	0.552	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107	-16.6	179	51.7	0	0	0	0	113	D605 D607 V612	D605-T610 VanDerWaalsContact OD2-CB 3.3Å; D605-T610 WeakPolarHBondContact OD2-CB 3.24Å; D605-T610 PolarHBondContact OD2-OG1 3.05Å; D607-T610 PolarHBondContact O-N 3.19Å; D607-T610 PolarHBondContact O-OG1 2.85Å; T610-V612 PolarHBondContact O-N 3.24Å
611	R	98.8	Very high	98.4	Very high	7 Å²	7	56.3 Å²	56.3	3%	0.026	27%	0.268	C	S	.	.	S	Bend	trans	-50.3	135.7	168	-164.5	179	-62.5	149.4	7.4	111	E475 A485 M603 D605 D607 T613	E475-R611 IonicContact OE1-CZ 2.78Å; E475-R611 IonicContact OE1-NH1 2.73Å; E475-R611 PolarHBondContact OE1-NH1 2.7Å; E475-R611 IonicContact OE1-NH2 3.79Å; E475-R611 PolarHBondContact OE1-NH2 3.45Å; E475-R611 IonicContact OE2-CZ 3.01Å; E475-R611 IonicContact OE2-NH1 3.74Å; E475-R611 IonicContact OE2-NH2 3.96Å; E475-R611 PolarHBondContact OE2-NH2 3.28Å; A485-R611 WeakPolarHBondContact O-CD 3.5Å; A485-R611 PolarHBondContact O-NH1 2.89Å; M603-R611 VanDerWaalsContact O-CD 3.24Å; M603-R611 WeakPolarHBondContact O-CD 3.43Å; M603-R611 WeakPolarHBondContact O-CG 3.4Å; D605-R611 HydrophobicContact CB-CB 3.98Å; D605-R611 HydrophobicContact CB-CG 4.28Å; D605-R611 VanDerWaalsContact O-CZ 3.3Å; D605-R611 PolarHBondContact O-NE 3.22Å; D605-R611 PolarHBondContact O-NH2 3.39Å; D607-R611 PolarHBondContact O-N 3.19Å; R611-T613 PolarHBondContact O-N 3.5Å
612	V	98.8	Very high	98.3	Very high	18 Å²	18	52.9 Å²	52.9	11%	0.109	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-63.6	130	-172.9	68.3	0	0	0	0	112	M488 R602 M603 T610 A617	M488-V612 HydrophobicContact CE-CG1 4.13Å; M488-V612 WeakPolarHBondContact CE-O 3.44Å; R602-V612 HydrophobicContact CB-CB 3.9Å; R602-V612 HydrophobicContact CB-CG1 3.8Å; R602-V612 PolarHBondContact O-N 3.02Å; M603-V612 HydrophobicContact CG-CG1 3.87Å; T610-V612 PolarHBondContact O-N 3.24Å; V612-A617 HydrophobicContact CG1-CB 4.34Å; V612-A617 HydrophobicContact CG2-CB 4.21Å
613	T	98.7	Very high	98.2	Very high	63 Å²	63	48.4 Å²	48.4	39%	0.387	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-75	159.1	174.9	69.5	0	0	0	0	111	R611 Y615 Y616 A617	R611-T613 PolarHBondContact O-N 3.5Å; T613-Y615 PolarHBondContact O-N 3.38Å; T613-Y616 PolarHBondContact O-N 2.94Å; T613-Y616 VanDerWaalsContact OG1-CD2 3.27Å; T613-Y616 WeakPolarHBondContact OG1-CD2 3.41Å; T613-A617 WeakPolarHBondContact O-CB 3.45Å; T613-A617 PolarHBondContact O-N 3.48Å
614	P	98.6	Very high	97.6	Very high	15 Å²	15	54.6 Å²	54.6	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-54.4	-36.8	178.1	-25.5	33.1	0	0	0	113.7	C414 L417 L418 M488 A617 L618	C414-P614 WeakPolarHBondContact O-CB 3.21Å; L417-P614 HydrophobicContact CB-CB 4.08Å; L417-P614 HydrophobicContact CB-CG 3.68Å; L418-P614 HydrophobicContact CB-CB 3.81Å; L418-P614 HydrophobicContact CD1-CB 4.42Å; M488-P614 HydrophobicContact CG-CG 4.33Å; M488-P614 HydrophobicContact SD-CB 4.33Å; M488-P614 HydrophobicContact SD-CG 3.75Å; P614-A617 PolarHBondContact O-N 2.9Å; P614-L618 WeakPolarHBondContact O-CG 3.3Å; P614-L618 PolarHBondContact O-N 2.94Å; P614-L618 VanDerWaalsContact O-N 3.09Å
615	Y	98.2	Very high	95.9	Very high	123 Å²	123	64.6 Å²	64.6	48%	0.482	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-53.6	176.6	177.4	-94.6	0	0	0	112.4	T613 A617 L618 Q619	T613-Y615 PolarHBondContact O-N 3.38Å; Y615-A617 VanDerWaalsContact C-N 3.32Å; Y615-A617 PolarHBondContact O-N 2.76Å; Y615-L618 PolarHBondContact O-N 3.23Å; Y615-Q619 VanDerWaalsContact CE1-NE2 3.27Å; Y615-Q619 PolarHBondContact O-N 2.87Å; Y615-Q619 PolarHBondContact OH-NE2 3.35Å; Y615-Q619 VanDerWaalsContact OH-NE2 3.13Å
616	Y	98.4	Very high	93.9	Very high	146 Å²	146	63.6 Å²	63.6	57%	0.573	29%	0.294	S	S	*	.	H	α-helix	trans	-72.1	-27	179.2	-68.1	-56.9	0	0	0	112.6	T613 Q619 H620	T613-Y616 PolarHBondContact O-N 2.94Å; T613-Y616 VanDerWaalsContact OG1-CD2 3.27Å; T613-Y616 WeakPolarHBondContact OG1-CD2 3.41Å; Y616-Q619 PolarHBondContact O-N 2.96Å; Y616-H620 PolarHBondContact O-N 3.43Å
617	A	98.6	Very high	91.5	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.7	-46.8	172.9	0	0	0	0	0	111.1	M488 L599 M603 V612 T613 P614 Y615 Q619 H620 F623	M488-A617 HydrophobicContact CE-CB 3.97Å; L599-A617 HydrophobicContact CD1-CB 4.25Å; M603-A617 HydrophobicContact CE-CB 4.46Å; V612-A617 HydrophobicContact CG1-CB 4.34Å; V612-A617 HydrophobicContact CG2-CB 4.21Å; T613-A617 WeakPolarHBondContact O-CB 3.45Å; T613-A617 PolarHBondContact O-N 3.48Å; P614-A617 PolarHBondContact O-N 2.9Å; Y615-A617 VanDerWaalsContact C-N 3.32Å; Y615-A617 PolarHBondContact O-N 2.76Å; A617-Q619 PolarHBondContact O-N 3.21Å; A617-H620 WeakPolarHBondContact O-CB 3.24Å; A617-H620 PolarHBondContact O-N 3.46Å; A617-F623 WeakPolarHBondContact O-CD2 3.27Å; A617-F623 WeakPolarHBondContact O-CE2 3.41Å
618	L	98.2	Very high	89.1	Confident	46 Å²	46	73 Å²	73	24%	0.241	36%	0.359	C	S	.	.	H	α-helix	trans	-61.5	-27.2	177.9	-74.2	167.7	0	0	0	113.8	Q411 C414 L418 P614 Y615 H620	Q411-L618 HydrophobicContact CG-CD2 4.06Å; C414-L618 HydrophobicContact CB-CD1 4.45Å; C414-L618 HydrophobicContact CB-CD2 3.68Å; C414-L618 HydrophobicContact CB-CG 3.72Å; L418-L618 HydrophobicContact CD2-CD1 3.87Å; P614-L618 WeakPolarHBondContact O-CG 3.3Å; P614-L618 PolarHBondContact O-N 2.94Å; P614-L618 VanDerWaalsContact O-N 3.09Å; Y615-L618 PolarHBondContact O-N 3.23Å; L618-H620 VanDerWaalsContact C-N 3.3Å
619	Q	97.7	Very high	86.8	Confident	102 Å²	102	76.6 Å²	76.6	48%	0.477	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-6.3	176.6	-64.6	-179.3	-2.4	0	0	113.7	Y615 Y616 A617	Y615-Q619 VanDerWaalsContact CE1-NE2 3.27Å; Y615-Q619 PolarHBondContact O-N 2.87Å; Y615-Q619 PolarHBondContact OH-NE2 3.35Å; Y615-Q619 VanDerWaalsContact OH-NE2 3.13Å; Y616-Q619 PolarHBondContact O-N 2.96Å; A617-Q619 PolarHBondContact O-N 3.21Å
620	H	98.3	Very high	84.1	Confident	19 Å²	19	73 Å²	73	9%	0.088	38%	0.376	C	S	.	.	S	Bend	trans	-65.1	147.4	-173.2	-165.9	-98.7	0	0	0	113.1	K595 D598 L599 Y616 A617 L618 F622 F623	K595-H620 PolarHBondContact O-CE1 3.13Å; K595-H620 VanDerWaalsContact O-CE1 3.23Å; D598-H620 IonicContact OD2-CE1 3.53Å; D598-H620 IonicContact OD2-NE2 3.59Å; D598-H620 PolarHBondContact OD2-NE2 2.78Å; L599-H620 HydrophobicContact CD1-CB 3.95Å; Y616-H620 PolarHBondContact O-N 3.43Å; A617-H620 WeakPolarHBondContact O-CB 3.24Å; A617-H620 PolarHBondContact O-N 3.46Å; L618-H620 VanDerWaalsContact C-N 3.3Å; H620-F622 WeakPolarHBondContact ND1-CB 3.43Å; H620-F622 PolarHBondContact ND1-N 3.29Å; H620-F622 PolarHBondContact O-N 3.18Å; H620-F623 HydrophobicContact CB-CD2 4.35Å; H620-F623 PolarHBondContact O-N 3.08Å
621	N	96.8	Very high	81.5	Confident	88 Å²	88	73.5 Å²	73.5	47%	0.471	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.9	-179.8	-70.9	-23.7	0	0	0	114.3	F623 K624	N621-F623 VanDerWaalsContact C-N 3.28Å; N621-F623 PolarHBondContact O-N 2.98Å; N621-K624 WeakPolarHBondContact OD1-CD 3.24Å; N621-K624 VanDerWaalsContact OD1-CE 3.3Å; N621-K624 WeakPolarHBondContact OD1-CE 3.4Å; N621-K624 PolarHBondContact OD1-NZ 3.36Å
622	F	97.6	Very high	78.7	Confident	2 Å²	2	80.5 Å²	80.5	1%	0.009	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-23.1	173.2	-179.1	-115.3	0	0	0	113.7	L403 R407 A410 K595 F596 L599 H620	L403-F622 HydrophobicContact CD1-CE2 3.86Å; L403-F622 HydrophobicContact CD1-CZ 3.91Å; L403-F622 HydrophobicContact CD2-CE2 4.48Å; L403-F622 HydrophobicContact CG-CE2 4.08Å; L403-F622 HydrophobicContact CG-CZ 4.38Å; R407-F622 HydrophobicContact CB-CE1 3.83Å; R407-F622 HydrophobicContact CB-CZ 3.72Å; R407-F622 WeakPolarHBondContact CD-O 3.48Å; R407-F622 HydrophobicContact CG-CD1 4.24Å; R407-F622 HydrophobicContact CG-CE1 3.84Å; R407-F622 HydrophobicContact CG-CZ 4.05Å; R407-F622 PolarHBondContact NE-O 2.69Å; A410-F622 HydrophobicContact CB-CE1 4.38Å; K595-F622 HydrophobicContact CB-CB 4.12Å; K595-F622 HydrophobicContact CB-CD2 4.19Å; F596-F622 HydrophobicContact CB-CD2 3.87Å; F596-F622 HydrophobicContact CB-CE2 3.66Å; F596-F622 HydrophobicContact CB-CZ 4.28Å; F596-F622 HydrophobicContact CD2-CD1 4.32Å; F596-F622 HydrophobicContact CD2-CD2 4.28Å; F596-F622 AromaticContact CD2-CE1 3.76Å; F596-F622 HydrophobicContact CD2-CE1 3.76Å; F596-F622 AromaticContact CD2-CE2 3.75Å; F596-F622 HydrophobicContact CD2-CE2 3.75Å; F596-F622 AromaticContact CD2-CZ 3.45Å; F596-F622 HydrophobicContact CD2-CZ 3.45Å; F596-F622 VanDerWaalsContact CD2-CZ 3.45Å; F596-F622 HydrophobicContact CE2-CE1 4.25Å; F596-F622 HydrophobicContact CE2-CZ 4.1Å; F596-F622 HydrophobicContact CG-CE2 4.02Å; F596-F622 HydrophobicContact CG-CZ 4.13Å; L599-F622 HydrophobicContact CD2-CB 4.16Å; L599-F622 HydrophobicContact CD2-CD1 3.6Å; L599-F622 HydrophobicContact CD2-CE1 4.41Å; L599-F622 HydrophobicContact CD2-CG 4.22Å; H620-F622 WeakPolarHBondContact ND1-CB 3.43Å; H620-F622 PolarHBondContact ND1-N 3.29Å; H620-F622 PolarHBondContact O-N 3.18Å
623	F	95.9	Very high	76	Confident	28 Å²	28	86.5 Å²	86.5	12%	0.123	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-8	177.7	-61.7	-63.2	0	0	0	113.9	R407 A410 Q411 L599 A617 H620 N621	R407-F623 HydrophobicContact CG-CD1 3.87Å; R407-F623 HydrophobicContact CG-CE1 4.15Å; A410-F623 HydrophobicContact CB-CE1 3.79Å; A410-F623 HydrophobicContact CB-CZ 3.72Å; Q411-F623 HydrophobicContact CB-CD1 3.91Å; Q411-F623 HydrophobicContact CB-CE1 3.66Å; Q411-F623 HydrophobicContact CB-CZ 4.46Å; Q411-F623 HydrophobicContact CG-CD1 4.24Å; Q411-F623 HydrophobicContact CG-CE1 4.38Å; L599-F623 HydrophobicContact CD2-CE2 3.81Å; L599-F623 HydrophobicContact CD2-CZ 3.97Å; A617-F623 WeakPolarHBondContact O-CD2 3.27Å; A617-F623 WeakPolarHBondContact O-CE2 3.41Å; H620-F623 HydrophobicContact CB-CD2 4.35Å; H620-F623 PolarHBondContact O-N 3.08Å; N621-F623 VanDerWaalsContact C-N 3.28Å; N621-F623 PolarHBondContact O-N 2.98Å
624	K	86.4	Confident	72.9	Confident	130 Å²	130	89 Å²	89	57%	0.565	47%	0.474	S	S	*	.	S	Bend	trans	-71.7	135.4	173.1	-67.7	-178.6	-176.5	167.6	0	109.2	N621 T626	N621-K624 WeakPolarHBondContact OD1-CD 3.24Å; N621-K624 VanDerWaalsContact OD1-CE 3.3Å; N621-K624 WeakPolarHBondContact OD1-CE 3.4Å; N621-K624 PolarHBondContact OD1-NZ 3.36Å; K624-T626 PolarHBondContact O-N 3.42Å
625	R	63.5	Low	69.7	Low	214 Å²	214	92.2 Å²	92.2	81%	0.808	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-55	128	174.1	-65.9	-165.5	160.8	144.6	-1.9	110.1	E629	R625-E629 WeakPolarHBondContact CD-OE2 3.5Å; R625-E629 VanDerWaalsContact CG-OE2 3.24Å; R625-E629 WeakPolarHBondContact CG-OE2 3.45Å; R625-E629 IonicContact NE-OE2 3.42Å; R625-E629 PolarHBondContact NE-OE2 3.3Å
626	T	55.8	Low	66.5	Low	31 Å²	31	91.4 Å²	91.4	19%	0.19	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-74	151.9	158.8	42.1	0	0	0	0	109	K595 K624 D628 E629	K595-T626 VanDerWaalsContact NZ-CG2 3.32Å; K624-T626 PolarHBondContact O-N 3.42Å; T626-D628 WeakPolarHBondContact CB-OD2 3.24Å; T626-D628 PolarHBondContact O-N 3.31Å; T626-D628 VanDerWaalsContact O-N 3.16Å; T626-E629 PolarHBondContact O-N 2.59Å
627	A	48.9	Very low	63.4	Low	102 Å²	102	88.5 Å²	88.5	84%	0.843	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.6	177.7	0	0	0	0	0	112	E629	A627-E629 VanDerWaalsContact C-N 3.27Å; A627-E629 PolarHBondContact O-N 3.39Å
628	D	49.1	Very low	60.1	Low	125 Å²	125	93.1 Å²	93.1	67%	0.668	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	6.4	-175	-33.5	-78.1	0	0	0	114	T626 A630	T626-D628 WeakPolarHBondContact CB-OD2 3.24Å; T626-D628 PolarHBondContact O-N 3.31Å; T626-D628 VanDerWaalsContact O-N 3.16Å; D628-A630 PolarHBondContact O-N 3.16Å
629	E	49.9	Very low	56.9	Low	94 Å²	94	98 Å²	98	44%	0.439	61%	0.613	S	S	.	*			trans	-69.8	19.6	175	-70.9	-160.7	148.4	0	0	114.1	R625 T626 A627 T631	R625-E629 WeakPolarHBondContact CD-OE2 3.5Å; R625-E629 VanDerWaalsContact CG-OE2 3.24Å; R625-E629 WeakPolarHBondContact CG-OE2 3.45Å; R625-E629 IonicContact NE-OE2 3.42Å; R625-E629 PolarHBondContact NE-OE2 3.3Å; T626-E629 PolarHBondContact O-N 2.59Å; A627-E629 VanDerWaalsContact C-N 3.27Å; A627-E629 PolarHBondContact O-N 3.39Å; E629-T631 PolarHBondContact O-N 2.94Å
630	A	40.1	Very low	53.8	Low	91 Å²	91	97.6 Å²	97.6	75%	0.752	63%	0.628	S	S	*	*			trans	-74.1	48.4	172.6	0	0	0	0	0	112.9	D628	D628-A630 PolarHBondContact O-N 3.16Å
631	T	42.6	Very low	50.7	Low	100 Å²	100	104.7 Å²	104.7	61%	0.613	67%	0.666	S	S	*	*	S	Bend	trans	-119.2	80.2	178.6	58.2	0	0	0	0	112.2	E629 T633	E629-T631 PolarHBondContact O-N 2.94Å; T631-T633 PolarHBondContact O-N 3.49Å
632	N	41.7	Very low	47.6	Very low	154 Å²	154	105.1 Å²	105.1	82%	0.824	68%	0.682	S	S	*	*	S	Bend	trans	47	55	149.4	-63.6	-8.5	0	0	0	118.9
633	T	40.3	Very low	44.4	Very low	143 Å²	143	108.6 Å²	108.6	88%	0.877	72%	0.718	S	S	*	*			trans	-136.3	51.7	153.8	64.9	0	0	0	0	112.6	T631	T631-T633 PolarHBondContact O-N 3.49Å
634	S	35	Very low	41.3	Very low	115 Å²	115	112.4 Å²	112.4	80%	0.804	76%	0.755	S	S	*	*			trans	-138.6	103.4	177.3	53.2	0	0	0	0	110.2
635	G	29.9	Very low	38.6	Very low	84 Å²	84	110.1 Å²	110.1	87%	0.866	77%	0.768	S	S	*	*			trans	174.9	21.2	-174.4	0	0	0	0	0	118.3
636	A	32.5	Very low	37.1	Very low	106 Å²	106	103.8 Å²	103.8	88%	0.876	77%	0.769	S	S	*	*	S	Bend	trans	-154.7	122.5	171.7	0	0	0	0	0	112.4
637	G	31.7	Very low	36	Very low	84 Å²	84	108.5 Å²	108.5	87%	0.866	80%	0.804	S	S	*	*	S	Bend	trans	74.9	70.4	158	0	0	0	0	0	118.4
638	A	31.1	Very low	35.1	Very low	98 Å²	98	107.5 Å²	107.5	81%	0.81	80%	0.803	S	S	*	*			trans	-153.6	33.4	165.1	0	0	0	0	0	114.8	A640	A638-A640 PolarHBondContact O-N 2.91Å
639	T	29.2	Very low	34.2	Very low	147 Å²	147	107.5 Å²	107.5	90%	0.902	81%	0.813	S	S	*	*			trans	-77.7	71.2	172.1	47.6	0	0	0	0	111.1	N641	T639-N641 PolarHBondContact O-N 2.88Å
640	A	34.4	Very low	33.4	Very low	95 Å²	95	108.7 Å²	108.7	79%	0.785	83%	0.832	S	S	*	*			trans	-80.9	111.3	170.8	0	0	0	0	0	109.6	A638 A642	A638-A640 PolarHBondContact O-N 2.91Å; A640-A642 PolarHBondContact O-N 3.43Å
641	N	32.3	Very low	33	Very low	168 Å²	168	108 Å²	108	90%	0.898	83%	0.834	S	S	*	*			trans	-80.8	114.3	-178	-167.4	29.1	0	0	0	110.7	T639	T639-N641 PolarHBondContact O-N 2.88Å
642	A	31	Very low	32.5	Very low	96 Å²	96	108.7 Å²	108.7	79%	0.793	85%	0.849	S	S	*	*			trans	-123.4	81.1	-179	0	0	0	0	0	110.6	A640 A644	A640-A642 PolarHBondContact O-N 3.43Å; A642-A644 PolarHBondContact O-N 3.49Å
643	G	30.1	Very low	31.9	Very low	75 Å²	75	105.1 Å²	105.1	77%	0.773	85%	0.849	S	S	*	*			trans	-72.7	122.7	172.2	0	0	0	0	0	111
644	A	32	Very low	31.5	Very low	109 Å²	109	102 Å²	102	90%	0.901	85%	0.845	S	S	*	*			trans	-92	139.7	172.2	0	0	0	0	0	110.6	A642	A642-A644 PolarHBondContact O-N 3.49Å
645	G	29.7	Very low	31.3	Very low	82 Å²	82	102.1 Å²	102.1	85%	0.845	85%	0.846	S	S	*	*			trans	175	116	172.8	0	0	0	0	0	116.4
646	G	30.9	Very low	31.4	Very low	80 Å²	80	103.5 Å²	103.5	83%	0.825	84%	0.842	S	S	*	*			trans	87.9	112.9	142.7	0	0	0	0	0	118.5
647	S	33.1	Very low	31.3	Very low	131 Å²	131	102.1 Å²	102.1	92%	0.916	84%	0.839	S	S	*	*			trans	-62.8	144.9	158.1	-51.7	0	0	0	0	110.9
648	G	30.4	Very low	31.3	Very low	81 Å²	81	102.2 Å²	102.2	84%	0.835	84%	0.839	S	S	*	*			trans	-86.7	166.4	-178.6	0	0	0	0	0	115.2
649	S	30.7	Very low	31.2	Very low	124 Å²	124	100.7 Å²	100.7	87%	0.867	83%	0.833	S	S	*	*			trans	-149.1	153.3	157.5	-171.5	0	0	0	0	109.6
650	S	33.4	Very low	31.4	Very low	119 Å²	119	101.2 Å²	101.2	83%	0.832	84%	0.836	S	S	*	*			trans	-83.8	141.2	-178.6	54.5	0	0	0	0	112.8
651	G	29.7	Very low	31.1	Very low	77 Å²	77	100 Å²	100	79%	0.794	83%	0.832	S	S	*	*			trans	-172.7	121.2	171.3	0	0	0	0	0	113.4
652	A	32.3	Very low	31	Very low	114 Å²	114	96.1 Å²	96.1	94%	0.942	83%	0.832	S	S	*	*			trans	-59.1	164.8	-173.5	0	0	0	0	0	117
653	G	30.5	Very low	30.8	Very low	79 Å²	79	94.8 Å²	94.8	81%	0.814	83%	0.828	S	S	*	*			trans	135.7	103	136.5	0	0	0	0	0	118.9
654	G	30.4	Very low	30.8	Very low	77 Å²	77	100.3 Å²	100.3	79%	0.794	84%	0.839	S	S	*	*			trans	92.5	131.5	137.5	0	0	0	0	0	119.9
655	S	31.3	Very low	30.7	Very low	119 Å²	119	99.1 Å²	99.1	83%	0.832	84%	0.837	S	S	*	*				19.2	144.5	124.9	-58.5	0	0	0	0	121
656	S	32.7	Very low	30.7	Very low	112 Å²	112	100.1 Å²	100.1	78%	0.783	84%	0.837	S	S	*	*			cis	179.5	147.9	-3.5	46.8	0	0	0	0	112.4
657	G	30.6	Very low	30.8	Very low	78 Å²	78	101.4 Å²	101.4	80%	0.804	83%	0.834	S	S	*	*			trans	80.7	143.9	141.7	0	0	0	0	0	119.5
658	G	30.5	Very low	30.7	Very low	85 Å²	85	102.3 Å²	102.3	88%	0.876	83%	0.828	S	S	*	*			trans	76.6	126.6	166.8	0	0	0	0	0	115.8
659	G	29.9	Very low	30.7	Very low	66 Å²	66	102.3 Å²	102.3	68%	0.68	82%	0.815	S	S	*	*			cis	116.8	123.5	-6	0	0	0	0	0	113.5
660	V	32.8	Very low	30.8	Very low	158 Å²	158	101.4 Å²	101.4	96%	0.958	81%	0.809	S	S	*	*			trans	66.2	142.5	176.5	-152.8	0	0	0	0	113.9
661	G	28.6	Very low	30.7	Very low	69 Å²	69	101.8 Å²	101.8	71%	0.711	81%	0.812	S	S	*	*			cis	139.3	130.2	-6.1	0	0	0	0	0	111.8
662	G	30.1	Very low	30.7	Very low	87 Å²	87	101.3 Å²	101.3	90%	0.897	81%	0.807	S	S	*	*			trans	84	153.5	-174.3	0	0	0	0	0	113.5
663	G	27.7	Very low	30.7	Very low	69 Å²	69	100.6 Å²	100.6	71%	0.711	80%	0.801	S	S	*	*			cis	152.7	137.6	-3.2	0	0	0	0	0	111.4
664	L	28.9	Very low	30.8	Very low	191 Å²	191	103.1 Å²	103.1	100%	1	80%	0.8	S	S	*	*			trans	69	144.8	171	-51.5	173.4	0	0	0	117.5
665	G	29.5	Very low	30.9	Very low	83 Å²	83	104.2 Å²	104.2	86%	0.856	80%	0.796	S	S	*	*			trans	164.2	119.8	176.1	0	0	0	0	0	110.7
666	A	31.1	Very low	30.9	Very low	103 Å²	103	103.2 Å²	103.2	85%	0.851	79%	0.789	S	S	*	*			trans	-101.8	166.7	-171.5	0	0	0	0	0	113.6
667	S	31.8	Very low	30.9	Very low	108 Å²	108	103.3 Å²	103.3	76%	0.755	79%	0.79	S	S	*	*			trans	-60.6	146.5	172.4	52.8	0	0	0	0	114
668	N	31.1	Very low	30.9	Very low	150 Å²	150	105.4 Å²	105.4	80%	0.802	79%	0.792	S	S	*	*				-164	147.1	115.8	-135.6	-3.7	0	0	0	117.9
669	S	31.3	Very low	30.9	Very low	80 Å²	80	105.9 Å²	105.9	56%	0.559	79%	0.788	S	S	*	*			trans	38.1	117.5	138.6	67.1	0	0	0	0	125.3
670	S	31.9	Very low	31	Very low	106 Å²	106	107.3 Å²	107.3	74%	0.741	79%	0.793	S	S	*	*				91.7	160.5	110.6	77.9	0	0	0	0	124.3
671	S	32.8	Very low	30.8	Very low	126 Å²	126	104.2 Å²	104.2	88%	0.881	78%	0.784	S	S	*	*			trans	79.3	135	177.8	74.9	0	0	0	0	117.1
672	G	28.6	Very low	32	Very low	67 Å²	67	106.2 Å²	106.2	69%	0.691	78%	0.784	S	S	*	*			cis	-148.5	153.2	-10.4	0	0	0	0	0	110.2
673	A	32.5	Very low	32.1	Very low	100 Å²	100	108.1 Å²	108.1	83%	0.826	78%	0.779	S	S	*	*				68	130.7	88.9	0	0	0	0	0	113.1
674	V	32.3	Very low	32.3	Very low	131 Å²	131	109.3 Å²	109.3	79%	0.794	78%	0.782	S	S	*	*			cis	-155.5	178	25.2	-73.3	0	0	0	0	113.7
675	S	33	Very low	32.5	Very low	100 Å²	100	104.4 Å²	104.4	70%	0.699	77%	0.769	S	S	*	*			trans	85.5	82.7	148.3	-58.1	0	0	0	0	122.8
676	S	31	Very low	32.5	Very low	98 Å²	98	106.9 Å²	106.9	69%	0.685	77%	0.768	S	S	*	*				47.8	115.9	113.8	66.3	0	0	0	0	123.1
677	S	32.4	Very low	32.5	Very low	115 Å²	115	106.4 Å²	106.4	80%	0.804	76%	0.764	S	S	*	*				53.8	152.2	123.9	72.5	0	0	0	0	121.8
678	S	31.4	Very low	32.4	Very low	121 Å²	121	106.1 Å²	106.1	85%	0.846	77%	0.768	S	S	*	*			cis	-146.8	-163.1	15	59.3	0	0	0	0	112
679	A	31.1	Very low	32.4	Very low	96 Å²	96	103.1 Å²	103.1	79%	0.793	76%	0.764	S	S	*	*			trans	-134.2	-179.1	-168.7	0	0	0	0	0	114.5
680	A	31.6	Very low	32.3	Very low	95 Å²	95	106.6 Å²	106.6	79%	0.785	78%	0.782	S	S	*	*			trans	78.2	123.3	178.7	0	0	0	0	0	115.6
681	A	28.8	Very low	32.5	Very low	94 Å²	94	106.1 Å²	106.1	78%	0.777	79%	0.785	S	S	*	*				67.5	159.6	64.3	0	0	0	0	0	113.3
682	P	53.8	Low	32.5	Very low	110 Å²	110	105.1 Å²	105.1	71%	0.714	78%	0.784	S	S	*	*			cis	-141.9	-170.5	6.8	37.5	-14.2	0	0	0	116.7
683	T	32	Very low	32.6	Very low	127 Å²	127	104.9 Å²	104.9	78%	0.779	78%	0.782	S	S	*	*			trans	63.2	117.3	147.2	43.3	0	0	0	0	124.7
684	A	32	Very low	32.7	Very low	95 Å²	95	105.4 Å²	105.4	79%	0.785	78%	0.779	S	S	*	*				96.5	143.1	112.3	0	0	0	0	0	124.3
685	A	31.4	Very low	32.9	Very low	88 Å²	88	105 Å²	105	73%	0.727	78%	0.782	S	S	*	*			trans	90.3	106.3	141.5	0	0	0	0	0	122.8
686	T	30.1	Very low	32.8	Very low	134 Å²	134	104.2 Å²	104.2	82%	0.822	79%	0.79	S	S	*	*			trans	56.6	107.4	133.5	51.3	0	0	0	0	123.8
687	A	31	Very low	33.1	Very low	94 Å²	94	105.7 Å²	105.7	78%	0.777	80%	0.8	S	S	*	*				87.3	147.6	108.3	0	0	0	0	0	122.7
688	A	30.8	Very low	33	Very low	102 Å²	102	103.8 Å²	103.8	84%	0.843	80%	0.799	S	S	*	*			trans	66.9	158.4	167.6	0	0	0	0	0	117.9
689	A	30.6	Very low	33.2	Very low	87 Å²	87	103.7 Å²	103.7	72%	0.719	80%	0.798	S	S	*	*			cis	-174.5	143.8	-36.2	0	0	0	0	0	108.9
690	T	30.1	Very low	33.3	Very low	153 Å²	153	104.5 Å²	104.5	94%	0.939	80%	0.798	S	S	*	*			trans	-170	157	153	13.3	0	0	0	0	113.4
691	A	34.3	Very low	33.5	Very low	96 Å²	96	107.1 Å²	107.1	79%	0.793	80%	0.804	S	S	*	*			trans	-104.2	-172.2	162.1	0	0	0	0	0	108.6
692	A	34.6	Very low	33.5	Very low	104 Å²	104	106.1 Å²	106.1	86%	0.86	80%	0.803	S	S	*	*			cis	-160.3	179.1	12.8	0	0	0	0	0	111.1
693	G	30.1	Very low	32.3	Very low	63 Å²	63	105.1 Å²	105.1	65%	0.649	81%	0.813	S	S	*	*			trans	175.2	97.5	164.7	0	0	0	0	0	111.1
694	S	35.2	Very low	32.2	Very low	110 Å²	110	102.5 Å²	102.5	77%	0.769	81%	0.811	S	S	*	*				64.4	91.2	90.1	69.4	0	0	0	0	112.7
695	S	35.7	Very low	32.1	Very low	122 Å²	122	103.5 Å²	103.5	85%	0.853	81%	0.812	S	S	*	*				99.4	125.5	65.9	60.6	0	0	0	0	112.4
696	G	31.7	Very low	32.1	Very low	84 Å²	84	105 Å²	105	87%	0.866	82%	0.817	S	S	*	*			trans	-179.3	121.5	172.5	0	0	0	0	0	111.9
697	S	35.6	Very low	32.2	Very low	129 Å²	129	103.9 Å²	103.9	90%	0.902	82%	0.821	S	S	*	*			trans	-129.5	150.4	-173.3	51.7	0	0	0	0	112.1
698	G	31.1	Very low	32.2	Very low	75 Å²	75	103.8 Å²	103.8	77%	0.773	82%	0.82	S	S	*	*			trans	-176.8	133.8	174	0	0	0	0	0	112.5
699	S	35	Very low	32.2	Very low	120 Å²	120	108.1 Å²	108.1	84%	0.839	82%	0.823	S	S	*	*			trans	-148.3	133.8	-167.4	-52	0	0	0	0	113.9
700	S	33.3	Very low	32.3	Very low	112 Å²	112	111.9 Å²	111.9	78%	0.783	83%	0.826	S	S	*	*			trans	179.7	134.1	151.7	38.3	0	0	0	0	109.1
701	V	35.6	Very low	32.5	Very low	150 Å²	150	114.1 Å²	114.1	91%	0.909	83%	0.826	S	S	*	*				63.1	126	71	-177.3	0	0	0	0	112.9
702	G	30.5	Very low	32.5	Very low	73 Å²	73	117.9 Å²	117.9	75%	0.753	83%	0.827	S	S	*	*			cis	168.7	167	-5	0	0	0	0	0	113.6
703	G	28.4	Very low	32.6	Very low	90 Å²	90	117.8 Å²	117.8	93%	0.928	83%	0.826	S	S	*	*			trans	84	159.8	179.2	0	0	0	0	0	115.2
704	G	29.4	Very low	32.9	Very low	71 Å²	71	123.1 Å²	123.1	73%	0.732	84%	0.836	S	S	*	*			cis	175.6	156.7	-8.4	0	0	0	0	0	113.2
705	S	30.3	Very low	33.3	Very low	117 Å²	117	123.5 Å²	123.5	82%	0.818	84%	0.836	S	S	*	*			trans	69.9	98.6	162.4	-56	0	0	0	0	122.2
706	S	30.9	Very low	33.6	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	84%	0.836	S	S	*	*				39.6	118.9	128.2	62.9	0	0	0	0	123.3
707	A	31.3	Very low	34.4	Very low	110 Å²	110	127.3 Å²	127.3	91%	0.909	83%	0.833	S	S	*	*			trans	-150.6	166.9	142.3	0	0	0	0	0	109.7
708	A	31.5	Very low	35	Very low	92 Å²	92	128.9 Å²	128.9	76%	0.76	83%	0.83	S	S	*	*			trans	-127.9	171.8	-173.1	0	0	0	0	0	113.5
709	Q	31.1	Very low	35.8	Very low	193 Å²	193	131 Å²	131	90%	0.902	83%	0.831	S	S	*	*			trans	70.9	138.8	-172.8	-51.7	177.8	-15.8	0	0	113
710	Q	32.9	Very low	36.6	Very low	167 Å²	167	133.1 Å²	133.1	78%	0.78	83%	0.831	S	S	*	*			cis	-127.3	158.1	19.2	-76.2	175.8	-24.5	0	0	113.7
711	Q	34	Very low	37.3	Very low	199 Å²	199	133.6 Å²	133.6	93%	0.93	83%	0.832	S	S	*	*			trans	-87.1	132.6	160.6	-69.5	170.4	-48	0	0	109.5
712	Q	35.2	Very low	38.1	Very low	176 Å²	176	134.1 Å²	134.1	82%	0.822	83%	0.829	S	S	*	*			trans	-115.2	117.5	159.5	-71.9	-170.2	-2.7	0	0	108.7
713	A	34.9	Very low	38.9	Very low	101 Å²	101	136.4 Å²	136.4	84%	0.835	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-84.2	131.3	174.1	0	0	0	0	0	109.7
714	M	37.5	Very low	39.8	Very low	176 Å²	176	140 Å²	140	87%	0.867	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-76.4	149.2	170.6	-69.9	-68.7	-98.2	0	0	110.1
715	P	44.3	Very low	40.9	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-73.9	148.1	-158.1	27	-35.7	0	0	0	114.9
716	L	40	Very low	41.6	Very low	163 Å²	163	142.3 Å²	142.3	85%	0.853	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-72.4	147.6	169.2	-69.4	167.6	0	0	0	111.2
717	P	49.1	Very low	42.1	Very low	122 Å²	122	145.2 Å²	145.2	79%	0.792	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-69.9	149.2	171.5	30.3	-34.6	0	0	0	111.8
718	L	48	Very low	42.3	Very low	163 Å²	163	144.5 Å²	144.5	85%	0.853	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-68.1	148.3	-178.5	-69.9	166	0	0	0	112.7
719	P	48.2	Very low	42.7	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72.7	147.8	176.4	30.8	-35.1	0	0	0	112.5
720	L	52.1	Low	43.5	Very low	163 Å²	163	140.9 Å²	140.9	85%	0.853	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-73.4	149	172.3	-71.4	166.4	0	0	0	111.4
721	P	47.5	Very low	43.5	Very low	123 Å²	123	137 Å²	137	80%	0.799	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-70.8	145.3	179.6	29.4	-35.1	0	0	0	112.6
722	L	52.1	Low	43.4	Very low	161 Å²	161	130.9 Å²	130.9	84%	0.843	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.8	154.1	174.3	-71.6	170.1	0	0	0	111.7
723	P	47.9	Very low	43.2	Very low	120 Å²	120	127.5 Å²	127.5	78%	0.779	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-71.2	144	-179.8	29.3	-35.1	0	0	0	112.8
724	L	47.7	Very low	43.1	Very low	166 Å²	166	127.4 Å²	127.4	87%	0.869	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.5	150.9	174.8	-74	165.6	0	0	0	112
725	P	51.7	Low	42.9	Very low	107 Å²	107	126.9 Å²	126.9	70%	0.695	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-72.2	159.4	175.8	31.6	-35.9	0	0	0	112.3
726	P	46.5	Very low	42.2	Very low	130 Å²	130	125 Å²	125	84%	0.844	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-68.7	134.6	-179.8	28.5	-35	0	0	0	112.2
727	L	39.8	Very low	41.8	Very low	179 Å²	179	126 Å²	126	94%	0.937	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.6	131.8	170	-89.8	162.8	0	0	0	110.6
728	A	35.9	Very low	40.9	Very low	96 Å²	96	125.2 Å²	125.2	79%	0.793	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-73.7	140	172.7	0	0	0	0	0	111.1
729	G	40.7	Very low	40.1	Very low	68 Å²	68	125 Å²	125	70%	0.701	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.6	150.1	167.5	0	0	0	0	0	111.6
730	P	47.3	Very low	39.5	Very low	141 Å²	141	126.1 Å²	126.1	92%	0.916	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-69.9	141.7	174.3	30.2	-34.3	0	0	0	111.1
731	G	33.9	Very low	38.7	Very low	84 Å²	84	123.6 Å²	123.6	87%	0.866	80%	0.795	S	S	*	*			trans	-119.7	155.5	176.9	0	0	0	0	0	113
732	G	30.8	Very low	38	Very low	71 Å²	71	127.9 Å²	127.9	73%	0.732	80%	0.795	S	S	*	*			trans	152.2	99.5	-178.7	0	0	0	0	0	108.1
733	A	32.2	Very low	37.4	Very low	105 Å²	105	135.1 Å²	135.1	87%	0.868	81%	0.811	S	S	*	*				77	135.5	90.6	0	0	0	0	0	111.8
734	S	32.1	Very low	36.8	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	81%	0.813	S	S	*	*			cis	-153.9	162.3	13.5	50.4	0	0	0	0	112.6
735	D	33.3	Very low	36.3	Very low	164 Å²	164	134.3 Å²	134.3	88%	0.877	81%	0.81	S	S	*	*			trans	36.4	127	148.5	-52	-29.1	0	0	0	122.1
736	G	29.7	Very low	35.4	Very low	80 Å²	80	135.8 Å²	135.8	83%	0.825	82%	0.816	S	S	*	*			trans	-172.4	124.1	165	0	0	0	0	0	111.5
737	Q	32.3	Very low	34.8	Very low	184 Å²	184	136.1 Å²	136.1	86%	0.86	82%	0.815	S	S	*	*			trans	-101.1	165.8	-175.6	-60.9	173.7	-78.3	0	0	112.9
738	C	28.8	Very low	34.4	Very low	104 Å²	104	133.4 Å²	133.4	70%	0.703	81%	0.807	S	S	*	*			trans	85.6	137.5	146.9	-75	0	0	0	0	122.4
739	H	31.3	Very low	34.3	Very low	159 Å²	159	135.9 Å²	135.9	74%	0.736	81%	0.808	S	S	*	*			trans	63.7	112.6	144.2	-73.9	-64.3	0	0	0	122.4
740	D	36.6	Very low	33.9	Very low	143 Å²	143	140.8 Å²	140.8	77%	0.765	82%	0.816	S	S	*	*				59.6	147	119.5	-73.6	-51.5	0	0	0	124.2
741	D	35.6	Very low	32.9	Very low	111 Å²	111	140.8 Å²	140.8	59%	0.594	81%	0.808	S	S	*	*			trans	80.6	123	146.6	-136.5	13.2	0	0	0	120.4
742	R	32.9	Very low	32.8	Very low	212 Å²	212	145.5 Å²	145.5	80%	0.8	80%	0.803	S	S	*	*			trans	73.1	143	165.1	-54.7	154.1	-153.2	-164.9	9.8	115.5
743	R	37.7	Very low	32.9	Very low	313 Å²	313	152.3 Å²	152.3	100%	1.181	81%	0.81	S	S	*	*			cis	-149.6	0	10.8	-148.5	-178.6	-162.7	-174	5.8	112.5

Retrieved 743 of 743 residues in 177 ms (Link to these results)

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