A0A087XTY8_POEFO Loading...

Wee1-like protein kinase

AlphaFold DB , UniProt , Accession A0A087XTY8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 620 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	37.4	Very low	34.4	Very low	246 Å²	246	154.5 Å²	154.5	100%	1.212	85%	0.849	S	S	*	*				0	152	0	-66.8	160.6	83	0	0	107.8
2	S	35.6	Very low	35.6	Very low	118 Å²	118	151.4 Å²	151.4	83%	0.825	84%	0.842	S	S	*	*			trans	-38.7	157.1	-172.5	-46.3	0	0	0	0	117.5
3	S	34.4	Very low	35.4	Very low	105 Å²	105	148.6 Å²	148.6	73%	0.734	84%	0.839	S	S	*	*			cis	-161.6	144	1.3	24	0	0	0	0	108.8
4	C	33	Very low	35.9	Very low	119 Å²	119	145 Å²	145	80%	0.804	82%	0.824	S	S	*	*				49.8	129.8	86.6	-78.1	0	0	0	0	114.7
5	S	33.7	Very low	35.7	Very low	117 Å²	117	147.9 Å²	147.9	82%	0.818	82%	0.824	S	S	*	*			cis	-151.2	168.8	14.4	-76.8	0	0	0	0	114.6
6	R	37.2	Very low	35.5	Very low	229 Å²	229	146.3 Å²	146.3	86%	0.864	83%	0.826	S	S	*	*			trans	-95.4	158.6	163.6	-72.7	174	165.2	172.1	-5.6	111
7	H	34.1	Very low	35.5	Very low	167 Å²	167	150.7 Å²	150.7	77%	0.773	83%	0.827	S	S	*	*			trans	164.6	118.8	134	-89.6	-65.1	0	0	0	109.1
8	R	34.6	Very low	35.5	Very low	217 Å²	217	149.4 Å²	149.4	82%	0.819	83%	0.827	S	S	*	*				87.1	111.6	77.3	-89.4	-157.9	-177.6	-164	0.2	115
9	L	34.8	Very low	35.4	Very low	173 Å²	173	149.5 Å²	149.5	91%	0.906	82%	0.824	S	S	*	*			trans	22.3	128	144	-69.6	165.3	0	0	0	120.6
10	G	28.1	Very low	35.2	Very low	73 Å²	73	154.2 Å²	154.2	75%	0.753	83%	0.829	S	S	*	*			trans	-157.2	145.5	156.9	0	0	0	0	0	111
11	T	35.1	Very low	35.1	Very low	136 Å²	136	155 Å²	155	83%	0.834	83%	0.827	S	S	*	*			trans	-133.8	-177.9	177.2	62.4	0	0	0	0	109.5
12	P	49.4	Very low	34.7	Very low	117 Å²	117	151.9 Å²	151.9	76%	0.76	81%	0.807	S	S	*	*				-123	161.3	-92.2	36.9	-21.2	0	0	0	114.3
13	S	32.4	Very low	34.4	Very low	115 Å²	115	153.1 Å²	153.1	80%	0.804	80%	0.803	S	S	*	*			trans	165.6	172.2	158.6	47.9	0	0	0	0	111
14	P	43.6	Very low	34.2	Very low	98 Å²	98	155.9 Å²	155.9	64%	0.636	81%	0.805	S	S	*	*			cis	-133.6	165.8	-33.1	28.5	-9.5	0	0	0	115
15	K	32.1	Very low	34.2	Very low	188 Å²	188	159 Å²	159	82%	0.817	81%	0.805	S	S	*	*			trans	56.8	107.5	149.1	-65	158.8	-173.6	172	0	119.3
16	S	33	Very low	34	Very low	122 Å²	122	159.5 Å²	159.5	85%	0.853	80%	0.803	S	S	*	*				-121	152.4	128.7	61	0	0	0	0	108.8
17	R	35.6	Very low	33.9	Very low	222 Å²	222	154.1 Å²	154.1	84%	0.838	80%	0.801	S	S	*	*			trans	-130.8	126.9	-179.2	-78.9	-179.3	169.9	178	-4.4	109.7
18	P	35.6	Very low	33.8	Very low	128 Å²	128	151.5 Å²	151.5	83%	0.831	80%	0.801	S	S	*	*			trans	-68.7	144.6	158.5	30.2	-32.3	0	0	0	109.7
19	I	33.5	Very low	33.9	Very low	150 Å²	150	149 Å²	149	77%	0.769	80%	0.804	S	S	*	*			trans	-88.7	118.6	-173.9	-64.7	172.1	0	0	0	109.8	Q21	I19-Q21 HydrophobicContact CG2-CG 4.36Å; I19-Q21 PolarHBondContact O-N 3.47Å
20	R	30.9	Very low	33.7	Very low	244 Å²	244	143.8 Å²	143.8	92%	0.921	79%	0.792	S	S	*	*			trans	-72.9	99.9	163.9	-87.5	-174.3	166.8	-173.9	-4.7	109.5	K22	R20-K22 PolarHBondContact O-N 3.17Å
21	Q	32.3	Very low	34.1	Very low	171 Å²	171	149.3 Å²	149.3	80%	0.799	80%	0.799	S	S	*	*			trans	-76.4	115.4	157.5	-75.4	-174.3	-22.7	0	0	108.8	I19	I19-Q21 HydrophobicContact CG2-CG 4.36Å; I19-Q21 PolarHBondContact O-N 3.47Å
22	K	30.1	Very low	34	Very low	181 Å²	181	151.3 Å²	151.3	79%	0.787	80%	0.804	S	S	*	*			trans	-79.1	118.9	159.6	-81.6	-174.4	171.6	-172.6	0	107.5	R20	R20-K22 PolarHBondContact O-N 3.17Å
23	L	30.1	Very low	33.4	Very low	143 Å²	143	153 Å²	153	75%	0.749	81%	0.807	S	S	*	*			trans	-101.7	111.7	152.9	-76.7	169.9	0	0	0	107.3	F25	L23-F25 HydrophobicContact CD2-CE2 4.43Å
24	Q	30	Very low	34	Very low	163 Å²	163	153 Å²	153	76%	0.762	80%	0.804	S	S	*	*			trans	-84.7	129.7	161.7	-69.6	171.9	-103.6	0	0	106.8
25	F	31.9	Very low	33.7	Very low	185 Å²	185	156.3 Å²	156.3	81%	0.811	82%	0.815	S	S	*	*			trans	-117.1	143.9	158.9	-88.8	-81.9	0	0	0	109.1	L23	L23-F25 HydrophobicContact CD2-CE2 4.43Å
26	T	30.6	Very low	34	Very low	127 Å²	127	155.4 Å²	155.4	78%	0.779	81%	0.813	S	S	*	*			trans	-90.8	150.2	-169.2	45.2	0	0	0	0	111.4
27	S	33.4	Very low	34.1	Very low	117 Å²	117	157.6 Å²	157.6	82%	0.818	82%	0.816	S	S	*	*			trans	-59.4	141.1	161.6	48.1	0	0	0	0	110.9
28	S	32.7	Very low	34.1	Very low	111 Å²	111	152 Å²	152	78%	0.776	81%	0.806	S	S	*	*			trans	-150.5	143.3	165.8	-173.5	0	0	0	0	107.7
29	D	35.8	Very low	34.1	Very low	164 Å²	164	152.7 Å²	152.7	88%	0.877	80%	0.802	S	S	*	*			trans	-91.1	176.3	-165.9	-47.7	-83.7	0	0	0	113.8
30	G	31.5	Very low	34.2	Very low	64 Å²	64	153.6 Å²	153.6	66%	0.66	81%	0.809	S	S	*	*			trans	136.6	83.7	-175.1	0	0	0	0	0	109.5
31	E	36.9	Very low	34.5	Very low	190 Å²	190	146.6 Å²	146.6	89%	0.888	80%	0.797	S	S	*	*				65	106.6	82.6	-66.6	-170.4	149.9	0	0	113.5
32	D	33.5	Very low	34.7	Very low	177 Å²	177	145.3 Å²	145.3	95%	0.947	80%	0.801	S	S	*	*			trans	-163.4	140.7	133.8	-107.1	-29.4	0	0	0	109.1
33	D	36.3	Very low	34.9	Very low	154 Å²	154	140.3 Å²	140.3	82%	0.824	80%	0.801	S	S	*	*			trans	-96.5	168.1	-168.5	-112.9	-27	0	0	0	113.1
34	P	45.3	Very low	35.1	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	81%	0.806	S	S	*	*			trans	-79.8	155.2	-173.4	33.6	-35.8	0	0	0	113.4
35	I	35.6	Very low	35.3	Very low	167 Å²	167	139.1 Å²	139.1	86%	0.856	81%	0.814	S	S	*	*			trans	-113.4	123.2	169.3	-67.4	177.6	0	0	0	108.9
36	E	39.8	Very low	35.8	Very low	169 Å²	169	136.3 Å²	136.3	79%	0.79	82%	0.817	S	S	*	*			trans	-68.5	155.7	168.2	-55.8	-178.9	124	0	0	110.6
37	D	34.9	Very low	35.8	Very low	168 Å²	168	133.7 Å²	133.7	90%	0.898	82%	0.815	S	S	*	*			trans	-142.8	143.3	150.1	-140	-23.7	0	0	0	111
38	V	35.7	Very low	35.7	Very low	104 Å²	104	138.5 Å²	138.5	63%	0.63	82%	0.822	S	S	*	*			trans	-116.5	138.7	-157.9	174.1	0	0	0	0	112.1
39	N	36.2	Very low	35.8	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	82%	0.822	S	S	*	*			trans	-3.6	133.6	164.6	-61.3	-48.8	0	0	0	117.8
40	N	35	Very low	35.7	Very low	169 Å²	169	140.5 Å²	140.5	90%	0.904	82%	0.822	S	S	*	*				-148.1	148	123.3	-118.4	-44.2	0	0	0	116.3
41	S	36.5	Very low	36.1	Very low	96 Å²	96	146 Å²	146	67%	0.671	83%	0.833	S	S	*	*			trans	-83.8	142.7	-164.1	176.9	0	0	0	0	114.7
42	T	37.9	Very low	35.9	Very low	145 Å²	145	144.8 Å²	144.8	89%	0.89	83%	0.833	S	S	*	*				177.9	144.5	127.2	23.6	0	0	0	0	109.3
43	G	32.3	Very low	36.1	Very low	76 Å²	76	141.5 Å²	141.5	78%	0.784	82%	0.823	S	S	*	*			cis	149	104.9	-2.9	0	0	0	0	0	110.6
44	G	34.5	Very low	36.6	Very low	82 Å²	82	140 Å²	140	85%	0.845	82%	0.822	S	S	*	*			trans	168.8	136.2	179.4	0	0	0	0	0	113
45	E	36.1	Very low	36.1	Very low	199 Å²	199	140.9 Å²	140.9	93%	0.93	83%	0.826	S	S	*	*			trans	-111.6	140.5	-165.7	-55.6	172.2	119.8	0	0	113.5
46	S	40.7	Very low	36.6	Very low	125 Å²	125	139 Å²	139	87%	0.874	83%	0.825	S	S	*	*			trans	-169	113	141.3	61.6	0	0	0	0	109.5
47	G	31.3	Very low	36.1	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	83%	0.825	S	S	*	*			trans	-109.1	159.7	-178.4	0	0	0	0	0	113.8
48	F	31.7	Very low	35.9	Very low	219 Å²	219	138.4 Å²	138.4	96%	0.961	83%	0.827	S	S	*	*			trans	-146.4	144.3	151.7	-121.8	-84.1	0	0	0	109
49	T	35.4	Very low	35.8	Very low	128 Å²	128	145.6 Å²	145.6	79%	0.785	84%	0.842	S	S	*	*			trans	-96.6	139.5	-158.7	-24.9	0	0	0	0	113.5
50	E	32.2	Very low	35.5	Very low	188 Å²	188	142.1 Å²	142.1	88%	0.879	84%	0.84	S	S	*	*			trans	-101.4	149	164.5	-167.8	163.2	-144.2	0	0	109.1
51	M	40.8	Very low	35.3	Very low	180 Å²	180	138.9 Å²	138.9	89%	0.887	84%	0.837	S	S	*	*			trans	-137.1	137.7	179.7	-89.6	-169	167.9	0	0	112
52	D	31.5	Very low	35.2	Very low	165 Å²	165	138.7 Å²	138.7	88%	0.882	84%	0.841	S	S	*	*			trans	-80.7	164.2	-171.2	-106.9	-51.9	0	0	0	115.3
53	S	39.3	Very low	35	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	83%	0.831	S	S	*	*			trans	-74.3	159.6	169.5	-62.6	0	0	0	0	112.2
54	P	46.3	Very low	35.2	Very low	122 Å²	122	141.1 Å²	141.1	79%	0.792	82%	0.824	S	S	*	*				-149.6	161.9	116.4	36.9	-21.4	0	0	0	116.8
55	T	33.8	Very low	35.1	Very low	135 Å²	135	144 Å²	144	83%	0.828	82%	0.819	S	S	*	*			trans	-139.5	172.6	155.1	58.9	0	0	0	0	107.3
56	P	46.3	Very low	34.9	Very low	128 Å²	128	141.7 Å²	141.7	83%	0.831	81%	0.808	S	S	*	*			cis	-129.6	-174.6	2.3	42.5	-26.3	0	0	0	114.7
57	G	28.9	Very low	34.4	Very low	78 Å²	78	144.5 Å²	144.5	80%	0.804	81%	0.808	S	S	*	*			trans	-140.7	155.8	173.3	0	0	0	0	0	113.7
58	R	32.3	Very low	34.4	Very low	246 Å²	246	145 Å²	145	93%	0.928	81%	0.813	S	S	*	*			trans	-153.8	159.5	-173.3	-165.8	-179.5	-176.3	-151.3	2.1	111.9
59	R	32.3	Very low	34.3	Very low	254 Å²	254	138.1 Å²	138.1	96%	0.958	80%	0.804	S	S	*	*			trans	97.7	147.5	-178.3	-56.8	168.5	-168.1	-156.8	4.9	113.1
60	G	30.1	Very low	34	Very low	70 Å²	70	137.4 Å²	137.4	72%	0.722	80%	0.804	S	S	*	*			cis	171.9	176.3	-5.6	0	0	0	0	0	113.8
61	A	30.4	Very low	34.1	Very low	101 Å²	101	134.1 Å²	134.1	84%	0.835	80%	0.802	S	S	*	*			trans	71.6	138.4	-175.8	0	0	0	0	0	115.8
62	A	34.5	Very low	34.9	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	80%	0.796	S	S	*	*			cis	83.5	145.8	36.4	0	0	0	0	0	113
63	D	35.3	Very low	35	Very low	127 Å²	127	130.7 Å²	130.7	68%	0.679	79%	0.793	S	S	*	*			cis	-163.1	177.2	17.4	-135.7	-5	0	0	0	107.5
64	K	35.7	Very low	34.6	Very low	146 Å²	146	131.7 Å²	131.7	64%	0.635	79%	0.79	S	S	*	*			cis	-172.7	170.7	-4.3	-149	174.9	-149.3	71.1	0	111.2
65	L	31.9	Very low	34	Very low	142 Å²	142	134.2 Å²	134.2	74%	0.743	79%	0.791	S	S	*	*			trans	70	152.5	157.1	-61.6	178.3	0	0	0	119.8
66	Q	32.5	Very low	34	Very low	150 Å²	150	132.8 Å²	132.8	70%	0.701	79%	0.787	S	S	*	*			cis	-168	167.2	-20.2	-166.4	176.2	-14.3	0	0	111.4
67	E	30.7	Very low	33.3	Very low	184 Å²	184	130.5 Å²	130.5	86%	0.86	79%	0.786	S	S	*	*			trans	71.5	152.4	168.4	-48.1	-166.5	152.6	0	0	118.8
68	G	29.7	Very low	33.4	Very low	82 Å²	82	129.9 Å²	129.9	85%	0.845	78%	0.779	S	S	*	*			cis	160.6	133.8	-16.4	0	0	0	0	0	115.5
69	G	29.6	Very low	33.5	Very low	76 Å²	76	125.6 Å²	125.6	78%	0.784	78%	0.775	S	S	*	*			trans	123.8	139.1	153.2	0	0	0	0	0	123.1
70	S	30	Very low	33.8	Very low	113 Å²	113	120.9 Å²	120.9	79%	0.79	77%	0.769	S	S	*	*			trans	63.8	91.9	144	60.8	0	0	0	0	126.3
71	S	33.6	Very low	34.1	Very low	119 Å²	119	124.4 Å²	124.4	83%	0.832	77%	0.771	S	S	*	*				53.8	180	106.3	-26.3	0	0	0	0	123.6
72	P	59.2	Low	34.6	Very low	118 Å²	118	125.1 Å²	125.1	77%	0.766	77%	0.765	S	S	*	*			trans	-135.2	-163.1	-133.3	38	-11.9	0	0	0	116.3
73	L	31.8	Very low	34.7	Very low	155 Å²	155	128.5 Å²	128.5	81%	0.812	77%	0.765	S	S	*	*			trans	-175.7	131.8	152.4	-103	161.8	0	0	0	116.3
74	N	32.2	Very low	34.6	Very low	128 Å²	128	128.3 Å²	128.3	68%	0.684	76%	0.763	S	S	*	*			trans	21.7	136.1	137	-67.4	6.9	0	0	0	122.9
75	H	33.3	Very low	34.6	Very low	174 Å²	174	130.7 Å²	130.7	81%	0.806	77%	0.768	S	S	*	*				66.4	144	74.7	-76.8	-69.2	0	0	0	115
76	S	33.9	Very low	34.6	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	76%	0.764	S	S	*	*			cis	-174.4	162.1	0.7	44.9	0	0	0	0	112.8
77	G	30.6	Very low	34.9	Very low	80 Å²	80	129.2 Å²	129.2	83%	0.825	76%	0.761	S	S	*	*			trans	83.6	146.6	168.4	0	0	0	0	0	114.7
78	G	32.1	Very low	35.1	Very low	64 Å²	64	129 Å²	129	66%	0.66	76%	0.76	S	S	*	*			cis	163.1	169.6	5	0	0	0	0	0	109.4
79	D	34.5	Very low	35.1	Very low	156 Å²	156	132.2 Å²	132.2	83%	0.834	76%	0.758	S	S	*	*			cis	-155.9	-169.5	-10.8	-62.4	-56.4	0	0	0	105.1
80	D	38.3	Very low	35.1	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	76%	0.755	S	S	*	*			cis	-161.5	-146.6	6.4	-154.6	-40.4	0	0	0	108.4
81	D	36.2	Very low	35	Very low	144 Å²	144	137.2 Å²	137.2	77%	0.77	75%	0.751	S	S	*	*			trans	85.2	90.3	165.5	-85.4	-14.4	0	0	0	120.8
82	V	40.6	Very low	35.1	Very low	117 Å²	117	136.7 Å²	136.7	71%	0.709	75%	0.747	S	S	*	*			trans	-0.1	156.2	134.7	-93.5	0	0	0	0	120.6
83	E	37.5	Very low	34.6	Very low	163 Å²	163	137.1 Å²	137.1	76%	0.762	75%	0.75	S	S	*	*			cis	-162.4	167.5	28.4	-126.6	-174.3	-160.2	0	0	108.8
84	L	32.5	Very low	34.5	Very low	122 Å²	122	134.3 Å²	134.3	64%	0.639	74%	0.744	S	S	*	*			cis	-157.6	133.4	-2.8	-171.2	81.9	0	0	0	109.8
85	W	34.9	Very low	34.3	Very low	197 Å²	197	135.2 Å²	135.2	75%	0.746	75%	0.747	S	S	*	*			trans	22.7	152.9	143.3	-48.9	60.6	0	0	0	121.4
86	D	32.3	Very low	34.1	Very low	122 Å²	122	133.8 Å²	133.8	65%	0.652	75%	0.745	S	S	*	*			cis	-146.7	136.5	24.7	-97.8	-50.3	0	0	0	111.5
87	E	38.9	Very low	33.9	Very low	138 Å²	138	138 Å²	138	65%	0.645	75%	0.753	S	S	*	*				67.2	108.8	97.3	-73.3	-167.1	-176.1	0	0	115.8
88	E	34.9	Very low	34.1	Very low	179 Å²	179	139.3 Å²	139.3	84%	0.836	75%	0.749	S	S	*	*				86.9	148.5	84.2	-78.9	-164.6	-171.6	0	0	114.6
89	D	31.1	Very low	34.6	Very low	150 Å²	150	142 Å²	142	80%	0.802	76%	0.755	S	S	*	*				-132.4	-109.1	-73.5	-170.6	31.6	0	0	0	110.1
90	F	29.5	Very low	34.4	Very low	163 Å²	163	139.8 Å²	139.8	72%	0.715	75%	0.752	S	S	*	*			cis	-158.4	166.8	-8.2	-168.9	-109.1	0	0	0	110.7
91	D	27.8	Very low	34.2	Very low	131 Å²	131	137.3 Å²	137.3	70%	0.701	75%	0.747	S	S	*	*			trans	68.6	139.6	167.6	-97.9	-30.3	0	0	0	121.2
92	S	35.9	Very low	34	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	75%	0.753	S	S	*	*			trans	-115.1	149.9	160	-64.3	0	0	0	0	108.5
93	P	48	Very low	33.7	Very low	126 Å²	126	138.1 Å²	138.1	82%	0.818	75%	0.751	S	S	*	*				-153.8	166	101.1	37.5	-18.7	0	0	0	118.3
94	S	29.9	Very low	33.4	Very low	97 Å²	97	139 Å²	139	68%	0.678	75%	0.753	S	S	*	*			trans	-45.5	161.8	169.1	56.6	0	0	0	0	120.6
95	L	28.3	Very low	33.4	Very low	146 Å²	146	136.7 Å²	136.7	76%	0.764	75%	0.751	S	S	*	*			trans	125.9	126.4	138.4	-68.7	171.3	0	0	0	117.8
96	L	28.6	Very low	33.2	Very low	145 Å²	145	134.5 Å²	134.5	76%	0.759	75%	0.754	S	S	*	*			trans	40.1	109.9	135	-59.8	174.1	0	0	0	121.3
97	Q	28.5	Very low	33	Very low	193 Å²	193	134.5 Å²	134.5	90%	0.902	76%	0.762	S	S	*	*				172.5	155.5	100.9	-96	177.8	3	0	0	113.2
98	S	35.2	Very low	32.7	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	77%	0.77	S	S	*	*			trans	-100.3	159.8	169	56.7	0	0	0	0	110.7
99	P	43.4	Very low	33.3	Very low	120 Å²	120	130.8 Å²	130.8	78%	0.779	77%	0.769	S	S	*	*				-153.2	173.8	99.8	39.5	-21.5	0	0	0	117.5
100	S	30.3	Very low	33.5	Very low	111 Å²	111	128.7 Å²	128.7	78%	0.776	77%	0.766	S	S	*	*			trans	-20.8	159.1	150.2	-51.9	0	0	0	0	118.6
101	S	33.3	Very low	34.6	Very low	103 Å²	103	126 Å²	126	72%	0.72	76%	0.764	S	S	*	*			cis	178.8	153.2	-9	50	0	0	0	0	110.9
102	V	33.3	Very low	34.7	Very low	148 Å²	148	129.4 Å²	129.4	90%	0.897	77%	0.773	S	S	*	*			trans	-138.9	159.6	164.7	-170.5	0	0	0	0	109.9
103	I	34.1	Very low	34.6	Very low	129 Å²	129	133.6 Å²	133.6	66%	0.662	78%	0.777	S	S	*	*			trans	-129.5	160.7	-168.1	2.2	175.8	0	0	0	110.1
104	F	30.1	Very low	33.7	Very low	182 Å²	182	134 Å²	134	80%	0.798	78%	0.778	S	S	*	*				-160	156.6	54.3	-92.5	-76.5	0	0	0	115.3
105	A	32.3	Very low	33.6	Very low	73 Å²	73	134.7 Å²	134.7	60%	0.603	78%	0.782	S	S	*	*			trans	12.2	153.1	131.5	0	0	0	0	0	121.4
106	N	32.3	Very low	33.7	Very low	152 Å²	152	138.9 Å²	138.9	81%	0.813	79%	0.788	S	S	*	*			cis	-171.7	174.6	-4.9	-116.5	-12.3	0	0	0	113.4
107	C	26.8	Very low	33.7	Very low	121 Å²	121	140 Å²	140	82%	0.818	79%	0.791	S	S	*	*			trans	82.3	133.6	152.8	-71.1	0	0	0	0	122.3
108	S	33.3	Very low	33.7	Very low	115 Å²	115	142.2 Å²	142.2	80%	0.804	79%	0.793	S	S	*	*			trans	-93.1	-167.2	161.3	-29.1	0	0	0	0	109.8
109	P	48.2	Very low	33.4	Very low	125 Å²	125	140.6 Å²	140.6	81%	0.812	79%	0.793	S	S	*	*			cis	-143	-166.7	16.1	42.5	-20	0	0	0	116.8
110	S	33.7	Very low	32.6	Very low	106 Å²	106	138.9 Å²	138.9	74%	0.741	80%	0.797	S	S	*	*			trans	-74.7	-161	166.4	-33.8	0	0	0	0	112.2
111	P	52.6	Low	32.6	Very low	106 Å²	106	139.2 Å²	139.2	69%	0.688	80%	0.8	S	S	*	*			cis	-143.9	-169.1	-5.1	27.4	0.1	0	0	0	116.2
112	K	31.5	Very low	33.3	Very low	202 Å²	202	140.3 Å²	140.3	88%	0.878	80%	0.804	S	S	*	*			trans	135.7	161.5	135.2	-72.8	176.6	-178.5	174.2	0	119.2
113	K	32	Very low	33.2	Very low	197 Å²	197	141.5 Å²	141.5	86%	0.857	80%	0.8	S	S	*	*			trans	-90	174.1	-167.8	-49.5	167.9	175.6	179.9	0	114.5
114	V	30.3	Very low	33.1	Very low	136 Å²	136	144.4 Å²	144.4	82%	0.824	80%	0.803	S	S	*	*				162	131.9	117.7	157	0	0	0	0	115.8
115	S	28.4	Very low	32.9	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	80%	0.8	S	S	*	*			trans	58.6	167.8	159.4	-120.2	0	0	0	0	120
116	R	29.4	Very low	32.8	Very low	235 Å²	235	145.9 Å²	145.9	89%	0.887	81%	0.805	S	S	*	*			cis	-145.5	-163.7	9.1	-152.1	168.4	-179.1	177.7	-0.7	111.9
117	M	28.4	Very low	32.8	Very low	167 Å²	167	145 Å²	145	82%	0.823	80%	0.798	S	S	*	*			trans	-117.7	-178.1	-167.1	-53.9	-171	82.5	0	0	115.1
118	Y	29.8	Very low	33.1	Very low	240 Å²	240	146.7 Å²	146.7	94%	0.941	79%	0.794	S	S	*	*			trans	76.5	146.1	-175.9	-62.9	-94.6	0	0	0	114.9
119	G	27.1	Very low	33.2	Very low	74 Å²	74	146.6 Å²	146.6	76%	0.763	79%	0.785	S	S	*	*			cis	155.9	145.7	-10.8	0	0	0	0	0	113.6
120	G	26.9	Very low	32.5	Very low	84 Å²	84	148 Å²	148	87%	0.866	79%	0.786	S	S	*	*			trans	108.1	142.4	165.8	0	0	0	0	0	117.5
121	S	31.2	Very low	32.6	Very low	119 Å²	119	146.2 Å²	146.2	83%	0.832	78%	0.783	S	S	*	*			trans	-94.6	170.7	159.3	-52.3	0	0	0	0	109.6
122	P	48.3	Very low	32	Very low	126 Å²	126	151.2 Å²	151.2	82%	0.818	80%	0.798	S	S	*	*				-151.1	-173.6	94.7	40.5	-22.3	0	0	0	116.5
123	E	30.9	Very low	32.2	Very low	173 Å²	173	144.9 Å²	144.9	81%	0.808	79%	0.79	S	S	*	*			trans	-67.3	-178.2	171.1	-68.3	171.5	110.7	0	0	114.4
124	R	31.3	Very low	32.4	Very low	190 Å²	190	141.3 Å²	141.3	72%	0.717	79%	0.79	S	S	*	*			cis	171.3	109.3	-31.3	176.1	-163.5	171.6	-163.5	-2.8	109.5
125	S	27.2	Very low	32.5	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	79%	0.788	S	S	*	*			trans	-173.5	131.7	168	42.6	0	0	0	0	110.2
126	Y	29.3	Very low	32.8	Very low	182 Å²	182	140.1 Å²	140.1	71%	0.714	79%	0.787	S	S	*	*				63.6	129.3	72.8	-68.8	-58.4	0	0	0	112.7
127	I	31.6	Very low	33.7	Very low	132 Å²	132	134.4 Å²	134.4	68%	0.677	78%	0.781	S	S	*	*			cis	-167	157.7	4.3	-150.3	166.5	0	0	0	112.1
128	Q	33.8	Very low	34.2	Very low	157 Å²	157	133 Å²	133	73%	0.734	78%	0.775	S	S	*	*			trans	61.6	160.4	156.1	-85.6	-176.1	-69	0	0	121.9
129	D	34.8	Very low	35	Very low	113 Å²	113	127 Å²	127	60%	0.604	77%	0.765	S	S	*	*			cis	-159.4	-172.7	-22.1	-139.8	-30.3	0	0	0	110.7
130	D	34.6	Very low	35.3	Very low	156 Å²	156	130 Å²	130	83%	0.834	76%	0.764	S	S	*	*			trans	72	142.8	161.9	-53.4	-39.4	0	0	0	119.1
131	G	35.7	Very low	35.5	Very low	67 Å²	67	132.2 Å²	132.2	69%	0.691	77%	0.765	S	S	*	*			cis	175.1	144.5	-9.6	0	0	0	0	0	114.6
132	E	39.5	Very low	35.9	Very low	211 Å²	211	132.9 Å²	132.9	99%	0.986	77%	0.766	S	S	*	*			trans	60.1	147.5	162.7	-51	-165.2	135.7	0	0	121.4
133	G	35.8	Very low	35.3	Very low	69 Å²	69	134 Å²	134	71%	0.711	77%	0.765	S	S	*	*			cis	174	174.7	-6.9	0	0	0	0	0	114.9
134	S	35.7	Very low	35.9	Very low	122 Å²	122	131.3 Å²	131.3	85%	0.853	76%	0.761	S	S	*	*			trans	76.4	137.8	171.9	-156.7	0	0	0	0	118.4
135	S	33.4	Very low	36.1	Very low	112 Å²	112	127.9 Å²	127.9	78%	0.783	76%	0.763	S	S	*	*			cis	-156	169	-10.8	42.4	0	0	0	0	112.7
136	S	33.3	Very low	36.9	Very low	109 Å²	109	128.4 Å²	128.4	76%	0.762	76%	0.764	S	S	*	*			trans	-112.2	-165.7	-168.2	-28	0	0	0	0	113.4
137	P	49.6	Very low	37.4	Very low	115 Å²	115	129 Å²	129	75%	0.747	77%	0.773	S	S	*	*			cis	-123.2	160.8	-2.1	14.1	13.8	0	0	0	115.5
138	I	37.7	Very low	37.5	Very low	138 Å²	138	131.6 Å²	131.6	71%	0.708	78%	0.779	S	S	*	*				64.8	136.2	72.5	-60	171.7	0	0	0	113
139	P	46.8	Very low	37.8	Very low	113 Å²	113	131 Å²	131	73%	0.734	79%	0.787	S	S	*	*			cis	-132.9	-172.1	26.4	28.1	-3.4	0	0	0	115.9
140	D	33.3	Very low	37.7	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	80%	0.797	S	S	*	*			cis	-163.7	135	-31.4	-92.9	-25.6	0	0	0	108.9
141	C	32.7	Very low	37.8	Very low	129 Å²	129	138 Å²	138	87%	0.872	80%	0.798	S	S	*	*			trans	-166.8	135.2	157.1	-99.3	0	0	0	0	109.7
142	P	38.1	Very low	38.2	Very low	133 Å²	133	144.7 Å²	144.7	86%	0.864	81%	0.808	S	S	*	*			trans	-92.2	151.4	-167.5	35.3	-36	0	0	0	114.9
143	D	35.3	Very low	37.9	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	79%	0.794	S	S	*	*			trans	-106.1	162.9	-177.9	-141.9	-38.6	0	0	0	113.7
144	T	43.6	Very low	38.2	Very low	118 Å²	118	148.2 Å²	148.2	72%	0.724	80%	0.8	S	S	*	*			trans	-16.3	127.6	168.8	-51.2	0	0	0	0	119.1
145	P	36	Very low	38.1	Very low	117 Å²	117	150.7 Å²	150.7	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-87.3	153	167.7	34.9	-33.8	0	0	0	113.8
146	P	43.4	Very low	38.1	Very low	115 Å²	115	153.7 Å²	153.7	75%	0.747	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-99.4	170.5	-166	38.7	-38.6	0	0	0	116.4	K148	P146-K148 PolarHBondContact O-N 3.25Å
147	H	39.8	Very low	38.4	Very low	196 Å²	196	156.5 Å²	156.5	91%	0.907	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-47.7	127.1	170	-85.9	-96.9	0	0	0	113.8
148	K	33.9	Very low	37.8	Very low	186 Å²	186	156.8 Å²	156.8	81%	0.809	81%	0.808	S	S	*	*			trans	-138.7	150.9	157.2	-77.4	-171.4	177.3	172.6	0	111.6	P146	P146-K148 PolarHBondContact O-N 3.25Å
149	T	40.3	Very low	38.2	Very low	145 Å²	145	155.7 Å²	155.7	89%	0.89	81%	0.81	S	S	*	*			trans	-82.3	124.6	-176.1	40.2	0	0	0	0	112	R151	T149-R151 PolarHBondContact O-N 3.25Å
150	F	34.3	Very low	38.1	Very low	184 Å²	184	159.6 Å²	159.6	81%	0.807	82%	0.818	S	S	*	*			trans	-88.5	111.6	178.2	-86.4	-84.1	0	0	0	112.8	L153	F150-L153 HydrophobicContact CD1-CD1 4.39Å; F150-L153 HydrophobicContact CE1-CD1 4.19Å
151	R	35.8	Very low	38.3	Very low	231 Å²	231	158.5 Å²	158.5	87%	0.872	82%	0.817	S	S	*	*			trans	-80.8	156.2	154.7	-69.5	179.2	172.1	-178	-2.6	109.4	T149 L153	T149-R151 PolarHBondContact O-N 3.25Å; R151-L153 PolarHBondContact O-N 3.11Å
152	K	43.4	Very low	38.6	Very low	207 Å²	207	157.9 Å²	157.9	90%	0.9	81%	0.812	S	S	*	*			trans	-21	119	172.9	-81	178.7	168.8	177.1	0	116.1
153	L	33.4	Very low	39	Very low	131 Å²	131	161.9 Å²	161.9	69%	0.686	82%	0.815	S	S	*	*			trans	-128.4	117.5	149.4	-62.2	172.2	0	0	0	104.3	F150 R151	F150-L153 HydrophobicContact CD1-CD1 4.39Å; F150-L153 HydrophobicContact CE1-CD1 4.19Å; R151-L153 PolarHBondContact O-N 3.11Å
154	R	42	Very low	39.7	Very low	223 Å²	223	159.2 Å²	159.2	84%	0.842	81%	0.808	S	S	*	*				47.9	104.5	64.2	-72.9	-166.5	174	-176.3	-0.8	111.6
155	L	33.5	Very low	39.5	Very low	174 Å²	174	161.3 Å²	161.3	91%	0.911	81%	0.814	S	S	*	*			trans	-59.1	142	168.1	-81.3	74	0	0	0	109.4
156	F	34.8	Very low	39.9	Very low	175 Å²	175	164.4 Å²	164.4	77%	0.768	82%	0.823	S	S	*	*			trans	-118.1	140.3	156.4	-85.7	-85.2	0	0	0	107.8	T158	F156-T158 PolarHBondContact O-N 3.43Å
157	D	39.1	Very low	39.7	Very low	169 Å²	169	164 Å²	164	90%	0.904	82%	0.824	S	S	*	*			trans	-66.2	115.5	174.3	-65.7	-67.3	0	0	0	110.4
158	T	36.5	Very low	39.7	Very low	120 Å²	120	166.7 Å²	166.7	74%	0.736	83%	0.826	S	S	*	*			trans	-103.1	135.2	162	37.9	0	0	0	0	110	F156 H160	F156-T158 PolarHBondContact O-N 3.43Å; T158-H160 PolarHBondContact O-N 3.22Å; T158-H160 VanDerWaalsContact O-N 3.13Å
159	P	46.6	Very low	39.7	Very low	115 Å²	115	162.6 Å²	162.6	75%	0.747	83%	0.826	S	S	*	*	S	Bend	trans	-82.7	99.8	-168.1	31.5	-34.2	0	0	0	110.9
160	H	43.6	Very low	39.3	Very low	195 Å²	195	167.7 Å²	167.7	90%	0.903	83%	0.829	S	S	*	*			trans	-164	26.5	151.7	-109	63.7	0	0	0	114.1	T158	T158-H160 PolarHBondContact O-N 3.22Å; T158-H160 VanDerWaalsContact O-N 3.13Å
161	T	37.5	Very low	39.1	Very low	117 Å²	117	165 Å²	165	72%	0.718	83%	0.833	S	S	*	*	S	Bend	trans	-93.2	138.9	173.3	39	0	0	0	0	112.4
162	P	39.3	Very low	38.9	Very low	116 Å²	116	159.6 Å²	159.6	75%	0.753	83%	0.831	S	S	*	*			trans	-73.2	133.6	-176.8	28.1	-34	0	0	0	112.8	S164	P162-S164 PolarHBondContact O-N 3.32Å; P162-S164 VanDerWaalsContact O-N 3.17Å
163	K	48	Very low	38.5	Very low	216 Å²	216	156.3 Å²	156.3	94%	0.939	83%	0.828	S	S	*	*	S	Bend	trans	-82.5	89.6	-173.3	-65.8	179.8	179.4	177.6	0	112.9
164	S	49	Very low	38.5	Very low	93 Å²	93	155.8 Å²	155.8	65%	0.65	83%	0.832	S	S	*	*			trans	-140.1	-3.9	171.5	60.9	0	0	0	0	116.6	P162	P162-S164 PolarHBondContact O-N 3.32Å; P162-S164 VanDerWaalsContact O-N 3.17Å
165	L	39	Very low	37.8	Very low	163 Å²	163	148.8 Å²	148.8	85%	0.853	83%	0.83	S	S	*	*	S	Bend	trans	-119.3	14.2	-171.4	-83	170.7	0	0	0	116.7
166	L	45.9	Very low	37.7	Very low	182 Å²	182	146.2 Å²	146.2	95%	0.953	83%	0.826	S	S	*	*	S	Bend	trans	-135.6	50.3	179.8	-85.3	176	0	0	0	114.3
167	S	39.1	Very low	37.3	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	83%	0.827	S	S	*	*	S	Bend	trans	-144.6	30.1	-178	58.8	0	0	0	0	116.8
168	R	39.1	Very low	37.1	Very low	252 Å²	252	140.1 Å²	140.1	95%	0.951	82%	0.818	S	S	*	*	S	Bend	trans	-150.6	47.1	171.3	-129.5	168.4	81	159.9	3.4	117.8
169	A	33.2	Very low	36.8	Very low	100 Å²	100	145 Å²	145	83%	0.826	82%	0.824	S	S	*	*	S	Bend	trans	-141.2	18.3	177.6	0	0	0	0	0	116.5
170	R	32.7	Very low	36	Very low	251 Å²	251	151.3 Å²	151.3	95%	0.947	83%	0.832	S	S	*	*			trans	-144.4	88	169.4	-74.2	-163.7	178.3	-164.5	-0.6	113
171	S	30.4	Very low	35.4	Very low	128 Å²	128	147.9 Å²	147.9	90%	0.895	83%	0.825	S	S	*	*			trans	-150.6	152.6	154.9	51.8	0	0	0	0	109.1
172	S	31.1	Very low	35.1	Very low	118 Å²	118	146.1 Å²	146.1	83%	0.825	82%	0.822	S	S	*	*			trans	-92.4	164.2	-160.8	42	0	0	0	0	115.3
173	V	34.4	Very low	34.8	Very low	137 Å²	137	148.4 Å²	148.4	83%	0.83	83%	0.827	S	S	*	*			trans	-64.7	146.1	178.2	179.7	0	0	0	0	112
174	P	34.4	Very low	34	Very low	120 Å²	120	146.2 Å²	146.2	78%	0.779	82%	0.818	S	S	*	*			trans	-134.5	153.3	131.8	37.9	-29.1	0	0	0	113.8
175	G	27.3	Very low	33.2	Very low	76 Å²	76	149.6 Å²	149.6	78%	0.784	82%	0.821	S	S	*	*			trans	97.4	103.4	153.1	0	0	0	0	0	117.6
176	S	30.1	Very low	32.8	Very low	120 Å²	120	148.3 Å²	148.3	84%	0.839	82%	0.815	S	S	*	*			trans	-73.7	142.6	164.2	174.2	0	0	0	0	111.9
177	S	27.8	Very low	32	Very low	112 Å²	112	145.2 Å²	145.2	78%	0.783	80%	0.804	S	S	*	*			trans	-164.1	138.1	139.3	-90.5	0	0	0	0	113.5
178	S	33.3	Very low	31.4	Very low	104 Å²	104	149 Å²	149	73%	0.727	81%	0.81	S	S	*	*			trans	-76.4	140.7	176.2	180	0	0	0	0	112.6
179	R	30.2	Very low	30.9	Very low	223 Å²	223	142.1 Å²	142.1	84%	0.842	80%	0.8	S	S	*	*			trans	-167.8	107.9	139.9	-111.7	166.2	-71.9	-174.3	0.5	111.8
180	R	30.6	Very low	31.2	Very low	247 Å²	247	143 Å²	143	93%	0.932	80%	0.797	S	S	*	*			trans	-77.2	120	155.4	-63.9	-174.4	-170.1	-179.8	4	107.4	A182	R180-A182 PolarHBondContact O-N 3.14Å
181	V	30.5	Very low	30.9	Very low	124 Å²	124	142 Å²	142	75%	0.752	79%	0.793	S	S	*	*			trans	-88	103.5	170	179.8	0	0	0	0	108.2
182	A	32.2	Very low	30.9	Very low	80 Å²	80	145.6 Å²	145.6	66%	0.661	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.3	135.4	164.4	0	0	0	0	0	108.9	R180	R180-A182 PolarHBondContact O-N 3.14Å
183	L	31.8	Very low	30.7	Very low	164 Å²	164	144.1 Å²	144.1	86%	0.859	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-83.9	143.5	170.1	-73	170.1	0	0	0	110.4
184	F	32.6	Very low	30.3	Very low	169 Å²	169	147 Å²	147	74%	0.741	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.7	138.4	-168	-78.6	-80.3	0	0	0	112.1
185	K	31.9	Very low	30.1	Very low	165 Å²	165	147.3 Å²	147.3	72%	0.717	78%	0.784	S	S	*	*				53.4	144.3	101.4	-67.6	-171	-168.5	176.6	0	114.6
186	N	29.5	Very low	30	Very low	136 Å²	136	151.2 Å²	151.2	73%	0.727	79%	0.787	S	S	*	*			cis	-145.2	178.1	13.7	-109.5	-12.3	0	0	0	108
187	V	30	Very low	30.1	Very low	117 Å²	117	150.4 Å²	150.4	71%	0.709	78%	0.781	S	S	*	*				-172.1	137.7	75.4	154.3	0	0	0	0	111.3
188	E	27.1	Very low	30.6	Very low	187 Å²	187	148.5 Å²	148.5	87%	0.874	78%	0.779	S	S	*	*			trans	57	145	157	-73.3	164.4	-163.6	0	0	124.3
189	S	28.6	Very low	30.4	Very low	107 Å²	107	155.4 Å²	155.4	75%	0.748	79%	0.789	S	S	*	*			trans	-155.7	148.9	168.8	171.8	0	0	0	0	107.3
190	P	38.5	Very low	30.6	Very low	117 Å²	117	154.7 Å²	154.7	76%	0.76	79%	0.793	S	S	*	*			trans	-134	118.8	143.2	32.5	-18.9	0	0	0	114.2
191	R	27.6	Very low	30.5	Very low	230 Å²	230	152.2 Å²	152.2	87%	0.868	79%	0.791	S	S	*	*				32.6	124	129.9	-54.4	175.3	172.6	-173.3	-4	116.7
192	K	29.4	Very low	30.6	Very low	204 Å²	204	154.7 Å²	154.7	89%	0.887	80%	0.795	S	S	*	*				-164.1	167.7	70.1	-113.1	175.4	-178.6	176.9	0	113.2
193	S	27.2	Very low	30.5	Very low	87 Å²	87	158.6 Å²	158.6	61%	0.608	80%	0.801	S	S	*	*			trans	-80.5	151.4	177.6	52.6	0	0	0	0	114
194	F	25.3	Very low	30.5	Very low	197 Å²	197	156.1 Å²	156.1	86%	0.864	80%	0.795	S	S	*	*				-166.9	175.9	110	-104.9	-69.3	0	0	0	111.4
195	T	29.5	Very low	30.8	Very low	128 Å²	128	154.6 Å²	154.6	79%	0.785	79%	0.794	S	S	*	*			trans	-84.9	137.9	-169.6	48.1	0	0	0	0	114.2
196	D	27	Very low	31.1	Very low	157 Å²	157	152.9 Å²	152.9	84%	0.84	80%	0.797	S	S	*	*				-161.4	-175.6	121.8	-153.4	-12.5	0	0	0	110.1
197	S	32.3	Very low	31.6	Very low	103 Å²	103	153.7 Å²	153.7	72%	0.72	80%	0.801	S	S	*	*			trans	-102.7	166.1	-159.7	55.4	0	0	0	0	114.2
198	G	38	Very low	32.3	Very low	72 Å²	72	155.2 Å²	155.2	74%	0.742	80%	0.799	S	S	*	*			trans	83.5	57	144.1	0	0	0	0	0	119.5
199	R	29.5	Very low	33.5	Very low	249 Å²	249	150.7 Å²	150.7	94%	0.94	78%	0.781	S	S	*	*			trans	-155.1	117.7	150.5	-108.1	155.2	-164.5	-161.7	3.3	112.3
200	K	33	Very low	34.5	Very low	209 Å²	209	151 Å²	151	91%	0.909	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-79.2	121.5	166.8	-73.1	-173	175.6	-175.4	0	108.7
201	Q	29.1	Very low	34.8	Very low	194 Å²	194	154.1 Å²	154.1	91%	0.907	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.8	135.1	167.4	-73.8	176.3	-29	0	0	109.4
202	Q	33	Very low	36.4	Very low	177 Å²	177	145.7 Å²	145.7	83%	0.827	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-99.2	120	176.3	-170.2	172.8	11.2	0	0	107.7
203	M	29.8	Very low	37.7	Very low	162 Å²	162	139.4 Å²	139.4	80%	0.798	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-73.6	144.8	173.6	-63.4	-159.3	76.5	0	0	110	L205	M203-L205 PolarHBondContact O-N 3.38Å
204	P	32.5	Very low	38.6	Very low	112 Å²	112	141.3 Å²	141.3	73%	0.727	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-69	119.6	-177.3	27.4	-33.8	0	0	0	110.8	V206	P204-V206 PolarHBondContact O-N 2.92Å
205	L	38.1	Very low	39.7	Very low	137 Å²	137	135.2 Å²	135.2	72%	0.717	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-75.4	119.9	168.3	-75.1	159.2	0	0	0	108.7	M203 F208	M203-L205 PolarHBondContact O-N 3.38Å; L205-F208 HydrophobicContact CB-CE2 4.06Å; L205-F208 HydrophobicContact CD1-CE2 4.27Å
206	V	39.1	Very low	40.6	Very low	128 Å²	128	133.5 Å²	133.5	78%	0.776	71%	0.707	S	S	*	*			trans	-105.2	136.6	179.6	-176.9	0	0	0	0	109.6	P204	P204-V206 PolarHBondContact O-N 2.92Å
207	N	38.3	Very low	41.8	Very low	154 Å²	154	130.1 Å²	130.1	82%	0.824	69%	0.688	S	S	*	*			trans	68.3	78.5	171.4	-149.4	22.9	0	0	0	116.9
208	F	45.6	Very low	42.8	Very low	148 Å²	148	130.6 Å²	130.6	65%	0.649	68%	0.682	S	S	*	*			trans	-90.3	135.5	157.6	-81.9	-87.9	0	0	0	110.2	L205 P210	L205-F208 HydrophobicContact CB-CE2 4.06Å; L205-F208 HydrophobicContact CD1-CE2 4.27Å; F208-P210 WeakPolarHBondContact O-CD 3.42Å
209	N	51.3	Low	43.2	Very low	93 Å²	93	132.3 Å²	132.3	50%	0.497	67%	0.67	S	S	.	*			trans	-74.1	118	172.4	174.2	10.1	0	0	0	109.8	F211 T212	N209-F211 PolarHBondContact O-N 3.41Å; N209-F211 VanDerWaalsContact O-N 3.12Å; N209-F211 PolarHBondContact OD1-N 3.12Å; N209-T212 PolarHBondContact O-N 3.14Å; N209-T212 PolarHBondContact O-OG1 3.02Å
210	P	50.1	Low	43.9	Very low	114 Å²	114	123.5 Å²	123.5	74%	0.74	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-7.8	-177.2	29.3	-36.5	0	0	0	114.3	F208	F208-P210 WeakPolarHBondContact O-CD 3.42Å
211	F	46	Very low	44.6	Very low	181 Å²	181	116.5 Å²	116.5	79%	0.794	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	23.5	176.3	-57.4	-72.5	0	0	0	113.3	N209 P213	N209-F211 PolarHBondContact O-N 3.41Å; N209-F211 VanDerWaalsContact O-N 3.12Å; N209-F211 PolarHBondContact OD1-N 3.12Å; F211-P213 WeakPolarHBondContact O-CD 3.27Å
212	T	60.4	Low	45.6	Very low	53 Å²	53	110.9 Å²	110.9	33%	0.325	61%	0.607	S	S	.	*			trans	-83	118.4	173	-47.3	0	0	0	0	108.6	N209 L216 L217	N209-T212 PolarHBondContact O-N 3.14Å; N209-T212 PolarHBondContact O-OG1 3.02Å; T212-L216 HydrophobicContact CG2-CB 4.46Å; T212-L216 HydrophobicContact CG2-CD1 4.48Å; T212-L217 HydrophobicContact CG2-CD1 4.11Å
213	P	56.5	Low	46.3	Very low	72 Å²	72	109.2 Å²	109.2	47%	0.468	60%	0.599	S	S	.	*			trans	-68.1	138.7	-178.5	27.2	-34.5	0	0	0	111.6	F211 S215 L216	F211-P213 WeakPolarHBondContact O-CD 3.27Å; P213-S215 PolarHBondContact O-N 2.94Å; P213-L216 HydrophobicContact CG-CD1 4.03Å; P213-L216 HydrophobicContact CG-CG 4.43Å; P213-L216 PolarHBondContact O-N 3.06Å
214	D	46.7	Very low	47.1	Very low	128 Å²	128	108.7 Å²	108.7	68%	0.684	60%	0.595	S	S	*	*	H	α-helix	trans	-55	-28.6	-173.3	-69.9	-51.5	0	0	0	114.2	L216 L217 I218	D214-L216 PolarHBondContact O-N 2.75Å; D214-L217 PolarHBondContact O-N 2.69Å; D214-L217 VanDerWaalsContact O-N 3.12Å; D214-I218 WeakPolarHBondContact O-CG1 3.32Å; D214-I218 PolarHBondContact O-N 2.88Å; D214-I218 VanDerWaalsContact O-N 3.15Å
215	S	47.5	Very low	47.6	Very low	69 Å²	69	113.2 Å²	113.2	48%	0.483	60%	0.597	S	S	.	*	H	α-helix	trans	-55.9	-35.2	175.8	49	0	0	0	0	113.1	P213 Q219	P213-S215 PolarHBondContact O-N 2.94Å; S215-Q219 PolarHBondContact O-N 3.14Å
216	L	48.2	Very low	47.8	Very low	92 Å²	92	112.3 Å²	112.3	48%	0.482	59%	0.593	S	S	.	*	H	α-helix	trans	-74.7	-35.5	176.5	-73.3	171.9	0	0	0	112.6	T212 P213 D214 I218 Q219 S220	T212-L216 HydrophobicContact CG2-CB 4.46Å; T212-L216 HydrophobicContact CG2-CD1 4.48Å; P213-L216 HydrophobicContact CG-CD1 4.03Å; P213-L216 HydrophobicContact CG-CG 4.43Å; P213-L216 PolarHBondContact O-N 3.06Å; D214-L216 PolarHBondContact O-N 2.75Å; L216-I218 VanDerWaalsContact C-N 3.33Å; L216-I218 PolarHBondContact O-N 3.47Å; L216-Q219 PolarHBondContact O-N 2.93Å; L216-S220 PolarHBondContact O-N 2.77Å; L216-S220 VanDerWaalsContact O-N 3.11Å
217	L	53.9	Low	48.1	Very low	85 Å²	85	112.2 Å²	112.2	45%	0.445	59%	0.588	S	S	.	*	H	α-helix	trans	-62.4	-42.5	174.5	-92	91	0	0	0	111	T212 D214 Q219 S220 A221	T212-L217 HydrophobicContact CG2-CD1 4.11Å; D214-L217 PolarHBondContact O-N 2.69Å; D214-L217 VanDerWaalsContact O-N 3.12Å; L217-Q219 VanDerWaalsContact C-N 3.33Å; L217-Q219 PolarHBondContact O-N 3.48Å; L217-S220 PolarHBondContact O-N 3.08Å; L217-S220 PolarHBondContact O-OG 3.29Å; L217-A221 PolarHBondContact O-N 3.47Å; L217-A221 VanDerWaalsContact O-N 3.1Å
218	I	51.7	Low	48.4	Very low	114 Å²	114	115.6 Å²	115.6	59%	0.585	59%	0.589	S	S	*	*	H	α-helix	trans	-63	-38	179.7	-63.9	166.1	0	0	0	111.6	D214 L216 T222	D214-I218 WeakPolarHBondContact O-CG1 3.32Å; D214-I218 PolarHBondContact O-N 2.88Å; D214-I218 VanDerWaalsContact O-N 3.15Å; L216-I218 VanDerWaalsContact C-N 3.33Å; L216-I218 PolarHBondContact O-N 3.47Å; I218-T222 PolarHBondContact O-N 3.42Å; I218-T222 PolarHBondContact O-OG1 3.34Å; I218-T222 VanDerWaalsContact O-OG1 3.09Å
219	Q	46	Very low	48.2	Very low	108 Å²	108	116.7 Å²	116.7	51%	0.505	59%	0.594	S	S	.	*	H	α-helix	trans	-65.1	-42.6	173.1	-71.5	-177.2	-3.8	0	0	112.3	S215 L216 L217 A221 T222 Q223	S215-Q219 PolarHBondContact O-N 3.14Å; L216-Q219 PolarHBondContact O-N 2.93Å; L217-Q219 VanDerWaalsContact C-N 3.33Å; L217-Q219 PolarHBondContact O-N 3.48Å; Q219-A221 VanDerWaalsContact C-N 3.35Å; Q219-A221 PolarHBondContact O-N 2.88Å; Q219-T222 PolarHBondContact O-N 2.98Å; Q219-T222 PolarHBondContact O-OG1 2.94Å; Q219-Q223 PolarHBondContact O-N 3.2Å
220	S	45.2	Very low	47.6	Very low	63 Å²	63	122.2 Å²	122.2	44%	0.441	61%	0.608	S	S	.	*	H	α-helix	trans	-61.8	-40.3	178.3	77.7	0	0	0	0	113	L216 L217 T222 H224	L216-S220 PolarHBondContact O-N 2.77Å; L216-S220 VanDerWaalsContact O-N 3.11Å; L217-S220 PolarHBondContact O-N 3.08Å; L217-S220 PolarHBondContact O-OG 3.29Å; S220-T222 PolarHBondContact O-N 3.33Å; S220-H224 PolarHBondContact O-N 3.28Å
221	A	48.4	Very low	47.1	Very low	62 Å²	62	121.3 Å²	121.3	51%	0.512	61%	0.61	S	S	.	*	H	α-helix	trans	-68.6	-32.6	-179.5	0	0	0	0	0	112.8	L217 Q219	L217-A221 PolarHBondContact O-N 3.47Å; L217-A221 VanDerWaalsContact O-N 3.1Å; Q219-A221 VanDerWaalsContact C-N 3.35Å; Q219-A221 PolarHBondContact O-N 2.88Å
222	T	50.3	Low	46.6	Very low	77 Å²	77	120.1 Å²	120.1	47%	0.472	61%	0.607	S	S	.	*	H	α-helix	trans	-76.8	-38.9	179.5	47	0	0	0	0	112.2	I218 Q219 S220 H224 R225 N226	I218-T222 PolarHBondContact O-N 3.42Å; I218-T222 PolarHBondContact O-OG1 3.34Å; I218-T222 VanDerWaalsContact O-OG1 3.09Å; Q219-T222 PolarHBondContact O-N 2.98Å; Q219-T222 PolarHBondContact O-OG1 2.94Å; S220-T222 PolarHBondContact O-N 3.33Å; T222-H224 PolarHBondContact O-N 2.88Å; T222-R225 WeakPolarHBondContact O-CB 3.42Å; T222-R225 PolarHBondContact O-N 3.39Å; T222-R225 VanDerWaalsContact O-N 3.12Å; T222-N226 PolarHBondContact O-N 3.01Å
223	Q	47.4	Very low	45.3	Very low	142 Å²	142	127.8 Å²	127.8	66%	0.664	63%	0.63	S	S	*	*	H	α-helix	trans	-59	-44.5	173.5	-70.3	-172	8.1	0	0	112.4	Q219 R225 N226 N227	Q219-Q223 PolarHBondContact O-N 3.2Å; Q223-R225 PolarHBondContact O-N 3.05Å; Q223-N226 PolarHBondContact O-N 3.19Å; Q223-N226 VanDerWaalsContact O-N 3.15Å; Q223-N227 PolarHBondContact O-N 2.88Å; Q223-N227 VanDerWaalsContact O-N 3.16Å
224	H	46.1	Very low	44.4	Very low	151 Å²	151	132.2 Å²	132.2	70%	0.699	65%	0.649	S	S	*	*	H	α-helix	trans	-60.7	-27.7	176.3	-98.5	-71.7	0	0	0	113.8	S220 T222	S220-H224 PolarHBondContact O-N 3.28Å; T222-H224 PolarHBondContact O-N 2.88Å
225	R	42.7	Very low	43.9	Very low	207 Å²	207	133.8 Å²	133.8	78%	0.781	66%	0.658	S	S	*	*	H	α-helix	trans	-75.1	-36.7	176.7	-128.4	176.8	-177.5	-173.8	0.7	112.2	T222 Q223	T222-R225 WeakPolarHBondContact O-CB 3.42Å; T222-R225 PolarHBondContact O-N 3.39Å; T222-R225 VanDerWaalsContact O-N 3.12Å; Q223-R225 PolarHBondContact O-N 3.05Å
226	N	43.3	Very low	43.2	Very low	118 Å²	118	135.5 Å²	135.5	63%	0.631	67%	0.67	S	S	*	*	H	α-helix	trans	-73.2	-37.4	179.5	-72.9	-12.7	0	0	0	112.5	T222 Q223 R228 K229	T222-N226 PolarHBondContact O-N 3.01Å; Q223-N226 PolarHBondContact O-N 3.19Å; Q223-N226 VanDerWaalsContact O-N 3.15Å; N226-R228 PolarHBondContact O-N 3.41Å; N226-K229 PolarHBondContact O-N 2.97Å
227	N	44	Very low	42.5	Very low	126 Å²	126	137.2 Å²	137.2	67%	0.674	69%	0.688	S	S	*	*	H	α-helix	trans	-62.7	-27.8	-177.3	-133.3	10.4	0	0	0	112.9	Q223 K229	Q223-N227 PolarHBondContact O-N 2.88Å; Q223-N227 VanDerWaalsContact O-N 3.16Å; N227-K229 VanDerWaalsContact C-N 3.33Å; N227-K229 PolarHBondContact O-N 3.39Å
228	R	46.3	Very low	41.5	Very low	225 Å²	225	136.4 Å²	136.4	85%	0.849	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-20.6	173.4	-79.2	-171.9	173.5	173.1	1.3	114.9	N226	N226-R228 PolarHBondContact O-N 3.41Å
229	K	39.3	Very low	40.9	Very low	170 Å²	170	140 Å²	140	74%	0.739	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-12.1	178.7	-74.7	-168.8	171.6	-171.5	0	113.8	N226 N227	N226-K229 PolarHBondContact O-N 2.97Å; N227-K229 VanDerWaalsContact C-N 3.33Å; N227-K229 PolarHBondContact O-N 3.39Å
230	R	40.2	Very low	40.3	Very low	209 Å²	209	142.7 Å²	142.7	79%	0.789	73%	0.733	S	S	*	*	S	Bend	trans	-88.4	-15.9	-176.1	-156.3	170.3	-172.1	157.1	5.3	114	H232	R230-H232 VanDerWaalsContact C-N 3.29Å; R230-H232 PolarHBondContact O-N 2.91Å
231	A	38.7	Very low	40.1	Very low	96 Å²	96	148.4 Å²	148.4	79%	0.793	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	27.3	-176.1	0	0	0	0	0	114.7
232	H	36.1	Very low	39.4	Very low	156 Å²	156	154.9 Å²	154.9	72%	0.722	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.4	7	-174.4	-162.6	-65.6	0	0	0	113.1	R230	R230-H232 VanDerWaalsContact C-N 3.29Å; R230-H232 PolarHBondContact O-N 2.91Å
233	W	33.6	Very low	38.9	Very low	214 Å²	214	156 Å²	156	81%	0.811	79%	0.791	S	S	*	*	S	Bend	trans	-127.8	12	-171.2	-77.8	104.5	0	0	0	115.1
234	N	36.9	Very low	38.3	Very low	164 Å²	164	155 Å²	155	88%	0.877	80%	0.8	S	S	*	*			trans	-132.4	67.6	176.3	-86.5	87.3	0	0	0	110.4
235	D	37.1	Very low	37.7	Very low	161 Å²	161	155.6 Å²	155.6	86%	0.861	81%	0.808	S	S	*	*			trans	-157.2	85.1	163.2	-169.9	19	0	0	0	110.6
236	S	32.1	Very low	37.4	Very low	106 Å²	106	152.6 Å²	152.6	74%	0.741	81%	0.813	S	S	*	*			trans	-171	127.8	163.7	-150.3	0	0	0	0	111.1
237	C	33.7	Very low	36.9	Very low	127 Å²	127	156 Å²	156	86%	0.858	83%	0.825	S	S	*	*			trans	63	132.3	167.6	-51.2	0	0	0	0	117.3
238	G	33.3	Very low	36.7	Very low	69 Å²	69	153.8 Å²	153.8	71%	0.711	83%	0.832	S	S	*	*			cis	123	97.2	-9.3	0	0	0	0	0	113.4
239	E	37.4	Very low	36.2	Very low	189 Å²	189	152 Å²	152	88%	0.883	83%	0.833	S	S	*	*			trans	65.1	155.2	173.5	-51	-173.9	138.4	0	0	112.5
240	D	34.5	Very low	36.1	Very low	165 Å²	165	151.5 Å²	151.5	88%	0.882	84%	0.839	S	S	*	*			cis	-124.7	-165.3	24.6	-62.7	-53.8	0	0	0	114.6
241	M	40.6	Very low	35.9	Very low	182 Å²	182	150.7 Å²	150.7	90%	0.897	84%	0.844	S	S	*	*			trans	-132.1	130.3	-169.1	165.6	-175.2	174.4	0	0	111.5
242	E	34	Very low	36.1	Very low	198 Å²	198	153.6 Å²	153.6	93%	0.925	85%	0.845	S	S	*	*			trans	-158.5	168.4	156.6	-89.4	-119.3	124.3	0	0	109.3
243	A	38.9	Very low	36.2	Very low	100 Å²	100	153.6 Å²	153.6	83%	0.826	85%	0.849	S	S	*	*			trans	-137.1	141.9	-168.5	0	0	0	0	0	114.2
244	S	35	Very low	36.5	Very low	121 Å²	121	148.6 Å²	148.6	85%	0.846	84%	0.844	S	S	*	*			trans	-158.2	137	165.9	54.2	0	0	0	0	112
245	D	34.7	Very low	36.7	Very low	164 Å²	164	146.5 Å²	146.5	88%	0.877	84%	0.839	S	S	*	*			trans	-81.1	133	172.6	-55.1	-81.3	0	0	0	111.6
246	V	35.8	Very low	36.9	Very low	144 Å²	144	144.6 Å²	144.6	87%	0.873	84%	0.838	S	S	*	*			trans	-144.7	157.3	154	172.1	0	0	0	0	108.5
247	E	33.2	Very low	37.6	Very low	189 Å²	189	149.4 Å²	149.4	88%	0.883	85%	0.846	S	S	*	*			trans	-67	166.9	-171.3	-53.4	-171.5	137.5	0	0	114.9
248	G	39.6	Very low	38.1	Very low	80 Å²	80	153.9 Å²	153.9	83%	0.825	85%	0.845	S	S	*	*			trans	-94.2	153.6	-166.6	0	0	0	0	0	116.4
249	E	35.9	Very low	38.6	Very low	189 Å²	189	157.5 Å²	157.5	88%	0.883	85%	0.846	S	S	*	*			trans	-124.6	145.1	170.3	-61.5	-173.8	-174.5	0	0	109.6	E251	E249-E251 PolarHBondContact O-N 3.46Å
250	D	36.8	Very low	38.7	Very low	159 Å²	159	153.6 Å²	153.6	85%	0.85	84%	0.836	S	S	*	*			trans	-68.3	117.8	-179.2	-73.8	-59.1	0	0	0	111.3	I252	D250-I252 PolarHBondContact O-N 2.85Å
251	E	35.9	Very low	39.4	Very low	192 Å²	192	152.8 Å²	152.8	90%	0.897	83%	0.829	S	S	*	*			trans	-62.6	103.6	173.6	-86	-156.4	128.9	0	0	111.3	E249 L253	E249-E251 PolarHBondContact O-N 3.46Å; E251-L253 PolarHBondContact O-N 3.48Å
252	I	42.2	Very low	39.6	Very low	157 Å²	157	152.2 Å²	152.2	81%	0.805	83%	0.826	S	S	*	*			trans	-67.6	102.2	174.1	-58.7	175.9	0	0	0	108.9	D250	D250-I252 PolarHBondContact O-N 2.85Å
253	L	39.8	Very low	40.4	Very low	156 Å²	156	152.7 Å²	152.7	82%	0.817	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-50.6	122	171.1	-72.8	172	0	0	0	110	E251	E251-L253 PolarHBondContact O-N 3.48Å
254	P	39	Very low	40.8	Very low	108 Å²	108	151.8 Å²	151.8	70%	0.701	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-66.7	136.5	-176.2	26	-34	0	0	0	110.3	S256	P254-S256 PolarHBondContact O-N 3.28Å
255	P	40.6	Very low	41.7	Very low	120 Å²	120	153.7 Å²	153.7	78%	0.779	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-60.6	140.1	-177.2	24.3	-33.9	0	0	0	111.5	K257	P255-K257 PolarHBondContact O-N 3Å
256	S	40.9	Very low	42.9	Very low	121 Å²	121	153.4 Å²	153.4	85%	0.846	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-46.8	126.4	-178.6	-64.3	0	0	0	0	111.9	P254 R258	P254-S256 PolarHBondContact O-N 3.28Å; S256-R258 PolarHBondContact O-N 3.13Å
257	K	48	Very low	44.8	Very low	208 Å²	208	153.3 Å²	153.3	90%	0.904	80%	0.804	S	S	*	*			trans	-62	110.8	-168.3	-71.6	173.3	-179	168.1	0	111.2	P255 I259	P255-K257 PolarHBondContact O-N 3Å; K257-I259 PolarHBondContact O-N 3.12Å
258	R	45	Very low	47.5	Very low	220 Å²	220	145.6 Å²	145.6	83%	0.83	77%	0.77	S	S	*	*			trans	-49.2	128.1	-178.9	-159.5	179.4	-157.7	152.3	2.6	111.5	S256 T260	S256-R258 PolarHBondContact O-N 3.13Å; R258-T260 VanDerWaalsContact C-N 3.31Å; R258-T260 PolarHBondContact O-N 2.74Å; R258-T260 VanDerWaalsContact O-N 3.07Å
259	I	42	Very low	50	Low	145 Å²	145	145.5 Å²	145.5	74%	0.744	75%	0.745	S	S	*	*			trans	-77.5	89.1	163.3	-56.7	177.9	0	0	0	106.7	K257 M261	K257-I259 PolarHBondContact O-N 3.12Å; I259-M261 HydrophobicContact CG2-CG 4.29Å; I259-M261 HydrophobicContact CG2-SD 3.81Å; I259-M261 PolarHBondContact O-N 2.79Å
260	T	41.1	Very low	52.8	Low	108 Å²	108	137.5 Å²	137.5	66%	0.663	71%	0.707	S	S	*	*			trans	-72.9	96.6	167.5	-54.8	0	0	0	0	107.9	R258 M262	R258-T260 VanDerWaalsContact C-N 3.31Å; R258-T260 PolarHBondContact O-N 2.74Å; R258-T260 VanDerWaalsContact O-N 3.07Å; T260-M262 PolarHBondContact O-N 3.36Å
261	M	48.4	Very low	55.5	Low	148 Å²	148	132.1 Å²	132.1	73%	0.729	68%	0.684	S	S	*	*			trans	-60.4	122.2	171	-64.6	-67.2	-79.8	0	0	108.3	I259	I259-M261 HydrophobicContact CG2-CG 4.29Å; I259-M261 HydrophobicContact CG2-SD 3.81Å; I259-M261 PolarHBondContact O-N 2.79Å
262	M	45	Very low	58.3	Low	169 Å²	169	125.7 Å²	125.7	83%	0.833	66%	0.661	S	S	*	*			trans	-74.9	131.7	176	-73.8	179.4	163	0	0	109.6	T260 S264	T260-M262 PolarHBondContact O-N 3.36Å; M262-S264 VanDerWaalsContact C-N 3.29Å; M262-S264 PolarHBondContact O-N 2.9Å; M262-S264 PolarHBondContact O-OG 3.46Å
263	E	49.8	Very low	60.8	Low	208 Å²	208	121.2 Å²	121.2	97%	0.972	64%	0.637	S	S	*	*			trans	-65.3	86.7	171.5	-68.8	-179.9	114.8	0	0	110.2
264	S	47.8	Very low	63.6	Low	82 Å²	82	114 Å²	114	57%	0.573	60%	0.598	S	S	*	*			trans	-125.6	51.9	-177.1	65.2	0	0	0	0	112.1	M262 M266	M262-S264 VanDerWaalsContact C-N 3.29Å; M262-S264 PolarHBondContact O-N 2.9Å; M262-S264 PolarHBondContact O-OG 3.46Å; S264-M266 VanDerWaalsContact C-N 3.26Å; S264-M266 PolarHBondContact O-N 2.92Å
265	N	54	Low	66.4	Low	161 Å²	161	112.9 Å²	112.9	86%	0.861	59%	0.587	S	S	*	*			trans	50.7	35.9	164.7	-161.1	36.4	0	0	0	115.5	M267	N265-M267 PolarHBondContact O-N 3.33Å
266	M	60.9	Low	69.1	Low	157 Å²	157	111.2 Å²	111.2	77%	0.773	57%	0.568	S	S	*	*			trans	-72.7	115.1	166.7	-78.5	-176.5	59.8	0	0	108.3	S264 S268	S264-M266 VanDerWaalsContact C-N 3.26Å; S264-M266 PolarHBondContact O-N 2.92Å; M266-S268 PolarHBondContact O-N 2.86Å
267	M	74.9	Confident	71.8	Confident	143 Å²	143	109.6 Å²	109.6	70%	0.704	55%	0.55	S	S	*	.			trans	-56	129.3	171.1	-171.6	66.8	66.4	0	0	109	N265 R269	N265-M267 PolarHBondContact O-N 3.33Å; M267-R269 PolarHBondContact O-N 2.83Å
268	S	89.3	Confident	74.1	Confident	27 Å²	27	104.1 Å²	104.1	19%	0.189	53%	0.527	C	S	.	.			trans	-44.7	128.2	177.8	154.8	0	0	0	0	110.9	M266 Y270 A271 S272 E343	M266-S268 PolarHBondContact O-N 2.86Å; S268-Y270 VanDerWaalsContact C-N 3.32Å; S268-Y270 PolarHBondContact OG-N 2.95Å; S268-A271 PolarHBondContact O-N 3.37Å; S268-A271 WeakPolarHBondContact OG-CB 3.35Å; S268-A271 PolarHBondContact OG-N 3.37Å; S268-S272 VanDerWaalsContact O-CB 3.28Å; S268-S272 WeakPolarHBondContact O-CB 3.4Å; S268-S272 PolarHBondContact O-N 3.5Å; S268-S272 PolarHBondContact O-OG 2.89Å; S268-E343 WeakPolarHBondContact CA-OE1 3.25Å; S268-E343 WeakPolarHBondContact CB-OE1 3.36Å; S268-E343 PolarHBondContact OG-OE1 3.36Å
269	R	93.4	Very high	76.5	Confident	78 Å²	78	99.2 Å²	99.2	29%	0.294	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-43.8	177.2	-176.6	-175.1	175.4	-125.5	-22.3	109.5	M267 S272 E273 E343	M267-R269 PolarHBondContact O-N 2.83Å; R269-S272 WeakPolarHBondContact CA-OG 3.39Å; R269-S272 PolarHBondContact O-N 3.06Å; R269-S272 PolarHBondContact O-OG 2.97Å; R269-E273 HydrophobicContact CG-CG 4.33Å; R269-E273 WeakPolarHBondContact CG-OE1 3.44Å; R269-E273 IonicContact CZ-OE1 3.71Å; R269-E273 IonicContact CZ-OE2 3.43Å; R269-E273 IonicContact NE-OE1 2.86Å; R269-E273 PolarHBondContact NE-OE1 3.47Å; R269-E273 IonicContact NE-OE2 2.67Å; R269-E273 IonicContact NH2-OE1 3.38Å; R269-E273 PolarHBondContact NH2-OE1 3.4Å; R269-E273 IonicContact NH2-OE2 3.71Å; R269-E273 PolarHBondContact NH2-OE2 2.9Å; R269-E273 WeakPolarHBondContact O-CB 3.23Å; R269-E273 PolarHBondContact O-N 3.36Å; R269-E343 WeakPolarHBondContact CB-OE2 3.39Å; R269-E343 PolarHBondContact N-OE1 3.35Å
270	Y	94.4	Very high	79	Confident	20 Å²	20	95.8 Å²	95.8	8%	0.078	49%	0.494	C	S	.	.	H	α-helix	trans	-54.2	-54.7	171.2	-178.1	-105.4	0	0	0	111.5	S268 S272 F274 E276 C291 I302 W341 E343 L348	S268-Y270 VanDerWaalsContact C-N 3.32Å; S268-Y270 PolarHBondContact OG-N 2.95Å; Y270-S272 VanDerWaalsContact C-N 3.33Å; Y270-S272 PolarHBondContact O-N 3.05Å; Y270-F274 HydrophobicContact CD2-CD2 4.48Å; Y270-F274 WeakPolarHBondContact O-CA 3.42Å; Y270-F274 WeakPolarHBondContact O-CB 3.45Å; Y270-F274 PolarHBondContact O-N 3.19Å; Y270-E276 WeakPolarHBondContact CE1-OE2 3.43Å; Y270-E276 PolarHBondContact OH-OE2 2.96Å; Y270-C291 PolarHBondContact OH-SG 3.5Å; Y270-I302 HydrophobicContact CD2-CD1 4.2Å; Y270-I302 HydrophobicContact CD2-CG2 4.23Å; Y270-I302 HydrophobicContact CE2-CB 4.21Å; Y270-I302 HydrophobicContact CE2-CD1 3.85Å; Y270-I302 HydrophobicContact CE2-CG2 3.87Å; Y270-W341 HydrophobicContact CD2-CZ2 4.43Å; Y270-E343 PolarHBondContact N-OE1 2.92Å; Y270-E343 PolarHBondContact N-OE2 3.46Å; Y270-L348 HydrophobicContact CD2-CD2 3.56Å; Y270-L348 HydrophobicContact CE2-CD2 4.32Å; Y270-L348 HydrophobicContact CG-CD2 3.87Å
271	A	93.6	Very high	81.3	Confident	46 Å²	46	92 Å²	92	38%	0.38	48%	0.476	S	S	.	.	H	α-helix	trans	-66.6	-30	-177.2	0	0	0	0	0	113.8	S268 R294	S268-A271 PolarHBondContact O-N 3.37Å; S268-A271 WeakPolarHBondContact OG-CB 3.35Å; S268-A271 PolarHBondContact OG-N 3.37Å; A271-R294 PolarHBondContact O-NH1 2.97Å; A271-R294 PolarHBondContact O-NH2 2.99Å
272	S	94.2	Very high	83.2	Confident	58 Å²	58	88.5 Å²	88.5	41%	0.406	47%	0.466	S	S	.	.	H	α-helix	trans	-87.1	-40.8	-178.7	57.3	0	0	0	0	113.9	S268 R269 Y270 R294	S268-S272 VanDerWaalsContact O-CB 3.28Å; S268-S272 WeakPolarHBondContact O-CB 3.4Å; S268-S272 PolarHBondContact O-N 3.5Å; S268-S272 PolarHBondContact O-OG 2.89Å; R269-S272 WeakPolarHBondContact CA-OG 3.39Å; R269-S272 PolarHBondContact O-N 3.06Å; R269-S272 PolarHBondContact O-OG 2.97Å; Y270-S272 VanDerWaalsContact C-N 3.33Å; Y270-S272 PolarHBondContact O-N 3.05Å; S272-R294 PolarHBondContact O-NH1 3.38Å
273	E	95.8	Very high	84.8	Confident	62 Å²	62	82.5 Å²	82.5	29%	0.29	45%	0.448	S	S	.	.	H	α-helix	trans	-82.3	-29.3	177.1	-74	-176.1	-146.7	0	0	113.3	R269 K293 R294	R269-E273 HydrophobicContact CG-CG 4.33Å; R269-E273 WeakPolarHBondContact CG-OE1 3.44Å; R269-E273 IonicContact CZ-OE1 3.71Å; R269-E273 IonicContact CZ-OE2 3.43Å; R269-E273 IonicContact NE-OE1 2.86Å; R269-E273 PolarHBondContact NE-OE1 3.47Å; R269-E273 IonicContact NE-OE2 2.67Å; R269-E273 IonicContact NH2-OE1 3.38Å; R269-E273 PolarHBondContact NH2-OE1 3.4Å; R269-E273 IonicContact NH2-OE2 3.71Å; R269-E273 PolarHBondContact NH2-OE2 2.9Å; R269-E273 WeakPolarHBondContact O-CB 3.23Å; R269-E273 PolarHBondContact O-N 3.36Å; E273-K293 CarbonylContact O-C 3.52Å; E273-K293 WeakPolarHBondContact O-CA 3.42Å; E273-R294 PolarHBondContact O-N 3.13Å
274	F	97.5	Very high	85.9	Confident	4 Å²	4	80 Å²	80	2%	0.018	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.5	-170.4	-56	-89.2	0	0	0	114.1	Y270 C291 V292 K293 R294 Y300 I302 W341 Q350	Y270-F274 HydrophobicContact CD2-CD2 4.48Å; Y270-F274 WeakPolarHBondContact O-CA 3.42Å; Y270-F274 WeakPolarHBondContact O-CB 3.45Å; Y270-F274 PolarHBondContact O-N 3.19Å; F274-C291 HydrophobicContact CB-CB 4.07Å; F274-C291 HydrophobicContact CD1-CB 4.37Å; F274-V292 WeakPolarHBondContact CA-O 3.48Å; F274-K293 HydrophobicContact CD1-CB 3.71Å; F274-K293 HydrophobicContact CD1-CG 4.05Å; F274-K293 HydrophobicContact CE1-CB 3.61Å; F274-K293 HydrophobicContact CE1-CD 3.74Å; F274-K293 HydrophobicContact CE1-CG 3.68Å; F274-K293 HydrophobicContact CZ-CD 4.02Å; F274-K293 HydrophobicContact CZ-CG 4.2Å; F274-R294 VanDerWaalsContact N-NH1 3.2Å; F274-R294 VanDerWaalsContact O-CZ 3.28Å; F274-R294 PolarHBondContact O-NH1 3.46Å; F274-R294 PolarHBondContact O-NH2 3Å; F274-Y300 HydrophobicContact CE1-CD2 4.35Å; F274-I302 HydrophobicContact CB-CD1 4.21Å; F274-I302 HydrophobicContact CD1-CD1 3.46Å; F274-I302 VanDerWaalsContact CD1-CD1 3.46Å; F274-I302 HydrophobicContact CD2-CD1 4Å; F274-I302 HydrophobicContact CE1-CD1 3.67Å; F274-I302 HydrophobicContact CE2-CD1 4.22Å; F274-I302 HydrophobicContact CG-CD1 3.61Å; F274-I302 HydrophobicContact CZ-CD1 4.06Å; F274-W341 HydrophobicContact CD2-CH2 4.22Å; F274-W341 HydrophobicContact CD2-CZ2 4.43Å; F274-W341 AromaticContact CE2-CH2 3.48Å; F274-W341 HydrophobicContact CE2-CH2 3.48Å; F274-W341 VanDerWaalsContact CE2-CH2 3.48Å; F274-W341 AromaticContact CE2-CZ2 3.97Å; F274-W341 HydrophobicContact CE2-CZ2 3.97Å; F274-W341 HydrophobicContact CE2-CZ3 4.37Å; F274-W341 AromaticContact CZ-CH2 3.98Å; F274-W341 HydrophobicContact CZ-CH2 3.98Å; F274-Q350 HydrophobicContact CE1-CG 4.33Å; F274-Q350 HydrophobicContact CZ-CG 4.35Å
275	L	97.4	Very high	87.2	Confident	86 Å²	86	79 Å²	79	45%	0.45	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	109.3	165.8	175	64.6	0	0	0	108.4	L277 C291 V292	L275-L277 HydrophobicContact CD2-CD2 4.26Å; L275-L277 HydrophobicContact CG-CD2 4.28Å; L275-C291 CarbonylContact O-C 3.54Å; L275-C291 WeakPolarHBondContact O-CA 3.45Å; L275-C291 WeakPolarHBondContact O-CB 3.34Å; L275-V292 HydrophobicContact CB-CB 4.45Å; L275-V292 PolarHBondContact N-O 3.29Å; L275-V292 PolarHBondContact O-N 2.91Å
276	E	97.3	Very high	88.8	Confident	85 Å²	85	71.7 Å²	71.7	40%	0.397	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	129.7	171.2	-170.4	172	126.6	0	0	110	Y270 F289	Y270-E276 WeakPolarHBondContact CE1-OE2 3.43Å; Y270-E276 PolarHBondContact OH-OE2 2.96Å; E276-F289 HydrophobicContact CG-CB 4.17Å; E276-F289 HydrophobicContact CG-CD1 3.82Å; E276-F289 HydrophobicContact CG-CG 4.29Å; E276-F289 WeakPolarHBondContact OE1-CD1 3.35Å; E276-F289 VanDerWaalsContact OE1-CE1 3.23Å; E276-F289 WeakPolarHBondContact OE1-CE1 3.49Å
277	L	97.1	Very high	90.3	Very high	87 Å²	87	65 Å²	65	46%	0.455	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-53.4	176.9	-60.6	-175.5	0	0	0	111.7	L275 K290 V292	L275-L277 HydrophobicContact CD2-CD2 4.26Å; L275-L277 HydrophobicContact CG-CD2 4.28Å; L277-K290 WeakPolarHBondContact CB-O 3.42Å; L277-K290 HydrophobicContact CD1-CD 4.3Å; L277-K290 HydrophobicContact CD1-CG 4.4Å; L277-K290 PolarHBondContact N-O 2.89Å; L277-V292 HydrophobicContact CD1-CG2 3.76Å; L277-V292 HydrophobicContact CD2-CG2 4.08Å; L277-V292 HydrophobicContact CG-CG2 4.03Å
278	E	96.6	Very high	91.3	Very high	92 Å²	92	60.1 Å²	60.1	43%	0.43	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	149.1	-175.2	58.7	-177.4	157.6	0	0	111	I280 F289 K290	E278-I280 HydrophobicContact CG-CG2 3.89Å; E278-I280 PolarHBondContact O-N 3.48Å; E278-F289 WeakPolarHBondContact O-CA 3.35Å; E278-K290 HydrophobicContact CG-CB 3.89Å; E278-K290 HydrophobicContact CG-CD 3.69Å; E278-K290 HydrophobicContact CG-CG 4.45Å; E278-K290 PolarHBondContact N-O 2.94Å; E278-K290 PolarHBondContact O-N 2.91Å; E278-K290 WeakPolarHBondContact OE1-CD 3.39Å; E278-K290 WeakPolarHBondContact OE1-CE 3.4Å; E278-K290 IonicContact OE1-NZ 2.65Å; E278-K290 PolarHBondContact OE1-NZ 3Å
279	K	96.1	Very high	91.6	Very high	117 Å²	117	59.6 Å²	59.6	51%	0.509	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	105.2	172.8	-177.2	-169.7	166.8	-162.8	0	109.2	G281 S282 V288 F289	K279-G281 WeakPolarHBondContact CE-O 3.47Å; K279-S282 VanDerWaalsContact CE-CB 3.43Å; K279-S282 WeakPolarHBondContact CE-OG 3.45Å; K279-S282 PolarHBondContact NZ-OG 3.3Å; K279-V288 CarbonylContact C-O 3.49Å; K279-F289 HydrophobicContact CB-CD1 3.77Å; K279-F289 HydrophobicContact CB-CE1 3.75Å; K279-F289 HydrophobicContact CD-CE1 4.25Å; K279-F289 HydrophobicContact CG-CD1 4.05Å; K279-F289 HydrophobicContact CG-CE1 3.8Å; K279-F289 HydrophobicContact CG-CZ 4.3Å
280	I	94.3	Very high	91.9	Very high	74 Å²	74	57.4 Å²	57.4	38%	0.379	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-11.7	-177.2	61.1	174.8	0	0	0	114	E278 V288 K290 A301 Y353	E278-I280 HydrophobicContact CG-CG2 3.89Å; E278-I280 PolarHBondContact O-N 3.48Å; I280-V288 HydrophobicContact CD1-CG1 3.92Å; I280-V288 HydrophobicContact CG1-CB 4.11Å; I280-V288 HydrophobicContact CG1-CG1 3.84Å; I280-V288 WeakPolarHBondContact CG1-O 3.49Å; I280-V288 PolarHBondContact N-O 3.02Å; I280-K290 HydrophobicContact CD1-CB 4.42Å; I280-K290 HydrophobicContact CG2-CB 3.72Å; I280-A301 HydrophobicContact CD1-CB 4.17Å; I280-Y353 HydrophobicContact CD1-CD2 4.14Å; I280-Y353 HydrophobicContact CD1-CE2 4.04Å; I280-Y353 HydrophobicContact CG2-CE2 4.42Å
281	G	89.3	Confident	92	Very high	27 Å²	27	56.5 Å²	56.5	28%	0.278	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	164.5	175.2	0	0	0	0	0	115	K279 A287 V288	K279-G281 WeakPolarHBondContact CE-O 3.47Å; G281-A287 WeakPolarHBondContact O-CA 3.39Å; G281-V288 PolarHBondContact N-O 2.8Å; G281-V288 VanDerWaalsContact N-O 3.09Å; G281-V288 PolarHBondContact O-N 3.26Å
282	S	88.6	Confident	92.2	Very high	75 Å²	75	55.9 Å²	55.9	52%	0.524	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	132.8	159.9	48.3	0	0	0	0	110.8	K279 G286	K279-S282 VanDerWaalsContact CE-CB 3.43Å; K279-S282 WeakPolarHBondContact CE-OG 3.45Å; K279-S282 PolarHBondContact NZ-OG 3.3Å; S282-G286 VanDerWaalsContact CA-O 3.32Å; S282-G286 WeakPolarHBondContact CA-O 3.47Å; S282-G286 WeakPolarHBondContact CB-O 3.43Å
283	G	78.2	Confident	92.4	Very high	44 Å²	44	54.8 Å²	54.8	45%	0.454	30%	0.295	S	S	.	.			trans	-129.1	-155.3	176.5	0	0	0	0	0	110.4	G286 K306	G283-G286 PolarHBondContact N-O 3.31Å; G283-G286 VanDerWaalsContact N-O 3.12Å; G283-K306 PolarHBondContact O-NZ 3.22Å
284	E	72.5	Confident	92.5	Very high	155 Å²	155	58 Å²	58	72%	0.724	31%	0.305	S	S	*	.	S	Bend	trans	-60.4	-54.7	175.4	-173.9	147.4	-146.3	0	0	111.6	G286 K306	E284-G286 PolarHBondContact O-N 2.95Å; E284-G286 VanDerWaalsContact O-N 3.08Å; E284-K306 WeakPolarHBondContact O-CD 3.33Å
285	F	76.8	Confident	92.4	Very high	62 Å²	62	65.1 Å²	65.1	27%	0.272	34%	0.342	S	S	.	.	S	Bend	trans	-63.1	-14.6	-175.3	-48.4	-61.1	0	0	0	116.2	S305	F285-S305 WeakPolarHBondContact O-CA 3.28Å
286	G	86.9	Confident	92.3	Very high	6 Å²	6	64.1 Å²	64.1	6%	0.062	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.9	-151.3	-176.8	0	0	0	0	0	116.2	S282 G283 E284 R304	S282-G286 VanDerWaalsContact CA-O 3.32Å; S282-G286 WeakPolarHBondContact CA-O 3.47Å; S282-G286 WeakPolarHBondContact CB-O 3.43Å; G283-G286 PolarHBondContact N-O 3.31Å; G283-G286 VanDerWaalsContact N-O 3.12Å; E284-G286 PolarHBondContact O-N 2.95Å; E284-G286 VanDerWaalsContact O-N 3.08Å; G286-R304 VanDerWaalsContact CA-O 3.26Å; G286-R304 WeakPolarHBondContact CA-O 3.49Å
287	A	92.5	Very high	92.3	Very high	16 Å²	16	62.5 Å²	62.5	13%	0.132	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.4	170.8	0	0	0	0	0	110.3	G281 F289 R304	G281-A287 WeakPolarHBondContact O-CA 3.39Å; A287-F289 HydrophobicContact CB-CD2 4.43Å; A287-F289 HydrophobicContact CB-CE2 3.57Å; A287-F289 HydrophobicContact CB-CZ 3.84Å; A287-R304 PolarHBondContact N-O 2.65Å; A287-R304 PolarHBondContact O-N 3.49Å
288	V	95.3	Very high	92.2	Very high	42 Å²	42	61.4 Å²	61.4	26%	0.255	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129	178.3	-169.5	0	0	0	0	109	K279 I280 G281 A301 I302 K303	K279-V288 CarbonylContact C-O 3.49Å; I280-V288 HydrophobicContact CD1-CG1 3.92Å; I280-V288 HydrophobicContact CG1-CB 4.11Å; I280-V288 HydrophobicContact CG1-CG1 3.84Å; I280-V288 WeakPolarHBondContact CG1-O 3.49Å; I280-V288 PolarHBondContact N-O 3.02Å; G281-V288 PolarHBondContact N-O 2.8Å; G281-V288 VanDerWaalsContact N-O 3.09Å; G281-V288 PolarHBondContact O-N 3.26Å; V288-A301 HydrophobicContact CG1-CB 4.22Å; V288-I302 WeakPolarHBondContact CA-O 3.49Å; V288-K303 HydrophobicContact CG2-CB 4.17Å; V288-K303 HydrophobicContact CG2-CG 4.2Å
289	F	96.9	Very high	92.3	Very high	15 Å²	15	60.6 Å²	60.6	7%	0.066	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.6	-177.9	-59.7	-91.3	0	0	0	110.4	E276 E278 K279 A287 A301 I302	E276-F289 HydrophobicContact CG-CB 4.17Å; E276-F289 HydrophobicContact CG-CD1 3.82Å; E276-F289 HydrophobicContact CG-CG 4.29Å; E276-F289 WeakPolarHBondContact OE1-CD1 3.35Å; E276-F289 VanDerWaalsContact OE1-CE1 3.23Å; E276-F289 WeakPolarHBondContact OE1-CE1 3.49Å; E278-F289 WeakPolarHBondContact O-CA 3.35Å; K279-F289 HydrophobicContact CB-CD1 3.77Å; K279-F289 HydrophobicContact CB-CE1 3.75Å; K279-F289 HydrophobicContact CD-CE1 4.25Å; K279-F289 HydrophobicContact CG-CD1 4.05Å; K279-F289 HydrophobicContact CG-CE1 3.8Å; K279-F289 HydrophobicContact CG-CZ 4.3Å; A287-F289 HydrophobicContact CB-CD2 4.43Å; A287-F289 HydrophobicContact CB-CE2 3.57Å; A287-F289 HydrophobicContact CB-CZ 3.84Å; F289-A301 CarbonylContact O-C 3.57Å; F289-A301 WeakPolarHBondContact O-CA 3.34Å; F289-I302 PolarHBondContact N-O 3.39Å; F289-I302 PolarHBondContact O-N 3.33Å
290	K	97.8	Very high	92.4	Very high	33 Å²	33	55.8 Å²	55.8	14%	0.143	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120	168.7	176.8	-166.3	-171.3	175.6	0	107.6	L277 E278 I280 I299 Y300 Y353	L277-K290 WeakPolarHBondContact CB-O 3.42Å; L277-K290 HydrophobicContact CD1-CD 4.3Å; L277-K290 HydrophobicContact CD1-CG 4.4Å; L277-K290 PolarHBondContact N-O 2.89Å; E278-K290 HydrophobicContact CG-CB 3.89Å; E278-K290 HydrophobicContact CG-CD 3.69Å; E278-K290 HydrophobicContact CG-CG 4.45Å; E278-K290 PolarHBondContact N-O 2.94Å; E278-K290 PolarHBondContact O-N 2.91Å; E278-K290 WeakPolarHBondContact OE1-CD 3.39Å; E278-K290 WeakPolarHBondContact OE1-CE 3.4Å; E278-K290 IonicContact OE1-NZ 2.65Å; E278-K290 PolarHBondContact OE1-NZ 3Å; I280-K290 HydrophobicContact CD1-CB 4.42Å; I280-K290 HydrophobicContact CG2-CB 3.72Å; K290-I299 HydrophobicContact CD-CG2 4.27Å; K290-I299 HydrophobicContact CG-CG2 3.49Å; K290-I299 VanDerWaalsContact CG-CG2 3.49Å; K290-Y300 WeakPolarHBondContact CA-O 3.44Å; K290-Y353 HydrophobicContact CB-CD2 4.29Å; K290-Y353 HydrophobicContact CB-CE2 4.12Å; K290-Y353 HydrophobicContact CD-CD2 4.37Å; K290-Y353 HydrophobicContact CD-CE1 4.2Å; K290-Y353 HydrophobicContact CD-CE2 3.77Å; K290-Y353 WeakPolarHBondContact CE-OH 3.34Å; K290-Y353 HydrophobicContact CG-CD2 3.87Å; K290-Y353 HydrophobicContact CG-CE1 4.49Å; K290-Y353 HydrophobicContact CG-CE2 3.74Å; K290-Y353 HydrophobicContact CG-CG 4.31Å; K290-Y353 PolarHBondContact NZ-OH 3.44Å
291	C	98.1	Very high	92.5	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.9	-173.5	-51.1	0	0	0	0	111.4	Y270 F274 L275 I299 Y300 I302	Y270-C291 PolarHBondContact OH-SG 3.5Å; F274-C291 HydrophobicContact CB-CB 4.07Å; F274-C291 HydrophobicContact CD1-CB 4.37Å; L275-C291 CarbonylContact O-C 3.54Å; L275-C291 WeakPolarHBondContact O-CA 3.45Å; L275-C291 WeakPolarHBondContact O-CB 3.34Å; C291-I299 WeakPolarHBondContact O-CA 3.27Å; C291-Y300 PolarHBondContact N-O 2.99Å; C291-Y300 PolarHBondContact O-N 2.67Å; C291-I302 HydrophobicContact CB-CD1 3.91Å; C291-I302 HydrophobicContact CB-CG1 4.48Å
292	V	98.1	Very high	92.9	Very high	33 Å²	33	51.7 Å²	51.7	20%	0.2	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	126.2	167.7	-178.5	0	0	0	0	108.4	F274 L275 L277 C298 I299	F274-V292 WeakPolarHBondContact CA-O 3.48Å; L275-V292 HydrophobicContact CB-CB 4.45Å; L275-V292 PolarHBondContact N-O 3.29Å; L275-V292 PolarHBondContact O-N 2.91Å; L277-V292 HydrophobicContact CD1-CG2 3.76Å; L277-V292 HydrophobicContact CD2-CG2 4.08Å; L277-V292 HydrophobicContact CG-CG2 4.03Å; V292-C298 WeakPolarHBondContact CA-O 3.42Å; V292-I299 HydrophobicContact CG2-CG1 4.46Å
293	K	97.6	Very high	93.1	Very high	36 Å²	36	49.8 Å²	49.8	16%	0.157	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	122.9	172.1	-175.9	173.3	163.4	-132	0	109.4	E273 F274 L295 D296 G297 C298 Y300	E273-K293 CarbonylContact O-C 3.52Å; E273-K293 WeakPolarHBondContact O-CA 3.42Å; F274-K293 HydrophobicContact CD1-CB 3.71Å; F274-K293 HydrophobicContact CD1-CG 4.05Å; F274-K293 HydrophobicContact CE1-CB 3.61Å; F274-K293 HydrophobicContact CE1-CD 3.74Å; F274-K293 HydrophobicContact CE1-CG 3.68Å; F274-K293 HydrophobicContact CZ-CD 4.02Å; F274-K293 HydrophobicContact CZ-CG 4.2Å; K293-L295 PolarHBondContact O-N 2.88Å; K293-D296 WeakPolarHBondContact CB-OD1 3.48Å; K293-D296 WeakPolarHBondContact CD-OD2 3.25Å; K293-D296 WeakPolarHBondContact CE-OD2 3.34Å; K293-D296 IonicContact NZ-OD2 2.67Å; K293-D296 PolarHBondContact NZ-OD2 3.33Å; K293-D296 PolarHBondContact O-N 3.34Å; K293-G297 WeakPolarHBondContact O-CA 3.31Å; K293-G297 PolarHBondContact O-N 3.49Å; K293-C298 PolarHBondContact N-O 2.9Å; K293-Y300 HydrophobicContact CB-CD2 3.74Å; K293-Y300 HydrophobicContact CB-CE2 3.56Å; K293-Y300 HydrophobicContact CD-CE2 4Å; K293-Y300 HydrophobicContact CG-CE2 4.44Å
294	R	96.9	Very high	93.8	Very high	130 Å²	130	51.5 Å²	51.5	49%	0.491	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-23.2	-170.2	-64.7	-168.2	-175.7	80.7	5.6	114.3	A271 S272 E273 F274	A271-R294 PolarHBondContact O-NH1 2.97Å; A271-R294 PolarHBondContact O-NH2 2.99Å; S272-R294 PolarHBondContact O-NH1 3.38Å; E273-R294 PolarHBondContact O-N 3.13Å; F274-R294 VanDerWaalsContact N-NH1 3.2Å; F274-R294 VanDerWaalsContact O-CZ 3.28Å; F274-R294 PolarHBondContact O-NH1 3.46Å; F274-R294 PolarHBondContact O-NH2 3Å
295	L	96.1	Very high	94.5	Very high	153 Å²	153	45.4 Å²	45.4	80%	0.801	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-33	-177	-176.1	63	0	0	0	113.8	K293	K293-L295 PolarHBondContact O-N 2.88Å
296	D	96.2	Very high	94.4	Very high	65 Å²	65	48.3 Å²	48.3	35%	0.348	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-2.6	-172.9	51.2	46.4	0	0	0	113.7	K293 C298	K293-D296 WeakPolarHBondContact CB-OD1 3.48Å; K293-D296 WeakPolarHBondContact CD-OD2 3.25Å; K293-D296 WeakPolarHBondContact CE-OD2 3.34Å; K293-D296 IonicContact NZ-OD2 2.67Å; K293-D296 PolarHBondContact NZ-OD2 3.33Å; K293-D296 PolarHBondContact O-N 3.34Å; D296-C298 PolarHBondContact O-N 3.1Å; D296-C298 VanDerWaalsContact O-N 3.1Å; D296-C298 WeakPolarHBondContact OD1-CB 3.49Å; D296-C298 PolarHBondContact OD1-N 3.18Å; D296-C298 VanDerWaalsContact OD1-N 3.08Å
297	G	95.8	Very high	93.5	Very high	51 Å²	51	54.7 Å²	54.7	53%	0.526	28%	0.281	S	S	.	.			trans	67.9	4.7	178.2	0	0	0	0	0	114.4	K293	K293-G297 WeakPolarHBondContact O-CA 3.31Å; K293-G297 PolarHBondContact O-N 3.49Å
298	C	96.8	Very high	91.8	Very high	63 Å²	63	57 Å²	57	43%	0.426	30%	0.295	S	S	.	.			trans	-83.9	151.3	-174.7	-72.9	0	0	0	0	112	V292 K293 D296 Y300	V292-C298 WeakPolarHBondContact CA-O 3.42Å; K293-C298 PolarHBondContact N-O 2.9Å; D296-C298 PolarHBondContact O-N 3.1Å; D296-C298 VanDerWaalsContact O-N 3.1Å; D296-C298 WeakPolarHBondContact OD1-CB 3.49Å; D296-C298 PolarHBondContact OD1-N 3.18Å; D296-C298 VanDerWaalsContact OD1-N 3.08Å; C298-Y300 HydrophobicContact CB-CE2 3.62Å; C298-Y300 VanDerWaalsContact O-CD2 3.25Å; C298-Y300 WeakPolarHBondContact O-CD2 3.5Å; C298-Y300 WeakPolarHBondContact O-CE2 3.43Å
299	I	97.6	Very high	89.9	Confident	75 Å²	75	58.7 Å²	58.7	39%	0.385	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.3	-178.7	-49.2	-179.9	0	0	0	109.6	K290 C291 V292 Y353	K290-I299 HydrophobicContact CD-CG2 4.27Å; K290-I299 HydrophobicContact CG-CG2 3.49Å; K290-I299 VanDerWaalsContact CG-CG2 3.49Å; C291-I299 WeakPolarHBondContact O-CA 3.27Å; V292-I299 HydrophobicContact CG2-CG1 4.46Å; I299-Y353 HydrophobicContact CB-CD1 4.23Å; I299-Y353 HydrophobicContact CB-CG 4.46Å; I299-Y353 HydrophobicContact CG2-CD1 3.63Å; I299-Y353 HydrophobicContact CG2-CD2 4.4Å; I299-Y353 HydrophobicContact CG2-CE1 4.32Å; I299-Y353 HydrophobicContact CG2-CG 3.66Å; I299-Y353 WeakPolarHBondContact O-CB 3.39Å
300	Y	97.9	Very high	87.9	Confident	17 Å²	17	62.6 Å²	62.6	7%	0.067	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.7	-179.5	-64.1	-84.3	0	0	0	111.1	F274 K290 C291 K293 C298 Y338 Q350	F274-Y300 HydrophobicContact CE1-CD2 4.35Å; K290-Y300 WeakPolarHBondContact CA-O 3.44Å; C291-Y300 PolarHBondContact N-O 2.99Å; C291-Y300 PolarHBondContact O-N 2.67Å; K293-Y300 HydrophobicContact CB-CD2 3.74Å; K293-Y300 HydrophobicContact CB-CE2 3.56Å; K293-Y300 HydrophobicContact CD-CE2 4Å; K293-Y300 HydrophobicContact CG-CE2 4.44Å; C298-Y300 HydrophobicContact CB-CE2 3.62Å; C298-Y300 VanDerWaalsContact O-CD2 3.25Å; C298-Y300 WeakPolarHBondContact O-CD2 3.5Å; C298-Y300 WeakPolarHBondContact O-CE2 3.43Å; Y300-Y338 AromaticContact CD1-CD2 3.81Å; Y300-Y338 HydrophobicContact CD1-CD2 3.81Å; Y300-Y338 AromaticContact CD1-CE2 3.97Å; Y300-Y338 HydrophobicContact CD1-CE2 3.97Å; Y300-Y338 HydrophobicContact CD1-CG 4.27Å; Y300-Y338 AromaticContact CE1-CD1 3.91Å; Y300-Y338 HydrophobicContact CE1-CD1 3.91Å; Y300-Y338 AromaticContact CE1-CD2 3.58Å; Y300-Y338 HydrophobicContact CE1-CD2 3.58Å; Y300-Y338 AromaticContact CE1-CE1 3.92Å; Y300-Y338 HydrophobicContact CE1-CE1 3.92Å; Y300-Y338 AromaticContact CE1-CE2 3.58Å; Y300-Y338 HydrophobicContact CE1-CE2 3.58Å; Y300-Y338 AromaticContact CE1-CG 3.73Å; Y300-Y338 HydrophobicContact CE1-CG 3.73Å; Y300-Y338 AromaticContact CE1-CZ 3.76Å; Y300-Q350 HydrophobicContact CD1-CG 3.77Å; Y300-Q350 HydrophobicContact CG-CG 3.95Å
301	A	97.6	Very high	86.3	Confident	15 Å²	15	64.7 Å²	64.7	12%	0.124	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.6	164.7	0	0	0	0	0	108.3	I280 V288 F289 N351	I280-A301 HydrophobicContact CD1-CB 4.17Å; V288-A301 HydrophobicContact CG1-CB 4.22Å; F289-A301 CarbonylContact O-C 3.57Å; F289-A301 WeakPolarHBondContact O-CA 3.34Å; A301-N351 PolarHBondContact N-O 2.94Å; A301-N351 PolarHBondContact O-N 3.21Å
302	I	96.3	Very high	85.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	110.7	179.6	-57.2	179.4	0	0	0	109.1	Y270 F274 V288 F289 C291 L348 I349 Q350	Y270-I302 HydrophobicContact CD2-CD1 4.2Å; Y270-I302 HydrophobicContact CD2-CG2 4.23Å; Y270-I302 HydrophobicContact CE2-CB 4.21Å; Y270-I302 HydrophobicContact CE2-CD1 3.85Å; Y270-I302 HydrophobicContact CE2-CG2 3.87Å; F274-I302 HydrophobicContact CB-CD1 4.21Å; F274-I302 HydrophobicContact CD1-CD1 3.46Å; F274-I302 VanDerWaalsContact CD1-CD1 3.46Å; F274-I302 HydrophobicContact CD2-CD1 4Å; F274-I302 HydrophobicContact CE1-CD1 3.67Å; F274-I302 HydrophobicContact CE2-CD1 4.22Å; F274-I302 HydrophobicContact CG-CD1 3.61Å; F274-I302 HydrophobicContact CZ-CD1 4.06Å; V288-I302 WeakPolarHBondContact CA-O 3.49Å; F289-I302 PolarHBondContact N-O 3.39Å; F289-I302 PolarHBondContact O-N 3.33Å; C291-I302 HydrophobicContact CB-CD1 3.91Å; C291-I302 HydrophobicContact CB-CG1 4.48Å; I302-L348 HydrophobicContact CG2-CB 4.39Å; I302-L348 HydrophobicContact CG2-CD2 4.25Å; I302-I349 CarbonylContact C-O 3.53Å; I302-I349 WeakPolarHBondContact CA-O 3.37Å; I302-Q350 HydrophobicContact CG1-CB 4.38Å; I302-Q350 HydrophobicContact CG1-CG 4.33Å
303	K	93.6	Very high	83.8	Confident	34 Å²	34	68.3 Å²	68.3	15%	0.148	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	111.8	173.4	-178.5	179.1	-179.1	-174.7	0	107.5	V288 E321 L348 I349 D436	V288-K303 HydrophobicContact CG2-CB 4.17Å; V288-K303 HydrophobicContact CG2-CG 4.2Å; K303-E321 IonicContact NZ-OE1 2.64Å; K303-E321 IonicContact NZ-OE2 3.33Å; K303-E321 PolarHBondContact NZ-OE2 3.05Å; K303-L348 CarbonylContact O-C 3.6Å; K303-L348 WeakPolarHBondContact O-CA 3.48Å; K303-I349 HydrophobicContact CB-CB 4.41Å; K303-I349 PolarHBondContact N-O 3.24Å; K303-I349 PolarHBondContact O-N 2.86Å; K303-D436 IonicContact NZ-OD1 2.68Å; K303-D436 PolarHBondContact NZ-OD1 3.36Å
304	R	91.6	Very high	82.6	Confident	81 Å²	81	70 Å²	70	31%	0.306	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.1	172.8	-175.1	171.4	79.5	-138.3	4.7	108.8	G286 A287 H346 M347 L348	G286-R304 VanDerWaalsContact CA-O 3.26Å; G286-R304 WeakPolarHBondContact CA-O 3.49Å; A287-R304 PolarHBondContact N-O 2.65Å; A287-R304 PolarHBondContact O-N 3.49Å; R304-H346 HydrophobicContact CG-CB 4.03Å; R304-M347 CarbonylContact C-O 3.4Å; R304-M347 WeakPolarHBondContact CA-O 3.44Å; R304-L348 HydrophobicContact CB-CG 4.31Å; R304-L348 HydrophobicContact CG-CD1 4.49Å; R304-L348 HydrophobicContact CG-CD2 4.38Å; R304-L348 HydrophobicContact CG-CG 4.05Å
305	S	87.7	Confident	81.6	Confident	26 Å²	26	67.1 Å²	67.1	18%	0.182	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	172.2	177.4	76.8	0	0	0	0	111.9	F285 K307 H346 M347	F285-S305 WeakPolarHBondContact O-CA 3.28Å; S305-K307 PolarHBondContact OG-O 2.68Å; S305-H346 PolarHBondContact O-CD2 2.81Å; S305-H346 WeakPolarHBondContact OG-CA 3.35Å; S305-M347 PolarHBondContact N-O 3.29Å; S305-M347 PolarHBondContact OG-N 2.65Å
306	K	74.3	Confident	80.8	Confident	123 Å²	123	64.4 Å²	64.4	54%	0.535	38%	0.377	S	S	.	.	S	Bend	trans	-100.4	-15.5	-172.7	-121.9	164.8	172.6	-176.7	0	115.3	G283 E284	G283-K306 PolarHBondContact O-NZ 3.22Å; E284-K306 WeakPolarHBondContact O-CD 3.33Å
307	K	68.2	Low	80	Confident	140 Å²	140	61.7 Å²	61.7	61%	0.609	36%	0.362	S	S	*	.	S	Bend	trans	-158.9	157.3	-175.4	-65	179.6	-175.9	168.5	0	110.7	S305 L309 D345	S305-K307 PolarHBondContact OG-O 2.68Å; K307-L309 HydrophobicContact CB-CD1 3.55Å; K307-L309 HydrophobicContact CD-CD1 3.65Å; K307-L309 HydrophobicContact CG-CD1 4.27Å; K307-D345 CarbonylContact C-O 3.48Å
308	P	56.8	Low	79.3	Confident	65 Å²	65	59.9 Å²	59.9	42%	0.422	34%	0.342	S	S	.	.			trans	-72.7	126.3	152.2	25.8	-30.2	0	0	0	111.4	D345	P308-D345 WeakPolarHBondContact CA-O 3.27Å; P308-D345 HydrophobicContact CB-CB 3.58Å; P308-D345 VanDerWaalsContact CB-CG 3.42Å; P308-D345 WeakPolarHBondContact CB-O 3.43Å; P308-D345 WeakPolarHBondContact CB-OD2 3.45Å; P308-D345 WeakPolarHBondContact CD-O 3.38Å; P308-D345 HydrophobicContact CG-CB 3.74Å; P308-D345 WeakPolarHBondContact CG-OD2 3.36Å
309	L	55.8	Low	78.7	Confident	78 Å²	78	60.7 Å²	60.7	41%	0.408	34%	0.342	S	S	.	.			trans	-150.1	98.8	156.8	-73.1	97.6	0	0	0	110.6	K307 G311 S312 E315	K307-L309 HydrophobicContact CB-CD1 3.55Å; K307-L309 HydrophobicContact CD-CD1 3.65Å; K307-L309 HydrophobicContact CG-CD1 4.27Å; L309-G311 PolarHBondContact O-N 2.86Å; L309-S312 VanDerWaalsContact CB-CB 3.41Å; L309-S312 VanDerWaalsContact CB-OG 3.29Å; L309-S312 WeakPolarHBondContact CB-OG 3.43Å; L309-S312 PolarHBondContact O-N 3.06Å; L309-S312 PolarHBondContact O-OG 3.03Å; L309-E315 WeakPolarHBondContact O-CB 3.06Å
310	A	55.9	Low	78.1	Confident	96 Å²	96	58.8 Å²	58.8	79%	0.793	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	127.7	158.5	0	0	0	0	0	109.5	E315	A310-E315 WeakPolarHBondContact CA-OE2 3.4Å
311	G	62.6	Low	77.6	Confident	78 Å²	78	58.1 Å²	58.1	80%	0.804	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	24.7	-179.3	0	0	0	0	0	115.4	L309 E315	L309-G311 PolarHBondContact O-N 2.86Å; G311-E315 PolarHBondContact N-OE2 3.33Å
312	S	73.1	Confident	77.1	Confident	18 Å²	18	59 Å²	59	13%	0.126	33%	0.331	C	S	.	.	S	Bend	trans	-103	162.1	177.9	60.9	0	0	0	0	114.5	L309 D314 E315 Q316	L309-S312 VanDerWaalsContact CB-CB 3.41Å; L309-S312 VanDerWaalsContact CB-OG 3.29Å; L309-S312 WeakPolarHBondContact CB-OG 3.43Å; L309-S312 PolarHBondContact O-N 3.06Å; L309-S312 PolarHBondContact O-OG 3.03Å; S312-D314 VanDerWaalsContact C-N 3.26Å; S312-D314 PolarHBondContact O-N 3.09Å; S312-E315 PolarHBondContact O-N 3Å; S312-E315 WeakPolarHBondContact OG-CB 3.16Å; S312-E315 PolarHBondContact OG-N 2.87Å; S312-Q316 WeakPolarHBondContact O-CB 3.37Å; S312-Q316 PolarHBondContact O-N 2.77Å
313	V	72.3	Confident	76.8	Confident	90 Å²	90	64.1 Å²	64.1	55%	0.545	35%	0.351	S	S	.	.	H	α-helix	trans	-62.1	-34.3	167.1	-177.4	0	0	0	0	111.1	Q316 N317 E449	V313-Q316 PolarHBondContact O-N 3.33Å; V313-N317 WeakPolarHBondContact O-CB 3.29Å; V313-N317 PolarHBondContact O-N 3.41Å; V313-N317 PolarHBondContact O-ND2 3.22Å; V313-N317 VanDerWaalsContact O-ND2 3.14Å; V313-E449 WeakPolarHBondContact CG1-OE2 3.15Å
314	D	71.1	Confident	76.5	Confident	72 Å²	72	62.5 Å²	62.5	39%	0.385	34%	0.344	S	S	.	.	H	α-helix	trans	-63.8	-45.5	174.7	-69.1	-49.6	0	0	0	112.3	S312 N317 A318	S312-D314 VanDerWaalsContact C-N 3.26Å; S312-D314 PolarHBondContact O-N 3.09Å; D314-N317 WeakPolarHBondContact O-CB 3.46Å; D314-N317 PolarHBondContact O-N 3.38Å; D314-A318 PolarHBondContact O-N 2.88Å
315	E	77.5	Confident	76.2	Confident	70 Å²	70	59.2 Å²	59.2	33%	0.327	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-43.3	174.3	-179.2	-174.6	-129.2	0	0	110.6	L309 A310 G311 S312 N317 A318 L319	L309-E315 WeakPolarHBondContact O-CB 3.06Å; A310-E315 WeakPolarHBondContact CA-OE2 3.4Å; G311-E315 PolarHBondContact N-OE2 3.33Å; S312-E315 PolarHBondContact O-N 3Å; S312-E315 WeakPolarHBondContact OG-CB 3.16Å; S312-E315 PolarHBondContact OG-N 2.87Å; E315-N317 VanDerWaalsContact C-N 3.3Å; E315-N317 PolarHBondContact O-N 3.06Å; E315-A318 PolarHBondContact O-N 3.04Å; E315-L319 HydrophobicContact CG-CD1 3.9Å; E315-L319 HydrophobicContact CG-CG 4.27Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 VanDerWaalsContact O-CG 3.29Å; E315-L319 WeakPolarHBondContact O-CG 3.49Å; E315-L319 PolarHBondContact O-N 3.4Å
316	Q	78.6	Confident	76.1	Confident	96 Å²	96	61.8 Å²	61.8	45%	0.449	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-34.7	178.1	-171.4	55.6	89.1	0	0	112.1	S312 V313 R320	S312-Q316 WeakPolarHBondContact O-CB 3.37Å; S312-Q316 PolarHBondContact O-N 2.77Å; V313-Q316 PolarHBondContact O-N 3.33Å; Q316-R320 WeakPolarHBondContact O-CB 3.49Å; Q316-R320 WeakPolarHBondContact O-CG 3.4Å; Q316-R320 PolarHBondContact O-N 3.46Å
317	N	79.8	Confident	76.8	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.037	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-50.8	169.1	-96.6	-59	0	0	0	111.9	V313 D314 E315 L319 R320 E321 G438 E449	V313-N317 WeakPolarHBondContact O-CB 3.29Å; V313-N317 PolarHBondContact O-N 3.41Å; V313-N317 PolarHBondContact O-ND2 3.22Å; V313-N317 VanDerWaalsContact O-ND2 3.14Å; D314-N317 WeakPolarHBondContact O-CB 3.46Å; D314-N317 PolarHBondContact O-N 3.38Å; E315-N317 VanDerWaalsContact C-N 3.3Å; E315-N317 PolarHBondContact O-N 3.06Å; N317-L319 VanDerWaalsContact C-N 3.31Å; N317-L319 PolarHBondContact O-N 3.41Å; N317-R320 PolarHBondContact ND2-NH2 3.43Å; N317-R320 PolarHBondContact O-N 2.89Å; N317-R320 VanDerWaalsContact O-N 3.16Å; N317-R320 PolarHBondContact OD1-NH2 2.94Å; N317-E321 PolarHBondContact O-N 3.1Å; N317-G438 VanDerWaalsContact OD1-C 3.25Å; N317-G438 PolarHBondContact OD1-O 2.96Å; N317-G438 VanDerWaalsContact OD1-O 3.08Å; N317-E449 PolarHBondContact ND2-OE1 3.12Å
318	A	80.4	Confident	77.8	Confident	13 Å²	13	51.5 Å²	51.5	11%	0.107	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-38.6	178.5	0	0	0	0	0	112.2	D314 E315 E321 V322 M347	D314-A318 PolarHBondContact O-N 2.88Å; E315-A318 PolarHBondContact O-N 3.04Å; A318-E321 PolarHBondContact O-N 3.41Å; A318-V322 WeakPolarHBondContact O-CB 3.47Å; A318-V322 VanDerWaalsContact O-CG2 3.31Å; A318-V322 WeakPolarHBondContact O-CG2 3.46Å; A318-V322 PolarHBondContact O-N 3.18Å; A318-M347 HydrophobicContact CB-CB 4.33Å; A318-M347 HydrophobicContact CB-CG 4.32Å
319	L	83.9	Confident	79.3	Confident	81 Å²	81	50.5 Å²	50.5	42%	0.424	32%	0.315	S	S	.	.	H	α-helix	trans	-69.7	-34.3	174.7	-70	174.7	0	0	0	112.4	E315 N317 Y323	E315-L319 HydrophobicContact CG-CD1 3.9Å; E315-L319 HydrophobicContact CG-CG 4.27Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 VanDerWaalsContact O-CG 3.29Å; E315-L319 WeakPolarHBondContact O-CG 3.49Å; E315-L319 PolarHBondContact O-N 3.4Å; N317-L319 VanDerWaalsContact C-N 3.31Å; N317-L319 PolarHBondContact O-N 3.41Å; L319-Y323 WeakPolarHBondContact O-CB 3.38Å; L319-Y323 PolarHBondContact O-N 2.74Å
320	R	85.3	Confident	80.9	Confident	34 Å²	34	53.3 Å²	53.3	13%	0.128	33%	0.326	C	S	.	.	H	α-helix	trans	-66.1	-44.9	170.5	-79.5	-174	-53.9	-124.8	-1.8	111.3	Q316 N317 V322 Y323 A324 G438 E449	Q316-R320 WeakPolarHBondContact O-CB 3.49Å; Q316-R320 WeakPolarHBondContact O-CG 3.4Å; Q316-R320 PolarHBondContact O-N 3.46Å; N317-R320 PolarHBondContact ND2-NH2 3.43Å; N317-R320 PolarHBondContact O-N 2.89Å; N317-R320 VanDerWaalsContact O-N 3.16Å; N317-R320 PolarHBondContact OD1-NH2 2.94Å; R320-V322 PolarHBondContact O-N 2.91Å; R320-Y323 PolarHBondContact O-N 3.25Å; R320-A324 WeakPolarHBondContact O-CB 3.39Å; R320-A324 PolarHBondContact O-N 3.36Å; R320-G438 VanDerWaalsContact CB-O 3.32Å; R320-G438 WeakPolarHBondContact CB-O 3.45Å; R320-G438 PolarHBondContact NE-O 3.28Å; R320-E449 IonicContact CZ-OE2 3.7Å; R320-E449 IonicContact NH1-OE2 3.72Å; R320-E449 PolarHBondContact NH1-OE2 2.87Å; R320-E449 IonicContact NH2-OE1 2.75Å; R320-E449 PolarHBondContact NH2-OE1 3.29Å; R320-E449 IonicContact NH2-OE2 3.61Å; R320-E449 PolarHBondContact NH2-OE2 2.9Å
321	E	87.7	Confident	82.8	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.019	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-47.5	176.4	-176.3	176.3	-178.6	0	0	111.4	K303 N317 A318 A324 H325 I349 L437	K303-E321 IonicContact NZ-OE1 2.64Å; K303-E321 IonicContact NZ-OE2 3.33Å; K303-E321 PolarHBondContact NZ-OE2 3.05Å; N317-E321 PolarHBondContact O-N 3.1Å; A318-E321 PolarHBondContact O-N 3.41Å; E321-A324 PolarHBondContact O-N 3.08Å; E321-H325 WeakPolarHBondContact O-CB 3.32Å; E321-H325 PolarHBondContact O-CD2 2.86Å; E321-H325 PolarHBondContact O-N 3.12Å; E321-I349 HydrophobicContact CB-CD1 4.22Å; E321-I349 VanDerWaalsContact CD-CD1 3.47Å; E321-I349 HydrophobicContact CG-CD1 3.95Å; E321-I349 VanDerWaalsContact OE2-CD1 3.32Å; E321-I349 WeakPolarHBondContact OE2-CD1 3.25Å; E321-L437 HydrophobicContact CG-CB 4.22Å
322	V	87.3	Confident	84.4	Confident	32 Å²	32	50.8 Å²	50.8	19%	0.194	28%	0.284	C	S	.	.	H	α-helix	trans	-66.1	-40.4	176.6	172.3	0	0	0	0	112.1	A318 R320 H325 A326 A340 I349	A318-V322 WeakPolarHBondContact O-CB 3.47Å; A318-V322 VanDerWaalsContact O-CG2 3.31Å; A318-V322 WeakPolarHBondContact O-CG2 3.46Å; A318-V322 PolarHBondContact O-N 3.18Å; R320-V322 PolarHBondContact O-N 2.91Å; V322-H325 PolarHBondContact O-N 3.09Å; V322-A326 WeakPolarHBondContact O-CB 3.36Å; V322-A326 PolarHBondContact O-N 3.07Å; V322-A340 HydrophobicContact CG1-CB 4.48Å; V322-A340 HydrophobicContact CG2-CB 3.53Å; V322-I349 HydrophobicContact CG2-CD1 3.98Å; V322-I349 HydrophobicContact CG2-CG1 4.15Å
323	Y	88.7	Confident	85.5	Confident	109 Å²	109	50.9 Å²	50.9	43%	0.427	28%	0.282	S	S	.	.	H	α-helix	trans	-67	-42.9	176.3	178.7	-97.7	0	0	0	112.1	L319 R320 H325 A326 V327 R442	L319-Y323 WeakPolarHBondContact O-CB 3.38Å; L319-Y323 PolarHBondContact O-N 2.74Å; R320-Y323 PolarHBondContact O-N 3.25Å; Y323-H325 VanDerWaalsContact C-N 3.34Å; Y323-H325 PolarHBondContact O-N 3.05Å; Y323-A326 PolarHBondContact O-N 3.21Å; Y323-A326 VanDerWaalsContact O-N 3.1Å; Y323-V327 HydrophobicContact CD1-CG2 4.4Å; Y323-V327 HydrophobicContact CE1-CG2 3.8Å; Y323-V327 HydrophobicContact CE2-CG2 4.08Å; Y323-V327 PolarHBondContact O-N 2.93Å; Y323-R442 PolarHBondContact OH-NH2 2.79Å
324	A	87.6	Confident	86.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-46.5	175	0	0	0	0	0	110.5	R320 E321 A326 V327 L328 L437 V440	R320-A324 WeakPolarHBondContact O-CB 3.39Å; R320-A324 PolarHBondContact O-N 3.36Å; E321-A324 PolarHBondContact O-N 3.08Å; A324-A326 VanDerWaalsContact C-N 3.3Å; A324-A326 PolarHBondContact O-N 3.14Å; A324-V327 PolarHBondContact O-N 3.1Å; A324-L328 HydrophobicContact CB-CD1 4.44Å; A324-L328 WeakPolarHBondContact O-CB 3.47Å; A324-L328 VanDerWaalsContact O-CG 3.28Å; A324-L328 WeakPolarHBondContact O-CG 3.49Å; A324-L328 PolarHBondContact O-N 3.09Å; A324-L437 HydrophobicContact CB-CB 3.95Å; A324-L437 HydrophobicContact CB-CD1 3.91Å; A324-V440 HydrophobicContact CB-CB 3.81Å; A324-V440 HydrophobicContact CB-CG1 3.65Å; A324-V440 HydrophobicContact CB-CG2 4.27Å
325	H	85.8	Confident	87.9	Confident	12 Å²	12	43.9 Å²	43.9	6%	0.056	24%	0.242	C	C	.	.	H	α-helix	trans	-69.5	-18.9	174.5	-77.5	-53.9	0	0	0	115.1	E321 V322 Y323 V335 Y337 L437	E321-H325 WeakPolarHBondContact O-CB 3.32Å; E321-H325 PolarHBondContact O-CD2 2.86Å; E321-H325 PolarHBondContact O-N 3.12Å; V322-H325 PolarHBondContact O-N 3.09Å; Y323-H325 VanDerWaalsContact C-N 3.34Å; Y323-H325 PolarHBondContact O-N 3.05Å; H325-V335 PolarHBondContact CE1-O 3.17Å; H325-Y337 HydrophobicContact CB-CD1 3.77Å; H325-Y337 HydrophobicContact CB-CD2 3.94Å; H325-Y337 HydrophobicContact CB-CE1 4.34Å; H325-Y337 HydrophobicContact CB-CE2 4.49Å; H325-Y337 HydrophobicContact CB-CG 3.53Å; H325-Y337 AromaticContact CD2-CD2 3.98Å; H325-Y337 AromaticContact CG-CG 3.79Å; H325-Y337 WeakPolarHBondContact ND1-CB 3.22Å; H325-L437 WeakPolarHBondContact CE1-CD1 3.31Å; H325-L437 WeakPolarHBondContact ND1-CD1 3.48Å
326	A	85.7	Confident	88.7	Confident	79 Å²	79	44.9 Å²	44.9	65%	0.653	24%	0.243	S	C	*	.	H	α-helix	trans	-80.7	-26.7	171.4	0	0	0	0	0	112.8	V322 Y323 A324	V322-A326 WeakPolarHBondContact O-CB 3.36Å; V322-A326 PolarHBondContact O-N 3.07Å; Y323-A326 PolarHBondContact O-N 3.21Å; Y323-A326 VanDerWaalsContact O-N 3.1Å; A324-A326 VanDerWaalsContact C-N 3.3Å; A324-A326 PolarHBondContact O-N 3.14Å
327	V	89	Confident	89.4	Confident	40 Å²	40	43.1 Å²	43.1	24%	0.242	23%	0.232	C	C	.	.	H	α-helix	trans	-87.5	-39.7	174.1	175.8	0	0	0	0	111.5	Y323 A324 G329 M395 L397	Y323-V327 HydrophobicContact CD1-CG2 4.4Å; Y323-V327 HydrophobicContact CE1-CG2 3.8Å; Y323-V327 HydrophobicContact CE2-CG2 4.08Å; Y323-V327 PolarHBondContact O-N 2.93Å; A324-V327 PolarHBondContact O-N 3.1Å; V327-G329 PolarHBondContact O-N 2.81Å; V327-M395 HydrophobicContact CG1-CB 4.26Å; V327-M395 HydrophobicContact CG1-CE 3.79Å; V327-L397 HydrophobicContact CB-CD1 4.24Å; V327-L397 HydrophobicContact CG1-CD1 3.95Å
328	L	89.4	Confident	90.1	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.042	25%	0.247	C	C	.	.	S	Bend	trans	-84.7	102.9	178.9	-64.6	166.1	0	0	0	110	A324 Y391 I392 M395 L397 L437	A324-L328 HydrophobicContact CB-CD1 4.44Å; A324-L328 WeakPolarHBondContact O-CB 3.47Å; A324-L328 VanDerWaalsContact O-CG 3.28Å; A324-L328 WeakPolarHBondContact O-CG 3.49Å; A324-L328 PolarHBondContact O-N 3.09Å; L328-Y391 HydrophobicContact CB-CE1 4.21Å; L328-Y391 HydrophobicContact CD2-CD1 4.02Å; L328-Y391 HydrophobicContact CD2-CE1 3.71Å; L328-I392 HydrophobicContact CD1-CG1 4.2Å; L328-I392 HydrophobicContact CD2-CB 4.44Å; L328-I392 HydrophobicContact CD2-CG1 4.1Å; L328-M395 HydrophobicContact CD2-CB 4.23Å; L328-M395 HydrophobicContact CD2-CG 3.97Å; L328-L397 HydrophobicContact CD1-CD1 4.16Å; L328-L397 HydrophobicContact CD2-CD1 4.18Å; L328-L397 HydrophobicContact CG-CD1 3.94Å; L328-L437 HydrophobicContact CD1-CD1 3.7Å
329	G	86.9	Confident	90.7	Very high	43 Å²	43	47.5 Å²	47.5	44%	0.443	25%	0.25	S	S	.	.			trans	-67.2	-173.4	168.1	0	0	0	0	0	113.2	V327 H331 Y391	V327-G329 PolarHBondContact O-N 2.81Å; G329-H331 PolarHBondContact O-N 2.86Å; G329-Y391 WeakPolarHBondContact CA-OH 3.42Å; G329-Y391 PolarHBondContact N-OH 3.47Å
330	Q	91.2	Very high	91.1	Very high	138 Å²	138	44.9 Å²	44.9	65%	0.645	24%	0.24	S	C	*	.			trans	-69.7	120.9	-176.8	-176.5	175.6	-12.6	0	0	112	R336	Q330-R336 VanDerWaalsContact OE1-CZ 3.26Å
331	H	95.3	Very high	91.4	Very high	40 Å²	40	44.6 Å²	44.6	19%	0.185	24%	0.239	C	C	.	.			trans	-131.3	141.1	173.7	-178.3	-103.6	0	0	0	110.6	G329 H333 V334 R387 Y391	G329-H331 PolarHBondContact O-N 2.86Å; H331-H333 VanDerWaalsContact C-N 3.29Å; H331-H333 AromaticContact CE1-CD2 3.99Å; H331-H333 PolarHBondContact ND1-N 3.44Å; H331-H333 PolarHBondContact O-N 2.87Å; H331-V334 HydrophobicContact CB-CB 4.35Å; H331-V334 HydrophobicContact CB-CG2 4.28Å; H331-V334 PolarHBondContact O-N 2.64Å; H331-V334 VanDerWaalsContact O-O 3.13Å; H331-R387 PolarHBondContact CE1-O 2.98Å; H331-R387 VanDerWaalsContact CE1-O 3.23Å; H331-Y391 HydrophobicContact CB-CD1 3.43Å; H331-Y391 VanDerWaalsContact CB-CD1 3.43Å; H331-Y391 HydrophobicContact CB-CE1 3.68Å; H331-Y391 HydrophobicContact CB-CG 3.89Å; H331-Y391 AromaticContact CD2-CG 3.8Å; H331-Y391 AromaticContact CG-CD1 3.7Å; H331-Y391 AromaticContact CG-CG 3.69Å
332	P	95.3	Very high	91.5	Very high	81 Å²	81	48.2 Å²	48.2	53%	0.526	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-37.6	-174.6	-28.8	36.9	0	0	0	114.7	K433	P332-K433 WeakPolarHBondContact O-CE 3.39Å; P332-K433 WeakPolarHBondContact O-CG 3.35Å; P332-K433 PolarHBondContact O-NZ 3.17Å
333	H	97.2	Very high	91.5	Very high	20 Å²	20	47.9 Å²	47.9	9%	0.093	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	21.4	-176.1	-54.2	-67.5	0	0	0	114	H331 Q384 Y432 K433 I434	H331-H333 VanDerWaalsContact C-N 3.29Å; H331-H333 AromaticContact CE1-CD2 3.99Å; H331-H333 PolarHBondContact ND1-N 3.44Å; H331-H333 PolarHBondContact O-N 2.87Å; H333-Q384 WeakPolarHBondContact CB-O 3.26Å; H333-Q384 PolarHBondContact CE1-OE1 3.08Å; H333-Q384 VanDerWaalsContact CG-O 3.27Å; H333-Q384 PolarHBondContact ND1-OE1 3.28Å; H333-Y432 WeakPolarHBondContact CA-O 3.43Å; H333-Y432 PolarHBondContact ND1-O 3.34Å; H333-K433 WeakPolarHBondContact O-CA 3.47Å; H333-I434 PolarHBondContact O-N 3.41Å
334	V	96.9	Very high	91.3	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.024	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-123	145.9	166	-179.8	0	0	0	0	107.6	H331 R336 Y391 I392 K433 I434	H331-V334 HydrophobicContact CB-CB 4.35Å; H331-V334 HydrophobicContact CB-CG2 4.28Å; H331-V334 PolarHBondContact O-N 2.64Å; H331-V334 VanDerWaalsContact O-O 3.13Å; V334-R336 PolarHBondContact O-N 2.91Å; V334-Y391 HydrophobicContact CG2-CD1 4.24Å; V334-I392 HydrophobicContact CG2-CD1 4.23Å; V334-I392 HydrophobicContact CG2-CG1 4.24Å; V334-K433 PolarHBondContact O-NZ 3.18Å; V334-I434 CarbonylContact C-O 3.59Å; V334-I434 WeakPolarHBondContact CA-O 3.48Å
335	V	96.4	Very high	91	Very high	10 Å²	10	54.5 Å²	54.5	6%	0.061	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-66.3	117.6	174.7	171.7	0	0	0	0	108.6	H325 Y337 N351 E352 F408 K433 I434	H325-V335 PolarHBondContact CE1-O 3.17Å; V335-Y337 PolarHBondContact O-N 3.49Å; V335-N351 HydrophobicContact CG1-CB 3.84Å; V335-E352 WeakPolarHBondContact CA-OE1 3.5Å; V335-E352 HydrophobicContact CG1-CG 4.21Å; V335-F408 HydrophobicContact CG2-CB 4.03Å; V335-F408 HydrophobicContact CG2-CD2 3.68Å; V335-F408 HydrophobicContact CG2-CE2 4.47Å; V335-F408 HydrophobicContact CG2-CG 4.02Å; V335-K433 HydrophobicContact CG2-CB 3.88Å; V335-I434 WeakPolarHBondContact CG2-O 3.44Å; V335-I434 PolarHBondContact N-O 3.46Å
336	R	94.6	Very high	90.9	Very high	91 Å²	91	56.3 Å²	56.3	34%	0.343	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-71.2	123	-179.5	177.7	177	-179.2	-179.2	9.5	110.9	Q330 V334 Y338 N351 E352	Q330-R336 VanDerWaalsContact OE1-CZ 3.26Å; V334-R336 PolarHBondContact O-N 2.91Å; R336-Y338 HydrophobicContact CB-CE2 4.42Å; R336-Y338 HydrophobicContact CG-CD2 4.42Å; R336-Y338 HydrophobicContact CG-CE2 3.94Å; R336-N351 CarbonylContact O-C 3.6Å; R336-N351 WeakPolarHBondContact O-CA 3.47Å; R336-E352 HydrophobicContact CB-CB 4.3Å; R336-E352 HydrophobicContact CB-CG 4.24Å; R336-E352 WeakPolarHBondContact CB-OE1 3.38Å; R336-E352 PolarHBondContact N-OE1 3.33Å; R336-E352 PolarHBondContact O-N 3.23Å
337	Y	93.8	Very high	91	Very high	59 Å²	59	54.5 Å²	54.5	23%	0.231	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	152.1	166.3	167	-98.7	0	0	0	112.3	H325 V335 S339 A340 I349 N351	H325-Y337 HydrophobicContact CB-CD1 3.77Å; H325-Y337 HydrophobicContact CB-CD2 3.94Å; H325-Y337 HydrophobicContact CB-CE1 4.34Å; H325-Y337 HydrophobicContact CB-CE2 4.49Å; H325-Y337 HydrophobicContact CB-CG 3.53Å; H325-Y337 AromaticContact CD2-CD2 3.98Å; H325-Y337 AromaticContact CG-CG 3.79Å; H325-Y337 WeakPolarHBondContact ND1-CB 3.22Å; V335-Y337 PolarHBondContact O-N 3.49Å; Y337-S339 WeakPolarHBondContact CE2-O 3.39Å; Y337-A340 HydrophobicContact CE2-CB 3.84Å; Y337-A340 WeakPolarHBondContact OH-CB 2.97Å; Y337-A340 PolarHBondContact OH-N 2.56Å; Y337-I349 HydrophobicContact CD2-CG2 4.02Å; Y337-I349 HydrophobicContact CE2-CG2 4.13Å; Y337-N351 WeakPolarHBondContact CA-OD1 3.26Å
338	Y	93.6	Very high	91.2	Very high	87 Å²	87	52.7 Å²	52.7	34%	0.341	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	-49.9	176.7	-70	-92.3	0	0	0	113	Y300 R336 Q350 E352	Y300-Y338 AromaticContact CD1-CD2 3.81Å; Y300-Y338 HydrophobicContact CD1-CD2 3.81Å; Y300-Y338 AromaticContact CD1-CE2 3.97Å; Y300-Y338 HydrophobicContact CD1-CE2 3.97Å; Y300-Y338 HydrophobicContact CD1-CG 4.27Å; Y300-Y338 AromaticContact CE1-CD1 3.91Å; Y300-Y338 HydrophobicContact CE1-CD1 3.91Å; Y300-Y338 AromaticContact CE1-CD2 3.58Å; Y300-Y338 HydrophobicContact CE1-CD2 3.58Å; Y300-Y338 AromaticContact CE1-CE1 3.92Å; Y300-Y338 HydrophobicContact CE1-CE1 3.92Å; Y300-Y338 AromaticContact CE1-CE2 3.58Å; Y300-Y338 HydrophobicContact CE1-CE2 3.58Å; Y300-Y338 AromaticContact CE1-CG 3.73Å; Y300-Y338 HydrophobicContact CE1-CG 3.73Å; Y300-Y338 AromaticContact CE1-CZ 3.76Å; R336-Y338 HydrophobicContact CB-CE2 4.42Å; R336-Y338 HydrophobicContact CG-CD2 4.42Å; R336-Y338 HydrophobicContact CG-CE2 3.94Å; Y338-Q350 PolarHBondContact N-O 3.11Å; Y338-E352 HydrophobicContact CE2-CB 3.91Å
339	S	93.7	Very high	91.4	Very high	25 Å²	25	52.5 Å²	52.5	18%	0.175	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	159.4	175.9	72.6	0	0	0	0	112.1	Y337 Q350	Y337-S339 WeakPolarHBondContact CE2-O 3.39Å; S339-Q350 PolarHBondContact N-O 3.13Å; S339-Q350 WeakPolarHBondContact O-CB 3.43Å; S339-Q350 PolarHBondContact O-N 2.61Å; S339-Q350 PolarHBondContact OG-OE1 2.75Å
340	A	92.4	Very high	91.8	Very high	26 Å²	26	50.8 Å²	50.8	22%	0.215	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	153	166	0	0	0	0	0	109.9	V322 Y337 L348 I349	V322-A340 HydrophobicContact CG1-CB 4.48Å; V322-A340 HydrophobicContact CG2-CB 3.53Å; Y337-A340 HydrophobicContact CE2-CB 3.84Å; Y337-A340 WeakPolarHBondContact OH-CB 2.97Å; Y337-A340 PolarHBondContact OH-N 2.56Å; A340-L348 CarbonylContact C-O 3.57Å; A340-L348 WeakPolarHBondContact CA-O 3.36Å; A340-L348 VanDerWaalsContact CB-O 3.32Å; A340-L348 WeakPolarHBondContact CB-O 3.49Å; A340-I349 HydrophobicContact CB-CG1 4.02Å
341	W	91.8	Very high	92	Very high	29 Å²	29	44.9 Å²	44.9	11%	0.11	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	162	177.2	66.1	104	0	0	0	110.9	Y270 F274 E343 L348 Q350	Y270-W341 HydrophobicContact CD2-CZ2 4.43Å; F274-W341 HydrophobicContact CD2-CH2 4.22Å; F274-W341 HydrophobicContact CD2-CZ2 4.43Å; F274-W341 AromaticContact CE2-CH2 3.48Å; F274-W341 HydrophobicContact CE2-CH2 3.48Å; F274-W341 VanDerWaalsContact CE2-CH2 3.48Å; F274-W341 AromaticContact CE2-CZ2 3.97Å; F274-W341 HydrophobicContact CE2-CZ2 3.97Å; F274-W341 HydrophobicContact CE2-CZ3 4.37Å; F274-W341 AromaticContact CZ-CH2 3.98Å; F274-W341 HydrophobicContact CZ-CH2 3.98Å; W341-E343 PolarHBondContact NE1-OE2 3.18Å; W341-L348 HydrophobicContact CD2-CB 4.01Å; W341-L348 HydrophobicContact CE3-CB 4.29Å; W341-L348 HydrophobicContact CH2-CB 4.25Å; W341-L348 HydrophobicContact CZ2-CB 3.95Å; W341-L348 HydrophobicContact CZ2-CD2 3.8Å; W341-L348 HydrophobicContact CZ2-CG 4.43Å; W341-L348 HydrophobicContact CZ3-CB 4.41Å; W341-L348 PolarHBondContact N-O 2.81Å; W341-L348 PolarHBondContact O-N 3.32Å; W341-Q350 HydrophobicContact CZ3-CB 4.02Å
342	A	88.3	Confident	92	Very high	79 Å²	79	44.8 Å²	44.8	65%	0.653	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	137.3	169.6	0	0	0	0	0	109.6	H346 M347	A342-H346 CarbonylContact C-O 3.5Å; A342-H346 VanDerWaalsContact CA-O 3.3Å; A342-H346 WeakPolarHBondContact CA-O 3.31Å; A342-M347 HydrophobicContact CB-SD 3.93Å
343	E	88.2	Confident	92.1	Very high	25 Å²	25	43.6 Å²	43.6	12%	0.117	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	139.7	-178	-164.9	-176.9	160.2	0	0	110.5	S268 R269 Y270 W341 D345 H346 L348	S268-E343 WeakPolarHBondContact CA-OE1 3.25Å; S268-E343 WeakPolarHBondContact CB-OE1 3.36Å; S268-E343 PolarHBondContact OG-OE1 3.36Å; R269-E343 WeakPolarHBondContact CB-OE2 3.39Å; R269-E343 PolarHBondContact N-OE1 3.35Å; Y270-E343 PolarHBondContact N-OE1 2.92Å; Y270-E343 PolarHBondContact N-OE2 3.46Å; W341-E343 PolarHBondContact NE1-OE2 3.18Å; E343-D345 PolarHBondContact O-N 2.68Å; E343-D345 VanDerWaalsContact O-N 3.11Å; E343-H346 PolarHBondContact N-O 3.15Å; E343-H346 WeakPolarHBondContact O-CA 3.38Å; E343-H346 PolarHBondContact O-N 3.29Å; E343-L348 HydrophobicContact CB-CD1 3.7Å
344	D	84.4	Confident	92	Very high	124 Å²	124	43.1 Å²	43.1	66%	0.663	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.6	42.6	-179	-61.3	-18.1	0	0	0	113.2	H346	D344-H346 PolarHBondContact O-CE1 2.75Å; D344-H346 PolarHBondContact O-N 2.8Å; D344-H346 PolarHBondContact O-ND1 3.28Å
345	D	81.3	Confident	91.9	Very high	124 Å²	124	46.5 Å²	46.5	66%	0.663	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	19.3	-178.4	-110.3	9.9	0	0	0	114.4	K307 P308 E343	K307-D345 CarbonylContact C-O 3.48Å; P308-D345 WeakPolarHBondContact CA-O 3.27Å; P308-D345 HydrophobicContact CB-CB 3.58Å; P308-D345 VanDerWaalsContact CB-CG 3.42Å; P308-D345 WeakPolarHBondContact CB-O 3.43Å; P308-D345 WeakPolarHBondContact CB-OD2 3.45Å; P308-D345 WeakPolarHBondContact CD-O 3.38Å; P308-D345 HydrophobicContact CG-CB 3.74Å; P308-D345 WeakPolarHBondContact CG-OD2 3.36Å; E343-D345 PolarHBondContact O-N 2.68Å; E343-D345 VanDerWaalsContact O-N 3.11Å
346	H	84.3	Confident	91.8	Very high	50 Å²	50	46.4 Å²	46.4	23%	0.231	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	155.1	175	-61.8	87	0	0	0	112.2	R304 S305 A342 E343 D344 L348	R304-H346 HydrophobicContact CG-CB 4.03Å; S305-H346 PolarHBondContact O-CD2 2.81Å; S305-H346 WeakPolarHBondContact OG-CA 3.35Å; A342-H346 CarbonylContact C-O 3.5Å; A342-H346 VanDerWaalsContact CA-O 3.3Å; A342-H346 WeakPolarHBondContact CA-O 3.31Å; E343-H346 PolarHBondContact N-O 3.15Å; E343-H346 WeakPolarHBondContact O-CA 3.38Å; E343-H346 PolarHBondContact O-N 3.29Å; D344-H346 PolarHBondContact O-CE1 2.75Å; D344-H346 PolarHBondContact O-N 2.8Å; D344-H346 PolarHBondContact O-ND1 3.28Å; H346-L348 HydrophobicContact CB-CD1 4.39Å
347	M	87.5	Confident	91.8	Very high	41 Å²	41	43.4 Å²	43.4	20%	0.202	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	133.2	166.7	-74.6	-64.9	-69	0	0	109.8	R304 S305 A318 A342	R304-M347 CarbonylContact C-O 3.4Å; R304-M347 WeakPolarHBondContact CA-O 3.44Å; S305-M347 PolarHBondContact N-O 3.29Å; S305-M347 PolarHBondContact OG-N 2.65Å; A318-M347 HydrophobicContact CB-CB 4.33Å; A318-M347 HydrophobicContact CB-CG 4.32Å; A342-M347 HydrophobicContact CB-SD 3.93Å
348	L	92.6	Very high	91.9	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.4	175.7	-65.7	90.2	0	0	0	110	Y270 I302 K303 R304 A340 W341 E343 H346	Y270-L348 HydrophobicContact CD2-CD2 3.56Å; Y270-L348 HydrophobicContact CE2-CD2 4.32Å; Y270-L348 HydrophobicContact CG-CD2 3.87Å; I302-L348 HydrophobicContact CG2-CB 4.39Å; I302-L348 HydrophobicContact CG2-CD2 4.25Å; K303-L348 CarbonylContact O-C 3.6Å; K303-L348 WeakPolarHBondContact O-CA 3.48Å; R304-L348 HydrophobicContact CB-CG 4.31Å; R304-L348 HydrophobicContact CG-CD1 4.49Å; R304-L348 HydrophobicContact CG-CD2 4.38Å; R304-L348 HydrophobicContact CG-CG 4.05Å; A340-L348 CarbonylContact C-O 3.57Å; A340-L348 WeakPolarHBondContact CA-O 3.36Å; A340-L348 VanDerWaalsContact CB-O 3.32Å; A340-L348 WeakPolarHBondContact CB-O 3.49Å; W341-L348 HydrophobicContact CD2-CB 4.01Å; W341-L348 HydrophobicContact CE3-CB 4.29Å; W341-L348 HydrophobicContact CH2-CB 4.25Å; W341-L348 HydrophobicContact CZ2-CB 3.95Å; W341-L348 HydrophobicContact CZ2-CD2 3.8Å; W341-L348 HydrophobicContact CZ2-CG 4.43Å; W341-L348 HydrophobicContact CZ3-CB 4.41Å; W341-L348 PolarHBondContact N-O 2.81Å; W341-L348 PolarHBondContact O-N 3.32Å; E343-L348 HydrophobicContact CB-CD1 3.7Å; H346-L348 HydrophobicContact CB-CD1 4.39Å
349	I	93.1	Very high	92.1	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	121	179.6	-58.1	177.1	0	0	0	108.6	I302 K303 E321 V322 Y337 A340	I302-I349 CarbonylContact C-O 3.53Å; I302-I349 WeakPolarHBondContact CA-O 3.37Å; K303-I349 HydrophobicContact CB-CB 4.41Å; K303-I349 PolarHBondContact N-O 3.24Å; K303-I349 PolarHBondContact O-N 2.86Å; E321-I349 HydrophobicContact CB-CD1 4.22Å; E321-I349 VanDerWaalsContact CD-CD1 3.47Å; E321-I349 HydrophobicContact CG-CD1 3.95Å; E321-I349 VanDerWaalsContact OE2-CD1 3.32Å; E321-I349 WeakPolarHBondContact OE2-CD1 3.25Å; V322-I349 HydrophobicContact CG2-CD1 3.98Å; V322-I349 HydrophobicContact CG2-CG1 4.15Å; Y337-I349 HydrophobicContact CD2-CG2 4.02Å; Y337-I349 HydrophobicContact CE2-CG2 4.13Å; A340-I349 HydrophobicContact CB-CG1 4.02Å
350	Q	95.7	Very high	92.2	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.028	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.4	-178.8	-179.9	-158.8	4.9	0	0	110.7	F274 Y300 I302 Y338 S339 W341	F274-Q350 HydrophobicContact CE1-CG 4.33Å; F274-Q350 HydrophobicContact CZ-CG 4.35Å; Y300-Q350 HydrophobicContact CD1-CG 3.77Å; Y300-Q350 HydrophobicContact CG-CG 3.95Å; I302-Q350 HydrophobicContact CG1-CB 4.38Å; I302-Q350 HydrophobicContact CG1-CG 4.33Å; Y338-Q350 PolarHBondContact N-O 3.11Å; S339-Q350 PolarHBondContact N-O 3.13Å; S339-Q350 WeakPolarHBondContact O-CB 3.43Å; S339-Q350 PolarHBondContact O-N 2.61Å; S339-Q350 PolarHBondContact OG-OE1 2.75Å; W341-Q350 HydrophobicContact CZ3-CB 4.02Å
351	N	95.8	Very high	92.4	Very high	14 Å²	14	41.8 Å²	41.8	8%	0.075	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	166.6	179.3	-70.8	-16.4	0	0	0	111.4	A301 V335 R336 Y337	A301-N351 PolarHBondContact N-O 2.94Å; A301-N351 PolarHBondContact O-N 3.21Å; V335-N351 HydrophobicContact CG1-CB 3.84Å; R336-N351 CarbonylContact O-C 3.6Å; R336-N351 WeakPolarHBondContact O-CA 3.47Å; Y337-N351 WeakPolarHBondContact CA-OD1 3.26Å
352	E	95.4	Very high	92.5	Very high	38 Å²	38	41.7 Å²	41.7	18%	0.178	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	139.4	174.2	74.6	-173.1	136.3	0	0	111.6	V335 R336 Y338 C354 K433	V335-E352 WeakPolarHBondContact CA-OE1 3.5Å; V335-E352 HydrophobicContact CG1-CG 4.21Å; R336-E352 HydrophobicContact CB-CB 4.3Å; R336-E352 HydrophobicContact CB-CG 4.24Å; R336-E352 WeakPolarHBondContact CB-OE1 3.38Å; R336-E352 PolarHBondContact N-OE1 3.33Å; R336-E352 PolarHBondContact O-N 3.23Å; Y338-E352 HydrophobicContact CE2-CB 3.91Å; E352-C354 PolarHBondContact O-N 3.17Å; E352-K433 VanDerWaalsContact CD-NZ 3.31Å; E352-K433 WeakPolarHBondContact OE1-CD 3.23Å; E352-K433 VanDerWaalsContact OE1-CE 3.23Å; E352-K433 WeakPolarHBondContact OE1-CE 3.47Å; E352-K433 IonicContact OE1-NZ 2.75Å; E352-K433 PolarHBondContact OE1-NZ 3.1Å; E352-K433 WeakPolarHBondContact OE2-CE 3.46Å; E352-K433 IonicContact OE2-NZ 3.6Å; E352-K433 PolarHBondContact OE2-NZ 3.09Å
353	Y	96.8	Very high	92.8	Very high	57 Å²	57	39.9 Å²	39.9	22%	0.224	22%	0.219	C	C	.	.			trans	-79.1	115.5	174.4	176.3	-109.9	0	0	0	111.3	I280 K290 I299 N355	I280-Y353 HydrophobicContact CD1-CD2 4.14Å; I280-Y353 HydrophobicContact CD1-CE2 4.04Å; I280-Y353 HydrophobicContact CG2-CE2 4.42Å; K290-Y353 HydrophobicContact CB-CD2 4.29Å; K290-Y353 HydrophobicContact CB-CE2 4.12Å; K290-Y353 HydrophobicContact CD-CD2 4.37Å; K290-Y353 HydrophobicContact CD-CE1 4.2Å; K290-Y353 HydrophobicContact CD-CE2 3.77Å; K290-Y353 WeakPolarHBondContact CE-OH 3.34Å; K290-Y353 HydrophobicContact CG-CD2 3.87Å; K290-Y353 HydrophobicContact CG-CE1 4.49Å; K290-Y353 HydrophobicContact CG-CE2 3.74Å; K290-Y353 HydrophobicContact CG-CG 4.31Å; K290-Y353 PolarHBondContact NZ-OH 3.44Å; I299-Y353 HydrophobicContact CB-CD1 4.23Å; I299-Y353 HydrophobicContact CB-CG 4.46Å; I299-Y353 HydrophobicContact CG2-CD1 3.63Å; I299-Y353 HydrophobicContact CG2-CD2 4.4Å; I299-Y353 HydrophobicContact CG2-CE1 4.32Å; I299-Y353 HydrophobicContact CG2-CG 3.66Å; I299-Y353 WeakPolarHBondContact O-CB 3.39Å; Y353-N355 HydrophobicContact CD1-CB 4.28Å; Y353-N355 HydrophobicContact CE1-CB 3.8Å; Y353-N355 PolarHBondContact O-N 3.46Å
354	C	96.3	Very high	93.1	Very high	10 Å²	10	41.3 Å²	41.3	7%	0.068	24%	0.235	C	C	.	.			trans	-89.1	98.4	174.7	-70.1	0	0	0	0	110.5	E352 G356 G357 F408 I409	E352-C354 PolarHBondContact O-N 3.17Å; C354-G356 PolarHBondContact O-N 3.29Å; C354-G356 VanDerWaalsContact O-N 3.08Å; C354-G357 PolarHBondContact O-N 2.99Å; C354-F408 HydrophobicContact CB-CB 3.74Å; C354-F408 HydrophobicContact CB-CD1 4.31Å; C354-F408 HydrophobicContact CB-CG 4.45Å; C354-I409 CarbonylContact C-O 3.54Å; C354-I409 WeakPolarHBondContact CB-O 3.42Å
355	N	94.4	Very high	93.6	Very high	75 Å²	75	38.3 Å²	38.3	40%	0.401	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-7.1	-175.2	67	-21.2	0	0	0	115.9	Y353 S410 R411	Y353-N355 HydrophobicContact CD1-CB 4.28Å; Y353-N355 HydrophobicContact CE1-CB 3.8Å; Y353-N355 PolarHBondContact O-N 3.46Å; N355-S410 WeakPolarHBondContact OD1-CA 3.5Å; N355-R411 PolarHBondContact ND2-O 3.41Å; N355-R411 PolarHBondContact OD1-N 3.27Å; N355-R411 PolarHBondContact OD1-O 3.23Å
356	G	93.8	Very high	94.1	Very high	8 Å²	8	33.1 Å²	33.1	8%	0.082	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-10.1	175.9	0	0	0	0	0	115.1	C354 I409 R411	C354-G356 PolarHBondContact O-N 3.29Å; C354-G356 VanDerWaalsContact O-N 3.08Å; G356-I409 WeakPolarHBondContact CA-O 3.37Å; G356-I409 PolarHBondContact N-O 3.35Å; G356-R411 PolarHBondContact O-NH2 3.19Å
357	G	94.9	Very high	94.4	Very high	27 Å²	27	38.6 Å²	38.6	28%	0.278	21%	0.211	S	C	.	.			trans	82.1	-157.7	-170.4	0	0	0	0	0	112.6	C354 I409	C354-G357 PolarHBondContact O-N 2.99Å; G357-I409 PolarHBondContact O-N 2.94Å
358	T	96.8	Very high	94.6	Very high	22 Å²	22	44.9 Å²	44.9	14%	0.135	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-96.1	162.6	171.8	72.7	0	0	0	0	111.3	S360 D361 V362 S405 I407 F408	T358-S360 PolarHBondContact O-N 3Å; T358-S360 WeakPolarHBondContact OG1-CB 3.43Å; T358-S360 PolarHBondContact OG1-N 3.15Å; T358-D361 WeakPolarHBondContact CA-OD2 3.14Å; T358-D361 WeakPolarHBondContact CB-OD2 3.28Å; T358-D361 PolarHBondContact N-OD2 3.49Å; T358-D361 WeakPolarHBondContact O-CB 3.35Å; T358-D361 PolarHBondContact O-N 2.85Å; T358-D361 PolarHBondContact OG1-N 2.86Å; T358-D361 VanDerWaalsContact OG1-N 3.17Å; T358-D361 PolarHBondContact OG1-OD2 2.91Å; T358-V362 PolarHBondContact O-N 2.98Å; T358-S405 WeakPolarHBondContact CG2-O 3.35Å; T358-I407 CarbonylContact C-O 3.57Å; T358-I407 WeakPolarHBondContact CA-O 3.25Å; T358-F408 HydrophobicContact CG2-CD1 4.08Å; T358-F408 HydrophobicContact CG2-CE1 3.84Å; T358-F408 HydrophobicContact CG2-CZ 4.39Å
359	L	97.1	Very high	94.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64	-28.8	170.4	-173.2	66.2	0	0	0	111.6	D361 V362 I363 L381 P404 I407 I409 Y432 T479 T483	L359-D361 VanDerWaalsContact C-N 3.31Å; L359-D361 PolarHBondContact O-N 3.39Å; L359-V362 PolarHBondContact O-N 2.99Å; L359-I363 WeakPolarHBondContact O-CG1 3.4Å; L359-I363 PolarHBondContact O-N 2.98Å; L359-L381 HydrophobicContact CD1-CD1 4.45Å; L359-L381 HydrophobicContact CD1-CD2 4.32Å; L359-L381 HydrophobicContact CD2-CD1 3.83Å; L359-L381 HydrophobicContact CD2-CD2 3.82Å; L359-L381 HydrophobicContact CD2-CG 4.48Å; L359-P404 HydrophobicContact CB-CB 4.22Å; L359-P404 WeakPolarHBondContact CB-O 3.49Å; L359-P404 HydrophobicContact CD2-CB 4.42Å; L359-P404 HydrophobicContact CG-CB 4.3Å; L359-P404 PolarHBondContact N-O 2.92Å; L359-I407 HydrophobicContact CB-CB 4.07Å; L359-I407 HydrophobicContact CB-CG2 4.27Å; L359-I407 HydrophobicContact CD2-CB 4.27Å; L359-I407 HydrophobicContact CD2-CD1 4.04Å; L359-I407 HydrophobicContact CD2-CG2 4.3Å; L359-I407 PolarHBondContact N-O 3.43Å; L359-I409 HydrophobicContact CD1-CD1 4.43Å; L359-Y432 HydrophobicContact CD1-CE1 4.15Å; L359-T479 HydrophobicContact CD2-CG2 3.91Å; L359-T483 HydrophobicContact CD1-CG2 3.89Å; L359-T483 WeakPolarHBondContact CD2-OG1 2.97Å; L359-T483 HydrophobicContact CG-CG2 4.44Å
360	S	96.3	Very high	94.4	Very high	51 Å²	51	59.6 Å²	59.6	36%	0.357	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-36	172.6	-165.7	0	0	0	0	112.6	T358 I363 A364 P404	T358-S360 PolarHBondContact O-N 3Å; T358-S360 WeakPolarHBondContact OG1-CB 3.43Å; T358-S360 PolarHBondContact OG1-N 3.15Å; S360-I363 PolarHBondContact O-N 2.99Å; S360-A364 WeakPolarHBondContact O-CB 3.49Å; S360-A364 PolarHBondContact O-N 2.82Å; S360-P404 PolarHBondContact N-O 2.81Å
361	D	95.3	Very high	94.2	Very high	90 Å²	90	60.9 Å²	60.9	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-67.8	-40.3	176.3	-56.3	-56.3	0	0	0	110.8	T358 L359 A364 D365	T358-D361 WeakPolarHBondContact CA-OD2 3.14Å; T358-D361 WeakPolarHBondContact CB-OD2 3.28Å; T358-D361 PolarHBondContact N-OD2 3.49Å; T358-D361 WeakPolarHBondContact O-CB 3.35Å; T358-D361 PolarHBondContact O-N 2.85Å; T358-D361 PolarHBondContact OG1-N 2.86Å; T358-D361 VanDerWaalsContact OG1-N 3.17Å; T358-D361 PolarHBondContact OG1-OD2 2.91Å; L359-D361 VanDerWaalsContact C-N 3.31Å; L359-D361 PolarHBondContact O-N 3.39Å; D361-A364 PolarHBondContact O-N 3.42Å; D361-D365 WeakPolarHBondContact O-CB 3.32Å; D361-D365 PolarHBondContact O-N 2.85Å
362	V	94.8	Very high	93.9	Very high	28 Å²	28	65.4 Å²	65.4	17%	0.17	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-42.4	174.7	173.5	0	0	0	0	111.5	T358 L359 D365 N366 L373 I409	T358-V362 PolarHBondContact O-N 2.98Å; L359-V362 PolarHBondContact O-N 2.99Å; V362-D365 PolarHBondContact O-N 2.97Å; V362-N366 VanDerWaalsContact O-CB 3.24Å; V362-N366 WeakPolarHBondContact O-CB 3.42Å; V362-N366 PolarHBondContact O-N 3.48Å; V362-L373 HydrophobicContact CG1-CD2 4.23Å; V362-I409 HydrophobicContact CB-CD1 4.46Å; V362-I409 HydrophobicContact CG2-CD1 3.51Å
363	I	95	Very high	93.8	Very high	40 Å²	40	64.3 Å²	64.3	21%	0.205	32%	0.32	C	S	.	.	H	α-helix	trans	-61.8	-45.5	174.7	-67.6	170	0	0	0	110.7	L359 S360 D365 N366 Y367 P404 T483	L359-I363 WeakPolarHBondContact O-CG1 3.4Å; L359-I363 PolarHBondContact O-N 2.98Å; S360-I363 PolarHBondContact O-N 2.99Å; I363-D365 VanDerWaalsContact C-N 3.31Å; I363-D365 PolarHBondContact O-N 3.41Å; I363-N366 PolarHBondContact O-N 2.66Å; I363-Y367 WeakPolarHBondContact O-CB 3.47Å; I363-Y367 PolarHBondContact O-N 2.9Å; I363-P404 HydrophobicContact CD1-CB 3.72Å; I363-P404 HydrophobicContact CD1-CG 3.69Å; I363-T483 HydrophobicContact CG1-CG2 4.5Å
364	A	94.9	Very high	93.6	Very high	56 Å²	56	63.9 Å²	63.9	46%	0.463	33%	0.326	S	S	.	.	H	α-helix	trans	-66.8	-29.8	179.7	0	0	0	0	0	113.4	S360 D361 R368	S360-A364 WeakPolarHBondContact O-CB 3.49Å; S360-A364 PolarHBondContact O-N 2.82Å; D361-A364 PolarHBondContact O-N 3.42Å; A364-R368 PolarHBondContact O-N 3.08Å; A364-R368 PolarHBondContact O-NH2 2.96Å
365	D	94	Very high	93.4	Very high	60 Å²	60	65.2 Å²	65.2	32%	0.321	33%	0.331	S	S	.	.	H	α-helix	trans	-75.5	-47.4	172.8	-163.8	72.6	0	0	0	112.3	D361 V362 I363 Y367 R368 R369	D361-D365 WeakPolarHBondContact O-CB 3.32Å; D361-D365 PolarHBondContact O-N 2.85Å; V362-D365 PolarHBondContact O-N 2.97Å; I363-D365 VanDerWaalsContact C-N 3.31Å; I363-D365 PolarHBondContact O-N 3.41Å; D365-Y367 PolarHBondContact O-N 2.79Å; D365-R368 WeakPolarHBondContact O-CB 3.43Å; D365-R368 PolarHBondContact O-N 3.22Å; D365-R368 VanDerWaalsContact O-N 3.09Å; D365-R368 IonicContact OD1-CZ 3.54Å; D365-R368 IonicContact OD1-NH1 2.68Å; D365-R368 PolarHBondContact OD1-NH1 3.21Å; D365-R368 IonicContact OD1-NH2 2.79Å; D365-R368 PolarHBondContact OD1-NH2 3.04Å; D365-R369 WeakPolarHBondContact O-CG 3.42Å; D365-R369 PolarHBondContact O-N 2.88Å; D365-R369 WeakPolarHBondContact OD2-CD 3.23Å
366	N	92.7	Very high	93.3	Very high	16 Å²	16	66.9 Å²	66.9	9%	0.086	34%	0.339	C	S	.	.	H	α-helix	trans	-55.4	-47.6	175.4	-94.2	-23.5	0	0	0	112	V362 I363 R368 R369 L370 S371	V362-N366 VanDerWaalsContact O-CB 3.24Å; V362-N366 WeakPolarHBondContact O-CB 3.42Å; V362-N366 PolarHBondContact O-N 3.48Å; I363-N366 PolarHBondContact O-N 2.66Å; N366-R368 VanDerWaalsContact C-N 3.28Å; N366-R368 PolarHBondContact O-N 2.98Å; N366-R369 CarbonylContact O-C 3.55Å; N366-R369 PolarHBondContact O-N 3.03Å; N366-L370 PolarHBondContact O-N 3.37Å; N366-S371 CarbonylContact C-O 3.59Å; N366-S371 VanDerWaalsContact CB-O 3.25Å; N366-S371 WeakPolarHBondContact CB-O 3.46Å; N366-S371 PolarHBondContact O-N 2.99Å; N366-S371 PolarHBondContact OD1-OG 2.67Å
367	Y	90.1	Very high	93.2	Very high	164 Å²	164	70 Å²	70	64%	0.643	35%	0.352	S	S	*	.	H	α-helix	trans	-60.4	-37	177.3	-163.3	-87.2	0	0	0	112.4	I363 D365 R369	I363-Y367 WeakPolarHBondContact O-CB 3.47Å; I363-Y367 PolarHBondContact O-N 2.9Å; D365-Y367 PolarHBondContact O-N 2.79Å; Y367-R369 VanDerWaalsContact C-N 3.34Å
368	R	91.9	Very high	93.3	Very high	173 Å²	173	68.8 Å²	68.8	65%	0.653	34%	0.339	S	S	*	.	H	α-helix	trans	-71.5	-28.8	176.3	-157.2	-168.4	-40.1	107.6	14.9	112.9	A364 D365 N366	A364-R368 PolarHBondContact O-N 3.08Å; A364-R368 PolarHBondContact O-NH2 2.96Å; D365-R368 WeakPolarHBondContact O-CB 3.43Å; D365-R368 PolarHBondContact O-N 3.22Å; D365-R368 VanDerWaalsContact O-N 3.09Å; D365-R368 IonicContact OD1-CZ 3.54Å; D365-R368 IonicContact OD1-NH1 2.68Å; D365-R368 PolarHBondContact OD1-NH1 3.21Å; D365-R368 IonicContact OD1-NH2 2.79Å; D365-R368 PolarHBondContact OD1-NH2 3.04Å; N366-R368 VanDerWaalsContact C-N 3.28Å; N366-R368 PolarHBondContact O-N 2.98Å
369	R	92.5	Very high	93.2	Very high	159 Å²	159	68.6 Å²	68.6	60%	0.6	34%	0.336	S	S	*	.	H	α-helix	trans	-92.2	-3.8	179.8	-70.8	176.7	60	-118.7	-9.2	113.9	D365 N366 Y367 S371	D365-R369 WeakPolarHBondContact O-CG 3.42Å; D365-R369 PolarHBondContact O-N 2.88Å; D365-R369 WeakPolarHBondContact OD2-CD 3.23Å; N366-R369 CarbonylContact O-C 3.55Å; N366-R369 PolarHBondContact O-N 3.03Å; Y367-R369 VanDerWaalsContact C-N 3.34Å; R369-S371 PolarHBondContact NH1-OG 3.22Å; R369-S371 VanDerWaalsContact NH1-OG 3.15Å; R369-S371 PolarHBondContact O-N 2.69Å
370	L	88.1	Confident	93	Very high	158 Å²	158	71.1 Å²	71.1	83%	0.827	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	34.9	-169.7	-55.6	177.8	0	0	0	112.9	N366	N366-L370 PolarHBondContact O-N 3.37Å
371	S	90.9	Very high	93.1	Very high	33 Å²	33	68.7 Å²	68.7	23%	0.231	33%	0.333	C	S	.	.			trans	-113.7	170.2	173.5	57.1	0	0	0	0	111.3	N366 R369	N366-S371 CarbonylContact C-O 3.59Å; N366-S371 VanDerWaalsContact CB-O 3.25Å; N366-S371 WeakPolarHBondContact CB-O 3.46Å; N366-S371 PolarHBondContact O-N 2.99Å; N366-S371 PolarHBondContact OD1-OG 2.67Å; R369-S371 PolarHBondContact NH1-OG 3.22Å; R369-S371 VanDerWaalsContact NH1-OG 3.15Å; R369-S371 PolarHBondContact O-N 2.69Å
372	Y	90.3	Very high	93.2	Very high	109 Å²	109	64.4 Å²	64.4	43%	0.427	31%	0.31	S	S	.	.			trans	-150.4	162.5	174.9	36.6	-106.2	0	0	0	108.5	P508 Q509	Y372-P508 HydrophobicContact CD1-CG 4.45Å; Y372-Q509 HydrophobicContact CD2-CB 3.99Å; Y372-Q509 VanDerWaalsContact CD2-CD 3.5Å; Y372-Q509 HydrophobicContact CD2-CG 4.23Å; Y372-Q509 VanDerWaalsContact CD2-NE2 3.25Å; Y372-Q509 HydrophobicContact CE1-CB 4.24Å; Y372-Q509 HydrophobicContact CE2-CB 3.46Å; Y372-Q509 VanDerWaalsContact CE2-CB 3.46Å; Y372-Q509 HydrophobicContact CE2-CG 4.18Å
373	L	92.2	Very high	93.3	Very high	14 Å²	14	63.3 Å²	63.3	7%	0.073	30%	0.303	C	S	.	.			trans	-69.8	141.1	172.8	-60.8	-165.6	0	0	0	110	V362 E377 L378 T483 Q509	V362-L373 HydrophobicContact CG1-CD2 4.23Å; L373-E377 HydrophobicContact CB-CB 3.97Å; L373-E377 HydrophobicContact CD1-CB 4.26Å; L373-L378 HydrophobicContact CB-CD2 4.06Å; L373-L378 HydrophobicContact CB-CG 4.13Å; L373-T483 HydrophobicContact CB-CG2 4.32Å; L373-T483 HydrophobicContact CD1-CG2 3.46Å; L373-T483 VanDerWaalsContact CD1-CG2 3.46Å; L373-T483 HydrophobicContact CG-CG2 3.82Å; L373-Q509 PolarHBondContact O-NE2 2.96Å; L373-Q509 PolarHBondContact O-OE1 3.44Å
374	S	92.8	Very high	93.3	Very high	48 Å²	48	62 Å²	62	34%	0.336	30%	0.296	S	S	.	.			trans	-68.3	162.5	175.9	66	0	0	0	0	112.3	L376 E377 L378	S374-L376 PolarHBondContact O-N 2.85Å; S374-L376 VanDerWaalsContact O-N 3.13Å; S374-E377 VanDerWaalsContact CB-OE2 3.27Å; S374-E377 WeakPolarHBondContact CB-OE2 2.95Å; S374-E377 PolarHBondContact N-OE2 2.95Å; S374-E377 PolarHBondContact O-N 3.26Å; S374-E377 VanDerWaalsContact O-N 3.11Å; S374-E377 WeakPolarHBondContact OG-CG 3.38Å; S374-E377 PolarHBondContact OG-N 2.67Å; S374-E377 PolarHBondContact OG-OE2 2.9Å; S374-L378 VanDerWaalsContact O-CG 3.31Å; S374-L378 WeakPolarHBondContact O-CG 3.38Å; S374-L378 PolarHBondContact O-N 3.06Å
375	E	93.3	Very high	93.5	Very high	39 Å²	39	59.4 Å²	59.4	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-54.9	-32.9	175.8	-173.9	172.8	157.1	0	0	113.2	K379 L511 S512 F515	E375-K379 HydrophobicContact CG-CD 4.09Å; E375-K379 HydrophobicContact CG-CG 4.45Å; E375-K379 WeakPolarHBondContact O-CB 3.37Å; E375-K379 VanDerWaalsContact O-CG 3.22Å; E375-K379 WeakPolarHBondContact O-CG 3.17Å; E375-K379 PolarHBondContact O-N 2.97Å; E375-K379 WeakPolarHBondContact OE1-CE 3.37Å; E375-K379 IonicContact OE1-NZ 3.77Å; E375-K379 PolarHBondContact OE1-NZ 3.41Å; E375-L511 HydrophobicContact CB-CD2 3.73Å; E375-L511 HydrophobicContact CG-CD2 4.02Å; E375-L511 WeakPolarHBondContact OE2-CA 3.38Å; E375-S512 VanDerWaalsContact OE1-CB 3.25Å; E375-S512 WeakPolarHBondContact OE1-CB 3.48Å; E375-S512 PolarHBondContact OE1-OG 3.38Å; E375-S512 PolarHBondContact OE2-N 3.41Å; E375-F515 HydrophobicContact CG-CD1 3.79Å; E375-F515 HydrophobicContact CG-CE1 4.19Å; E375-F515 HydrophobicContact CG-CG 4.41Å
376	L	91.1	Very high	93.7	Very high	110 Å²	110	56.5 Å²	56.5	58%	0.576	26%	0.259	S	S	*	.	H	α-helix	trans	-65.9	-47.7	177.5	-173.8	68	0	0	0	111.4	S374 K379 D380 A545	S374-L376 PolarHBondContact O-N 2.85Å; S374-L376 VanDerWaalsContact O-N 3.13Å; L376-K379 PolarHBondContact O-N 2.9Å; L376-D380 PolarHBondContact O-N 2.98Å; L376-A545 HydrophobicContact CD1-CB 3.73Å
377	E	93.3	Very high	93.9	Very high	74 Å²	74	60.3 Å²	60.3	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-67	-37.3	177.5	-67.4	163.3	104.8	0	0	112	L373 S374 D380 L381	L373-E377 HydrophobicContact CB-CB 3.97Å; L373-E377 HydrophobicContact CD1-CB 4.26Å; S374-E377 VanDerWaalsContact CB-OE2 3.27Å; S374-E377 WeakPolarHBondContact CB-OE2 2.95Å; S374-E377 PolarHBondContact N-OE2 2.95Å; S374-E377 PolarHBondContact O-N 3.26Å; S374-E377 VanDerWaalsContact O-N 3.11Å; S374-E377 WeakPolarHBondContact OG-CG 3.38Å; S374-E377 PolarHBondContact OG-N 2.67Å; S374-E377 PolarHBondContact OG-OE2 2.9Å; E377-D380 PolarHBondContact O-N 3.41Å; E377-L381 VanDerWaalsContact O-CB 3.26Å; E377-L381 WeakPolarHBondContact O-CB 3.41Å; E377-L381 PolarHBondContact O-N 3.32Å
378	L	95.8	Very high	94.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-36.5	175	-67.6	170.7	0	0	0	112.1	L373 S374 L382 V480 T483 L511 F515	L373-L378 HydrophobicContact CB-CD2 4.06Å; L373-L378 HydrophobicContact CB-CG 4.13Å; S374-L378 VanDerWaalsContact O-CG 3.31Å; S374-L378 WeakPolarHBondContact O-CG 3.38Å; S374-L378 PolarHBondContact O-N 3.06Å; L378-L382 WeakPolarHBondContact O-CB 3.46Å; L378-L382 PolarHBondContact O-N 3.12Å; L378-V480 HydrophobicContact CB-CG1 4.18Å; L378-V480 HydrophobicContact CD2-CG1 4.14Å; L378-T483 HydrophobicContact CD2-CG2 3.76Å; L378-L511 HydrophobicContact CD1-CD1 4.48Å; L378-L511 HydrophobicContact CD1-CD2 4.03Å; L378-F515 HydrophobicContact CB-CE1 3.88Å; L378-F515 HydrophobicContact CB-CZ 3.89Å; L378-F515 HydrophobicContact CD1-CE1 4.39Å
379	K	95.5	Very high	94.6	Very high	19 Å²	19	44.3 Å²	44.3	8%	0.083	21%	0.21	C	C	.	.	H	α-helix	trans	-70.2	-42	174.1	-76.3	171.2	178.1	177.1	0	112.3	E375 L376 L382 L383 F515 V541 L542 A545	E375-K379 HydrophobicContact CG-CD 4.09Å; E375-K379 HydrophobicContact CG-CG 4.45Å; E375-K379 WeakPolarHBondContact O-CB 3.37Å; E375-K379 VanDerWaalsContact O-CG 3.22Å; E375-K379 WeakPolarHBondContact O-CG 3.17Å; E375-K379 PolarHBondContact O-N 2.97Å; E375-K379 WeakPolarHBondContact OE1-CE 3.37Å; E375-K379 IonicContact OE1-NZ 3.77Å; E375-K379 PolarHBondContact OE1-NZ 3.41Å; L376-K379 PolarHBondContact O-N 2.9Å; K379-L382 PolarHBondContact O-N 3.09Å; K379-L383 VanDerWaalsContact O-CB 3.26Å; K379-L383 WeakPolarHBondContact O-CB 3.09Å; K379-L383 PolarHBondContact O-N 3.25Å; K379-F515 HydrophobicContact CG-CD2 3.88Å; K379-F515 HydrophobicContact CG-CE1 4.43Å; K379-F515 HydrophobicContact CG-CE2 3.63Å; K379-F515 HydrophobicContact CG-CG 4.39Å; K379-F515 HydrophobicContact CG-CZ 3.93Å; K379-V541 WeakPolarHBondContact CD-O 3.34Å; K379-V541 WeakPolarHBondContact CE-O 3.07Å; K379-L542 HydrophobicContact CB-CD2 4.14Å; K379-L542 HydrophobicContact CG-CD2 3.89Å; K379-A545 HydrophobicContact CB-CB 3.57Å; K379-A545 HydrophobicContact CD-CB 4.03Å; K379-A545 HydrophobicContact CG-CB 4.44Å
380	D	93.4	Very high	94.9	Very high	53 Å²	53	41.1 Å²	41.1	28%	0.283	20%	0.201	S	C	.	.	H	α-helix	trans	-64.6	-46.7	175	177.6	60.5	0	0	0	111.5	L376 E377 L382 L383 Q384	L376-D380 PolarHBondContact O-N 2.98Å; E377-D380 PolarHBondContact O-N 3.41Å; D380-L382 VanDerWaalsContact C-N 3.34Å; D380-L382 PolarHBondContact O-N 3.37Å; D380-L383 PolarHBondContact O-N 3.33Å; D380-L383 VanDerWaalsContact O-N 3.12Å; D380-Q384 WeakPolarHBondContact O-CB 3.24Å; D380-Q384 WeakPolarHBondContact O-CG 3.44Å; D380-Q384 PolarHBondContact O-N 3.5Å; D380-Q384 WeakPolarHBondContact OD1-CG 3.43Å; D380-Q384 PolarHBondContact OD1-NE2 2.94Å; D380-Q384 PolarHBondContact OD2-NE2 3.37Å
381	L	96.6	Very high	95.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-49.9	-53.2	170.7	167.8	65.7	0	0	0	111.4	L359 E377 L383 Q384 V385 I407 Y432 V480 T483	L359-L381 HydrophobicContact CD1-CD1 4.45Å; L359-L381 HydrophobicContact CD1-CD2 4.32Å; L359-L381 HydrophobicContact CD2-CD1 3.83Å; L359-L381 HydrophobicContact CD2-CD2 3.82Å; L359-L381 HydrophobicContact CD2-CG 4.48Å; E377-L381 VanDerWaalsContact O-CB 3.26Å; E377-L381 WeakPolarHBondContact O-CB 3.41Å; E377-L381 PolarHBondContact O-N 3.32Å; L381-L383 VanDerWaalsContact C-N 3.33Å; L381-L383 PolarHBondContact O-N 2.79Å; L381-Q384 PolarHBondContact O-N 3.06Å; L381-V385 HydrophobicContact CD1-CG2 3.77Å; L381-V385 WeakPolarHBondContact O-CB 3.25Å; L381-V385 VanDerWaalsContact O-CG2 3.23Å; L381-V385 WeakPolarHBondContact O-CG2 3.5Å; L381-V385 PolarHBondContact O-N 3.38Å; L381-I407 HydrophobicContact CD1-CG2 4.34Å; L381-Y432 HydrophobicContact CB-CD2 4.27Å; L381-Y432 HydrophobicContact CB-CE2 3.95Å; L381-Y432 HydrophobicContact CD1-CD1 3.62Å; L381-Y432 HydrophobicContact CD1-CD2 4.11Å; L381-Y432 HydrophobicContact CD1-CE1 3.86Å; L381-Y432 HydrophobicContact CD1-CE2 4.32Å; L381-Y432 HydrophobicContact CD1-CG 3.76Å; L381-V480 HydrophobicContact CD2-CG2 4.28Å; L381-V480 HydrophobicContact CG-CG2 4.5Å; L381-T483 HydrophobicContact CD2-CG2 3.89Å
382	L	97.8	Very high	95.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.8	-41.8	179.6	178.9	54.1	0	0	0	111.8	L378 K379 D380 S386 L476 V480 F515 L518 L519 M522 L542	L378-L382 WeakPolarHBondContact O-CB 3.46Å; L378-L382 PolarHBondContact O-N 3.12Å; K379-L382 PolarHBondContact O-N 3.09Å; D380-L382 VanDerWaalsContact C-N 3.34Å; D380-L382 PolarHBondContact O-N 3.37Å; L382-S386 WeakPolarHBondContact O-CB 3.45Å; L382-S386 PolarHBondContact O-N 3.4Å; L382-S386 PolarHBondContact O-OG 3.36Å; L382-L476 HydrophobicContact CD1-CD1 4.32Å; L382-L476 HydrophobicContact CD1-CD2 3.7Å; L382-L476 HydrophobicContact CD1-CG 3.69Å; L382-V480 HydrophobicContact CB-CG2 4Å; L382-V480 HydrophobicContact CD1-CG2 4.2Å; L382-F515 HydrophobicContact CD2-CE2 3.96Å; L382-L518 HydrophobicContact CD2-CD2 4.26Å; L382-L519 HydrophobicContact CD2-CD2 4.44Å; L382-M522 HydrophobicContact CD1-CE 3.6Å; L382-M522 HydrophobicContact CD1-SD 4.17Å; L382-M522 HydrophobicContact CD2-SD 4.05Å; L382-L542 HydrophobicContact CB-CD1 4.46Å; L382-L542 HydrophobicContact CD2-CD1 3.9Å; L382-L542 HydrophobicContact CD2-CD2 3.91Å; L382-L542 HydrophobicContact CG-CD1 3.8Å; L382-L542 HydrophobicContact CG-CD2 4.43Å
383	L	96.3	Very high	95.9	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-69.1	-45.1	-179.6	-178.1	58.2	0	0	0	112.4	K379 D380 L381 R387 I537 L542	K379-L383 VanDerWaalsContact O-CB 3.26Å; K379-L383 WeakPolarHBondContact O-CB 3.09Å; K379-L383 PolarHBondContact O-N 3.25Å; D380-L383 PolarHBondContact O-N 3.33Å; D380-L383 VanDerWaalsContact O-N 3.12Å; L381-L383 VanDerWaalsContact C-N 3.33Å; L381-L383 PolarHBondContact O-N 2.79Å; L383-R387 VanDerWaalsContact O-CG 3.31Å; L383-R387 WeakPolarHBondContact O-CG 3.42Å; L383-R387 PolarHBondContact O-N 3.19Å; L383-I537 HydrophobicContact CD1-CB 4.34Å; L383-I537 HydrophobicContact CD1-CG1 4.45Å; L383-I537 HydrophobicContact CD1-CG2 4.12Å; L383-L542 HydrophobicContact CB-CD1 4.47Å; L383-L542 HydrophobicContact CD1-CB 4.43Å
384	Q	96.5	Very high	96.1	Very high	13 Å²	13	33.8 Å²	33.8	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-48.2	177.2	-71.5	-157.2	40.9	0	0	111.6	H333 D380 L381 S386 R387 G388 I430 V431 Y432	H333-Q384 WeakPolarHBondContact CB-O 3.26Å; H333-Q384 PolarHBondContact CE1-OE1 3.08Å; H333-Q384 VanDerWaalsContact CG-O 3.27Å; H333-Q384 PolarHBondContact ND1-OE1 3.28Å; D380-Q384 WeakPolarHBondContact O-CB 3.24Å; D380-Q384 WeakPolarHBondContact O-CG 3.44Å; D380-Q384 PolarHBondContact O-N 3.5Å; D380-Q384 WeakPolarHBondContact OD1-CG 3.43Å; D380-Q384 PolarHBondContact OD1-NE2 2.94Å; D380-Q384 PolarHBondContact OD2-NE2 3.37Å; L381-Q384 PolarHBondContact O-N 3.06Å; Q384-S386 VanDerWaalsContact C-N 3.35Å; Q384-S386 PolarHBondContact O-N 2.68Å; Q384-R387 WeakPolarHBondContact O-CB 3.4Å; Q384-R387 PolarHBondContact O-N 2.76Å; Q384-R387 VanDerWaalsContact O-N 3.17Å; Q384-G388 PolarHBondContact O-N 2.73Å; Q384-G388 VanDerWaalsContact O-N 3.09Å; Q384-I430 PolarHBondContact NE2-O 2.79Å; Q384-V431 VanDerWaalsContact OE1-CA 3.31Å; Q384-Y432 HydrophobicContact CB-CD2 4.16Å; Q384-Y432 HydrophobicContact CG-CD2 4.29Å
385	V	98.3	Very high	96.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-69.9	-34.5	180	-179.1	0	0	0	0	110.9	L381 R387 G388 L389 I407 I434 L476	L381-V385 HydrophobicContact CD1-CG2 3.77Å; L381-V385 WeakPolarHBondContact O-CB 3.25Å; L381-V385 VanDerWaalsContact O-CG2 3.23Å; L381-V385 WeakPolarHBondContact O-CG2 3.5Å; L381-V385 PolarHBondContact O-N 3.38Å; V385-R387 PolarHBondContact O-N 3.34Å; V385-G388 WeakPolarHBondContact O-CA 3.38Å; V385-G388 PolarHBondContact O-N 2.8Å; V385-G388 VanDerWaalsContact O-N 3.1Å; V385-L389 PolarHBondContact O-N 2.9Å; V385-I407 HydrophobicContact CG1-CD1 4.09Å; V385-I407 HydrophobicContact CG2-CD1 3.97Å; V385-I407 HydrophobicContact CG2-CG2 4.09Å; V385-I434 HydrophobicContact CG1-CD1 3.99Å; V385-I434 HydrophobicContact CG1-CG1 3.92Å; V385-L476 HydrophobicContact CB-CD1 3.9Å; V385-L476 HydrophobicContact CB-CD2 4.38Å; V385-L476 HydrophobicContact CG1-CD1 3.51Å; V385-L476 HydrophobicContact CG1-CD2 4.05Å; V385-L476 HydrophobicContact CG1-CG 4.43Å
386	S	98.3	Very high	96.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60	-42.9	169.4	-64.5	0	0	0	0	111.8	L382 Q384 G388 L389 K390 V533	L382-S386 WeakPolarHBondContact O-CB 3.45Å; L382-S386 PolarHBondContact O-N 3.4Å; L382-S386 PolarHBondContact O-OG 3.36Å; Q384-S386 VanDerWaalsContact C-N 3.35Å; Q384-S386 PolarHBondContact O-N 2.68Å; S386-G388 VanDerWaalsContact C-N 3.25Å; S386-G388 PolarHBondContact O-N 3.5Å; S386-L389 PolarHBondContact O-N 2.97Å; S386-K390 WeakPolarHBondContact O-CB 3.22Å; S386-K390 PolarHBondContact O-N 3.45Å; S386-V533 WeakPolarHBondContact O-CG1 3.31Å
387	R	97.6	Very high	96.5	Very high	96 Å²	96	31.3 Å²	31.3	36%	0.362	16%	0.157	S	C	.	.	H	α-helix	trans	-58.2	-39.5	173.4	-69.1	163.6	-178	161.6	0.9	111.4	H331 L383 Q384 V385 Y391 I537	H331-R387 PolarHBondContact CE1-O 2.98Å; H331-R387 VanDerWaalsContact CE1-O 3.23Å; L383-R387 VanDerWaalsContact O-CG 3.31Å; L383-R387 WeakPolarHBondContact O-CG 3.42Å; L383-R387 PolarHBondContact O-N 3.19Å; Q384-R387 WeakPolarHBondContact O-CB 3.4Å; Q384-R387 PolarHBondContact O-N 2.76Å; Q384-R387 VanDerWaalsContact O-N 3.17Å; V385-R387 PolarHBondContact O-N 3.34Å; R387-Y391 PolarHBondContact O-N 3.31Å; R387-I537 HydrophobicContact CB-CD1 4.5Å; R387-I537 HydrophobicContact CG-CD1 4.12Å; R387-I537 HydrophobicContact CG-CG1 4.26Å; R387-I537 HydrophobicContact CG-CG2 4.41Å
388	G	97.9	Very high	96.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.8	-54	172.6	0	0	0	0	0	113.2	Q384 V385 S386 K390 Y391 I392	Q384-G388 PolarHBondContact O-N 2.73Å; Q384-G388 VanDerWaalsContact O-N 3.09Å; V385-G388 WeakPolarHBondContact O-CA 3.38Å; V385-G388 PolarHBondContact O-N 2.8Å; V385-G388 VanDerWaalsContact O-N 3.1Å; S386-G388 VanDerWaalsContact C-N 3.25Å; S386-G388 PolarHBondContact O-N 3.5Å; G388-K390 PolarHBondContact O-N 3.28Å; G388-Y391 WeakPolarHBondContact O-CB 3.46Å; G388-Y391 PolarHBondContact O-N 3.15Å; G388-Y391 VanDerWaalsContact O-N 3.15Å; G388-I392 PolarHBondContact O-N 2.83Å
389	L	98.3	Very high	96.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.7	-40.8	178.5	-80.3	-179.2	0	0	0	112.5	V385 S386 Y391 I392 H393 H399 I402 I434 D472 L476 V533	V385-L389 PolarHBondContact O-N 2.9Å; S386-L389 PolarHBondContact O-N 2.97Å; L389-Y391 PolarHBondContact O-N 2.87Å; L389-I392 PolarHBondContact O-N 3.2Å; L389-I392 VanDerWaalsContact O-N 3.13Å; L389-H393 WeakPolarHBondContact O-CB 3.44Å; L389-H393 PolarHBondContact O-CD2 3.13Å; L389-H393 VanDerWaalsContact O-CG 3.23Å; L389-H393 PolarHBondContact O-N 3.2Å; L389-H399 HydrophobicContact CD2-CB 4.12Å; L389-I402 HydrophobicContact CD2-CD1 3.84Å; L389-I402 HydrophobicContact CD2-CG1 4.06Å; L389-I402 HydrophobicContact CG-CD1 4.45Å; L389-I434 HydrophobicContact CB-CD1 4.45Å; L389-I434 HydrophobicContact CD2-CD1 3.99Å; L389-I434 HydrophobicContact CG-CD1 3.83Å; L389-D472 HydrophobicContact CD1-CB 3.92Å; L389-D472 HydrophobicContact CD2-CB 3.87Å; L389-L476 HydrophobicContact CD1-CB 4.38Å; L389-L476 HydrophobicContact CD1-CD2 3.77Å; L389-V533 HydrophobicContact CB-CG1 3.89Å; L389-V533 HydrophobicContact CB-CG2 4.14Å; L389-V533 HydrophobicContact CD1-CG2 4.48Å
390	K	97.9	Very high	96.7	Very high	92 Å²	92	27.6 Å²	27.6	40%	0.4	14%	0.14	S	C	.	.	H	α-helix	trans	-58	-38.5	176.5	177	178.2	173	-172.3	0	111.6	S386 G388 S394 V533 S534 I537	S386-K390 WeakPolarHBondContact O-CB 3.22Å; S386-K390 PolarHBondContact O-N 3.45Å; G388-K390 PolarHBondContact O-N 3.28Å; K390-S394 VanDerWaalsContact O-CB 3.31Å; K390-S394 WeakPolarHBondContact O-CB 3.47Å; K390-S394 PolarHBondContact O-N 2.57Å; K390-S394 PolarHBondContact O-OG 3.28Å; K390-V533 HydrophobicContact CB-CB 4.41Å; K390-V533 HydrophobicContact CB-CG1 3.98Å; K390-S534 WeakPolarHBondContact CE-OG 3.43Å; K390-I537 HydrophobicContact CB-CD1 3.69Å; K390-I537 HydrophobicContact CD-CD1 3.56Å; K390-I537 HydrophobicContact CG-CD1 4.23Å
391	Y	97.6	Very high	96.8	Very high	50 Å²	50	25.2 Å²	25.2	20%	0.196	13%	0.128	C	C	.	.	H	α-helix	trans	-64.3	-49	175.4	178.7	-114.8	0	0	0	111.3	L328 G329 H331 V334 R387 G388 L389 H393 S394 M395	L328-Y391 HydrophobicContact CB-CE1 4.21Å; L328-Y391 HydrophobicContact CD2-CD1 4.02Å; L328-Y391 HydrophobicContact CD2-CE1 3.71Å; G329-Y391 WeakPolarHBondContact CA-OH 3.42Å; G329-Y391 PolarHBondContact N-OH 3.47Å; H331-Y391 HydrophobicContact CB-CD1 3.43Å; H331-Y391 VanDerWaalsContact CB-CD1 3.43Å; H331-Y391 HydrophobicContact CB-CE1 3.68Å; H331-Y391 HydrophobicContact CB-CG 3.89Å; H331-Y391 AromaticContact CD2-CG 3.8Å; H331-Y391 AromaticContact CG-CD1 3.7Å; H331-Y391 AromaticContact CG-CG 3.69Å; V334-Y391 HydrophobicContact CG2-CD1 4.24Å; R387-Y391 PolarHBondContact O-N 3.31Å; G388-Y391 WeakPolarHBondContact O-CB 3.46Å; G388-Y391 PolarHBondContact O-N 3.15Å; G388-Y391 VanDerWaalsContact O-N 3.15Å; L389-Y391 PolarHBondContact O-N 2.87Å; Y391-H393 PolarHBondContact O-N 3.42Å; Y391-S394 PolarHBondContact O-N 3Å; Y391-S394 PolarHBondContact O-OG 2.74Å; Y391-M395 PolarHBondContact O-N 2.77Å
392	I	96.9	Very high	96.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.6	-48.9	178.2	-62.1	169.5	0	0	0	111	L328 V334 G388 L389 S394 M395 L397 I434	L328-I392 HydrophobicContact CD1-CG1 4.2Å; L328-I392 HydrophobicContact CD2-CB 4.44Å; L328-I392 HydrophobicContact CD2-CG1 4.1Å; V334-I392 HydrophobicContact CG2-CD1 4.23Å; V334-I392 HydrophobicContact CG2-CG1 4.24Å; G388-I392 PolarHBondContact O-N 2.83Å; L389-I392 PolarHBondContact O-N 3.2Å; L389-I392 VanDerWaalsContact O-N 3.13Å; I392-S394 VanDerWaalsContact C-N 3.31Å; I392-S394 PolarHBondContact O-N 2.89Å; I392-M395 PolarHBondContact O-N 3.41Å; I392-M395 VanDerWaalsContact O-N 3.08Å; I392-L397 CarbonylContact C-O 3.58Å; I392-L397 HydrophobicContact CG2-CB 3.8Å; I392-L397 PolarHBondContact O-N 2.86Å; I392-I434 HydrophobicContact CD1-CD1 4.06Å; I392-I434 HydrophobicContact CD1-CG2 4.14Å
393	H	96.9	Very high	96.9	Very high	32 Å²	32	26.7 Å²	26.7	15%	0.148	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-34.4	178.3	-64.2	177.6	0	0	0	112.6	L389 Y391 M395 S396 L397 T469 D472 V533	L389-H393 WeakPolarHBondContact O-CB 3.44Å; L389-H393 PolarHBondContact O-CD2 3.13Å; L389-H393 VanDerWaalsContact O-CG 3.23Å; L389-H393 PolarHBondContact O-N 3.2Å; Y391-H393 PolarHBondContact O-N 3.42Å; H393-M395 PolarHBondContact O-N 2.83Å; H393-S396 PolarHBondContact O-N 2.96Å; H393-L397 WeakPolarHBondContact CA-O 3.28Å; H393-L397 PolarHBondContact CD2-O 3.42Å; H393-T469 HydrophobicContact CB-CG2 4.28Å; H393-T469 PolarHBondContact CE1-O 3.28Å; H393-T469 VanDerWaalsContact CE1-O 3.25Å; H393-D472 IonicContact CD2-OD2 2.64Å; H393-D472 IonicContact CE1-OD2 2.69Å; H393-D472 IonicContact NE2-OD2 2.72Å; H393-D472 PolarHBondContact NE2-OD2 2.75Å; H393-V533 WeakPolarHBondContact ND1-CG2 3.15Å
394	S	95.9	Very high	96.9	Very high	79 Å²	79	26.8 Å²	26.8	55%	0.552	14%	0.135	S	C	*	.	H	α-helix	trans	-66.4	-20.4	176	73.3	0	0	0	0	113.9	K390 Y391 I392 S396	K390-S394 VanDerWaalsContact O-CB 3.31Å; K390-S394 WeakPolarHBondContact O-CB 3.47Å; K390-S394 PolarHBondContact O-N 2.57Å; K390-S394 PolarHBondContact O-OG 3.28Å; Y391-S394 PolarHBondContact O-N 3Å; Y391-S394 PolarHBondContact O-OG 2.74Å; I392-S394 VanDerWaalsContact C-N 3.31Å; I392-S394 PolarHBondContact O-N 2.89Å; S394-S396 VanDerWaalsContact C-N 3.3Å
395	M	95.4	Very high	96.9	Very high	76 Å²	76	28.3 Å²	28.3	37%	0.374	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	12.7	172.8	-60.1	-57.1	-63.6	0	0	113.1	V327 L328 Y391 I392 H393 L397	V327-M395 HydrophobicContact CG1-CB 4.26Å; V327-M395 HydrophobicContact CG1-CE 3.79Å; L328-M395 HydrophobicContact CD2-CB 4.23Å; L328-M395 HydrophobicContact CD2-CG 3.97Å; Y391-M395 PolarHBondContact O-N 2.77Å; I392-M395 PolarHBondContact O-N 3.41Å; I392-M395 VanDerWaalsContact O-N 3.08Å; H393-M395 PolarHBondContact O-N 2.83Å; M395-L397 HydrophobicContact CB-CD1 4.41Å; M395-L397 HydrophobicContact CB-CG 4.44Å; M395-L397 PolarHBondContact O-N 3.36Å
396	S	94.6	Very high	96.8	Very high	63 Å²	63	28.5 Å²	28.5	44%	0.441	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	28	-174	-55.8	0	0	0	0	114.4	H393 S394 V443	H393-S396 PolarHBondContact O-N 2.96Å; S394-S396 VanDerWaalsContact C-N 3.3Å; S396-V443 PolarHBondContact O-N 2.93Å
397	L	95.6	Very high	96.8	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.026	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	160	173.9	-62.8	176.1	0	0	0	110.7	V327 L328 I392 H393 M395 V440 T441 R442	V327-L397 HydrophobicContact CB-CD1 4.24Å; V327-L397 HydrophobicContact CG1-CD1 3.95Å; L328-L397 HydrophobicContact CD1-CD1 4.16Å; L328-L397 HydrophobicContact CD2-CD1 4.18Å; L328-L397 HydrophobicContact CG-CD1 3.94Å; I392-L397 CarbonylContact C-O 3.58Å; I392-L397 HydrophobicContact CG2-CB 3.8Å; I392-L397 PolarHBondContact O-N 2.86Å; H393-L397 WeakPolarHBondContact CA-O 3.28Å; H393-L397 PolarHBondContact CD2-O 3.42Å; M395-L397 HydrophobicContact CB-CD1 4.41Å; M395-L397 HydrophobicContact CB-CG 4.44Å; M395-L397 PolarHBondContact O-N 3.36Å; L397-V440 HydrophobicContact CB-CG1 4.04Å; L397-V440 HydrophobicContact CD1-CG1 4.04Å; L397-V440 HydrophobicContact CD2-CG1 4.11Å; L397-V440 HydrophobicContact CG-CG1 4.29Å; L397-T441 WeakPolarHBondContact CA-O 3.45Å; L397-R442 HydrophobicContact CD2-CG 3.97Å
398	V	96.4	Very high	96.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.9	171	-77.4	0	0	0	0	109.7	M400 V440 T441 V443 L468 T469	V398-M400 HydrophobicContact CB-CG 4.48Å; V398-M400 HydrophobicContact CB-SD 4.19Å; V398-M400 HydrophobicContact CG2-CG 4Å; V398-M400 HydrophobicContact CG2-SD 3.83Å; V398-V440 WeakPolarHBondContact O-CA 3.4Å; V398-T441 HydrophobicContact CG2-CG2 3.73Å; V398-T441 WeakPolarHBondContact CG2-O 3.46Å; V398-T441 PolarHBondContact N-O 2.95Å; V398-T441 PolarHBondContact O-N 3.1Å; V398-V443 HydrophobicContact CG1-CG2 3.8Å; V398-L468 HydrophobicContact CB-CB 4.31Å; V398-L468 HydrophobicContact CG1-CB 3.9Å; V398-L468 HydrophobicContact CG2-CB 3.98Å; V398-L468 HydrophobicContact CG2-CD1 3.97Å; V398-T469 HydrophobicContact CG1-CG2 3.58Å
399	H	96.8	Very high	96.8	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.145	C	C	.	.			trans	-87	-37.5	-173.1	-165.6	-85.1	0	0	0	113.5	L389 D401 I402 I434 G435 L437 D472	L389-H399 HydrophobicContact CD2-CB 4.12Å; H399-D401 PolarHBondContact CE1-O 2.94Å; H399-D401 VanDerWaalsContact CE1-O 3.32Å; H399-D401 VanDerWaalsContact ND1-C 3.35Å; H399-D401 PolarHBondContact ND1-O 3.22Å; H399-D401 PolarHBondContact O-N 2.77Å; H399-I402 HydrophobicContact CB-CD1 3.82Å; H399-I402 HydrophobicContact CB-CG1 3.87Å; H399-I402 WeakPolarHBondContact ND1-CD1 3.45Å; H399-I434 WeakPolarHBondContact CD2-CG2 3.35Å; H399-I434 WeakPolarHBondContact NE2-CG2 3.41Å; H399-G435 PolarHBondContact NE2-O 2.88Å; H399-L437 WeakPolarHBondContact NE2-CD2 3.32Å; H399-D472 WeakPolarHBondContact CB-OD1 3.37Å; H399-D472 PolarHBondContact N-OD1 3.34Å; H399-D472 PolarHBondContact N-OD2 2.9Å
400	M	95.4	Very high	96.6	Very high	14 Å²	14	28.1 Å²	28.1	7%	0.069	15%	0.152	C	C	.	.	S	Bend	trans	64.6	-26.9	178.2	-58.1	-54.2	-59.1	0	0	116.6	V398 H439 T441 V448 V460 L468 D472	V398-M400 HydrophobicContact CB-CG 4.48Å; V398-M400 HydrophobicContact CB-SD 4.19Å; V398-M400 HydrophobicContact CG2-CG 4Å; V398-M400 HydrophobicContact CG2-SD 3.83Å; M400-H439 HydrophobicContact CB-CB 4.12Å; M400-T441 HydrophobicContact CG-CG2 4.18Å; M400-V448 HydrophobicContact CE-CG1 4.08Å; M400-V460 HydrophobicContact CE-CG1 3.71Å; M400-V460 HydrophobicContact CE-CG2 4.12Å; M400-L468 HydrophobicContact CE-CD2 3.81Å; M400-L468 HydrophobicContact SD-CB 4.14Å; M400-L468 HydrophobicContact SD-CD1 4.2Å; M400-L468 HydrophobicContact SD-CD2 3.92Å; M400-L468 HydrophobicContact SD-CG 4.31Å; M400-D472 PolarHBondContact N-OD1 2.98Å
401	D	95.7	Very high	96.3	Very high	4 Å²	4	29 Å²	29	2%	0.021	15%	0.153	C	C	.	.			trans	-123.4	57	180	-166.5	44.9	0	0	0	112	H399 K403 N406 H439 D452	H399-D401 PolarHBondContact CE1-O 2.94Å; H399-D401 VanDerWaalsContact CE1-O 3.32Å; H399-D401 VanDerWaalsContact ND1-C 3.35Å; H399-D401 PolarHBondContact ND1-O 3.22Å; H399-D401 PolarHBondContact O-N 2.77Å; D401-K403 WeakPolarHBondContact OD1-CD 3.46Å; D401-K403 WeakPolarHBondContact OD1-CE 3.41Å; D401-K403 IonicContact OD1-NZ 2.67Å; D401-K403 PolarHBondContact OD1-NZ 3.32Å; D401-K403 WeakPolarHBondContact OD2-CE 3.49Å; D401-K403 IonicContact OD2-NZ 3.38Å; D401-K403 PolarHBondContact OD2-NZ 2.93Å; D401-N406 PolarHBondContact O-ND2 3.49Å; D401-N406 PolarHBondContact OD2-ND2 2.83Å; D401-H439 HydrophobicContact CB-CB 4.02Å; D401-H439 IonicContact OD2-CD2 3.04Å; D401-D452 PolarHBondContact OD1-N 2.72Å
402	I	98.3	Very high	95.6	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.168	C	C	.	.			trans	-81.5	113.6	173.8	-66	-69.5	0	0	0	109.7	L389 H399 I434 A475 L476	L389-I402 HydrophobicContact CD2-CD1 3.84Å; L389-I402 HydrophobicContact CD2-CG1 4.06Å; L389-I402 HydrophobicContact CG-CD1 4.45Å; H399-I402 HydrophobicContact CB-CD1 3.82Å; H399-I402 HydrophobicContact CB-CG1 3.87Å; H399-I402 WeakPolarHBondContact ND1-CD1 3.45Å; I402-I434 HydrophobicContact CD1-CD1 4.18Å; I402-I434 HydrophobicContact CD1-CG1 4.38Å; I402-I434 HydrophobicContact CD1-CG2 3.86Å; I402-A475 HydrophobicContact CB-CB 3.95Å; I402-A475 HydrophobicContact CG2-CB 4.42Å; I402-L476 HydrophobicContact CG2-CB 4.12Å; I402-L476 HydrophobicContact CG2-CD1 4.43Å
403	K	97.6	Very high	94.3	Very high	30 Å²	30	36.1 Å²	36.1	13%	0.13	20%	0.195	C	C	.	.	S	Bend	trans	-157.9	163.7	-179.7	63	-169.1	-179.7	-153	0	111.2	D401 S405 N406 I407 D452 Y455 T479	D401-K403 WeakPolarHBondContact OD1-CD 3.46Å; D401-K403 WeakPolarHBondContact OD1-CE 3.41Å; D401-K403 IonicContact OD1-NZ 2.67Å; D401-K403 PolarHBondContact OD1-NZ 3.32Å; D401-K403 WeakPolarHBondContact OD2-CE 3.49Å; D401-K403 IonicContact OD2-NZ 3.38Å; D401-K403 PolarHBondContact OD2-NZ 2.93Å; K403-S405 VanDerWaalsContact C-N 3.27Å; K403-S405 VanDerWaalsContact CE-OG 3.25Å; K403-S405 WeakPolarHBondContact CE-OG 3.42Å; K403-S405 WeakPolarHBondContact CG-OG 3.43Å; K403-S405 PolarHBondContact O-N 2.79Å; K403-S405 VanDerWaalsContact O-N 3.13Å; K403-N406 WeakPolarHBondContact CE-OD1 3.41Å; K403-N406 HydrophobicContact CG-CB 4.22Å; K403-N406 PolarHBondContact O-N 2.88Å; K403-I407 PolarHBondContact O-N 2.82Å; K403-D452 HydrophobicContact CD-CB 3.58Å; K403-Y455 HydrophobicContact CB-CD1 4.29Å; K403-Y455 HydrophobicContact CB-CD2 3.68Å; K403-Y455 HydrophobicContact CB-CE1 4.33Å; K403-Y455 HydrophobicContact CB-CE2 3.71Å; K403-Y455 HydrophobicContact CB-CG 4Å; K403-T479 WeakPolarHBondContact CA-OG1 3.37Å
404	P	97.7	Very high	92.3	Very high	5 Å²	5	37.9 Å²	37.9	3%	0.032	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-56.4	-28.8	-177.1	-25.8	31.7	0	0	0	116.4	L359 S360 I363 N406 Y455 T479	L359-P404 HydrophobicContact CB-CB 4.22Å; L359-P404 WeakPolarHBondContact CB-O 3.49Å; L359-P404 HydrophobicContact CD2-CB 4.42Å; L359-P404 HydrophobicContact CG-CB 4.3Å; L359-P404 PolarHBondContact N-O 2.92Å; S360-P404 PolarHBondContact N-O 2.81Å; I363-P404 HydrophobicContact CD1-CB 3.72Å; I363-P404 HydrophobicContact CD1-CG 3.69Å; P404-N406 PolarHBondContact O-N 2.86Å; P404-Y455 VanDerWaalsContact CD-CZ 3.43Å; P404-Y455 WeakPolarHBondContact CD-OH 3.2Å; P404-Y455 HydrophobicContact CG-CE1 4.46Å; P404-T479 HydrophobicContact CG-CG2 4.01Å
405	S	95.7	Very high	90.1	Very high	46 Å²	46	37.8 Å²	37.8	32%	0.322	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-70.6	-21.6	176.2	55.7	0	0	0	0	113.2	T358 K403	T358-S405 WeakPolarHBondContact CG2-O 3.35Å; K403-S405 VanDerWaalsContact C-N 3.27Å; K403-S405 VanDerWaalsContact CE-OG 3.25Å; K403-S405 WeakPolarHBondContact CE-OG 3.42Å; K403-S405 WeakPolarHBondContact CG-OG 3.43Å; K403-S405 PolarHBondContact O-N 2.79Å; K403-S405 VanDerWaalsContact O-N 3.13Å
406	N	96.9	Very high	87.7	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.027	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-103.7	-0.3	-172.7	-60.9	21.2	0	0	0	111.6	D401 K403 P404 G435	D401-N406 PolarHBondContact O-ND2 3.49Å; D401-N406 PolarHBondContact OD2-ND2 2.83Å; K403-N406 WeakPolarHBondContact CE-OD1 3.41Å; K403-N406 HydrophobicContact CG-CB 4.22Å; K403-N406 PolarHBondContact O-N 2.88Å; P404-N406 PolarHBondContact O-N 2.86Å; N406-G435 PolarHBondContact O-N 3.3Å
407	I	98.3	Very high	85	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.5	170.9	-60.6	175.2	0	0	0	107.9	T358 L359 L381 V385 K403 Y432 K433 T479	T358-I407 CarbonylContact C-O 3.57Å; T358-I407 WeakPolarHBondContact CA-O 3.25Å; L359-I407 HydrophobicContact CB-CB 4.07Å; L359-I407 HydrophobicContact CB-CG2 4.27Å; L359-I407 HydrophobicContact CD2-CB 4.27Å; L359-I407 HydrophobicContact CD2-CD1 4.04Å; L359-I407 HydrophobicContact CD2-CG2 4.3Å; L359-I407 PolarHBondContact N-O 3.43Å; L381-I407 HydrophobicContact CD1-CG2 4.34Å; V385-I407 HydrophobicContact CG1-CD1 4.09Å; V385-I407 HydrophobicContact CG2-CD1 3.97Å; V385-I407 HydrophobicContact CG2-CG2 4.09Å; K403-I407 PolarHBondContact O-N 2.82Å; I407-Y432 HydrophobicContact CG2-CD1 4.16Å; I407-K433 CarbonylContact C-O 3.6Å; I407-K433 WeakPolarHBondContact CA-O 3.5Å; I407-T479 HydrophobicContact CD1-CG2 3.51Å
408	F	97.8	Very high	82.6	Confident	60 Å²	60	47.1 Å²	47.1	26%	0.263	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	151.3	-179.9	-66.2	-93	0	0	0	111.2	V335 C354 T358 K433	V335-F408 HydrophobicContact CG2-CB 4.03Å; V335-F408 HydrophobicContact CG2-CD2 3.68Å; V335-F408 HydrophobicContact CG2-CE2 4.47Å; V335-F408 HydrophobicContact CG2-CG 4.02Å; C354-F408 HydrophobicContact CB-CB 3.74Å; C354-F408 HydrophobicContact CB-CD1 4.31Å; C354-F408 HydrophobicContact CB-CG 4.45Å; T358-F408 HydrophobicContact CG2-CD1 4.08Å; T358-F408 HydrophobicContact CG2-CE1 3.84Å; T358-F408 HydrophobicContact CG2-CZ 4.39Å; F408-K433 HydrophobicContact CB-CB 4.43Å; F408-K433 PolarHBondContact N-O 2.79Å; F408-K433 PolarHBondContact O-N 2.64Å
409	I	97.3	Very high	80.1	Confident	5 Å²	5	57 Å²	57	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.6	-175.5	-59.5	174.7	0	0	0	109.6	C354 G356 G357 L359 V362 R411 I430 Y432	C354-I409 CarbonylContact C-O 3.54Å; C354-I409 WeakPolarHBondContact CB-O 3.42Å; G356-I409 WeakPolarHBondContact CA-O 3.37Å; G356-I409 PolarHBondContact N-O 3.35Å; G357-I409 PolarHBondContact O-N 2.94Å; L359-I409 HydrophobicContact CD1-CD1 4.43Å; V362-I409 HydrophobicContact CB-CD1 4.46Å; V362-I409 HydrophobicContact CG2-CD1 3.51Å; I409-R411 HydrophobicContact CG2-CG 4.25Å; I409-I430 HydrophobicContact CG2-CG2 3.88Å; I409-Y432 HydrophobicContact CD1-CD1 4.46Å; I409-Y432 HydrophobicContact CD1-CE1 4.05Å; I409-Y432 HydrophobicContact CG1-CD1 3.91Å; I409-Y432 HydrophobicContact CG1-CE1 3.97Å
410	S	94.9	Very high	77.7	Confident	22 Å²	22	61 Å²	61	15%	0.154	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114	169.2	-178.8	0	0	0	0	109.1	N355 V431	N355-S410 WeakPolarHBondContact OD1-CA 3.5Å; S410-V431 PolarHBondContact N-O 3.42Å; S410-V431 PolarHBondContact O-N 2.88Å
411	R	91.2	Very high	75.2	Confident	110 Å²	110	68.3 Å²	68.3	42%	0.415	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	115.8	174.4	-65	-174.9	-170.3	116.9	9.6	108.9	N355 G356 I409 T428	N355-R411 PolarHBondContact ND2-O 3.41Å; N355-R411 PolarHBondContact OD1-N 3.27Å; N355-R411 PolarHBondContact OD1-O 3.23Å; G356-R411 PolarHBondContact O-NH2 3.19Å; I409-R411 HydrophobicContact CG2-CG 4.25Å; R411-T428 HydrophobicContact CB-CG2 3.77Å; R411-T428 HydrophobicContact CG-CG2 4.18Å
412	K	82.6	Confident	72.9	Confident	120 Å²	120	77.4 Å²	77.4	52%	0.522	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	115.8	171.6	-65.4	178.7	-178.9	177.7	0	109.2	V414 T428 S429 V431	K412-V414 PolarHBondContact O-N 2.99Å; K412-T428 CarbonylContact O-C 3.58Å; K412-T428 WeakPolarHBondContact O-CA 3.47Å; K412-S429 PolarHBondContact N-O 2.89Å; K412-S429 PolarHBondContact O-N 2.95Å; K412-V431 HydrophobicContact CD-CG2 4.39Å
413	S	68.3	Low	70.4	Confident	81 Å²	81	85.5 Å²	85.5	57%	0.566	47%	0.469	S	S	*	.			trans	-69	116.9	162.3	-176.4	0	0	0	0	108
414	V	56.1	Low	67.7	Low	68 Å²	68	92.2 Å²	92.2	41%	0.412	51%	0.507	S	S	.	.			trans	-88.6	104.6	165.6	-179	0	0	0	0	106.1	K412 T416	K412-V414 PolarHBondContact O-N 2.99Å; V414-T416 HydrophobicContact CG1-CG2 4.43Å; V414-T416 PolarHBondContact O-N 3.49Å; V414-T416 VanDerWaalsContact O-N 3.09Å
415	A	50.1	Low	65.1	Low	77 Å²	77	94.3 Å²	94.3	64%	0.636	53%	0.529	S	S	*	.			trans	-72.4	99	167.3	0	0	0	0	0	108	C417	A415-C417 PolarHBondContact O-N 3.22Å
416	T	45	Very low	62.5	Low	89 Å²	89	97.2 Å²	97.2	55%	0.546	54%	0.54	S	S	.	.			trans	-68.8	111.8	166.1	40.4	0	0	0	0	108.1	V414 D418	V414-T416 HydrophobicContact CG1-CG2 4.43Å; V414-T416 PolarHBondContact O-N 3.49Å; V414-T416 VanDerWaalsContact O-N 3.09Å; T416-D418 PolarHBondContact O-N 2.95Å
417	C	38.4	Very low	60.4	Low	122 Å²	122	101.2 Å²	101.2	82%	0.824	57%	0.565	S	S	*	*			trans	-80.4	34.7	-172.9	-57.6	0	0	0	0	113.5	A415	A415-C417 PolarHBondContact O-N 3.22Å
418	D	43.3	Very low	58.5	Low	129 Å²	129	104.1 Å²	104.1	69%	0.69	58%	0.583	S	S	*	*			trans	-106.9	104.8	-176.4	-67.6	-54.1	0	0	0	109.7	T416 S420	T416-D418 PolarHBondContact O-N 2.95Å; D418-S420 VanDerWaalsContact C-N 3.27Å; D418-S420 PolarHBondContact O-N 3.49Å
419	E	44.8	Very low	57.8	Low	208 Å²	208	104 Å²	104	97%	0.972	59%	0.589	S	S	*	*			trans	-77.5	77.1	171.7	-65.9	-126.6	147.4	0	0	110
420	S	47.5	Very low	57.6	Low	86 Å²	86	106.6 Å²	106.6	60%	0.601	60%	0.603	S	S	*	*			trans	-148	99.5	174.2	62	0	0	0	0	113.2	D418	D418-S420 VanDerWaalsContact C-N 3.27Å; D418-S420 PolarHBondContact O-N 3.49Å
421	D	41.8	Very low	57.6	Low	166 Å²	166	106.3 Å²	106.3	89%	0.888	60%	0.6	S	S	*	*			trans	65	171.8	158.5	-55.9	-38	0	0	0	118.8
422	E	48	Very low	57.9	Low	196 Å²	196	101.4 Å²	101.4	92%	0.916	58%	0.582	S	S	*	*	S	Bend	trans	-90.4	144.4	-158.4	-57.4	-178.3	128.9	0	0	114.4
423	D	45.9	Very low	58.6	Low	171 Å²	171	96.5 Å²	96.5	91%	0.914	56%	0.56	S	S	*	*			trans	67.7	51	160.7	-151.8	38.5	0	0	0	118.6
424	D	41.3	Very low	60	Low	171 Å²	171	92.6 Å²	92.6	91%	0.914	53%	0.533	S	S	*	.			trans	-123.7	152.4	149.7	-161.7	8.8	0	0	0	111.5
425	G	41.5	Very low	61.9	Low	48 Å²	48	89.4 Å²	89.4	50%	0.495	51%	0.514	S	S	.	.			trans	-80.8	142	-153.3	0	0	0	0	0	116.2	T427	G425-T427 PolarHBondContact O-N 3.18Å
426	L	42.4	Very low	63.8	Low	107 Å²	107	87.6 Å²	87.6	56%	0.56	49%	0.493	S	S	*	.			trans	-60.8	96.5	166.8	-178.2	69.5	0	0	0	110.6	T428	L426-T428 VanDerWaalsContact C-N 3.3Å; L426-T428 PolarHBondContact O-N 3.47Å; L426-T428 PolarHBondContact O-OG1 3.41Å
427	T	51.4	Low	66	Low	89 Å²	89	83.4 Å²	83.4	55%	0.546	47%	0.467	S	S	.	.			trans	-68.1	82.3	-175.7	45.2	0	0	0	0	112	G425 S429	G425-T427 PolarHBondContact O-N 3.18Å; T427-S429 PolarHBondContact O-N 3.3Å
428	T	59.3	Low	68.3	Low	61 Å²	61	77.7 Å²	77.7	37%	0.374	43%	0.43	S	S	.	.			trans	-72.2	99.8	179.4	-62	0	0	0	0	109.9	R411 K412 L426 I430	R411-T428 HydrophobicContact CB-CG2 3.77Å; R411-T428 HydrophobicContact CG-CG2 4.18Å; K412-T428 CarbonylContact O-C 3.58Å; K412-T428 WeakPolarHBondContact O-CA 3.47Å; L426-T428 VanDerWaalsContact C-N 3.3Å; L426-T428 PolarHBondContact O-N 3.47Å; L426-T428 PolarHBondContact O-OG1 3.41Å; T428-I430 PolarHBondContact O-N 3.33Å
429	S	83.4	Confident	70.5	Confident	58 Å²	58	72.4 Å²	72.4	41%	0.406	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	119.1	177.6	178.4	0	0	0	0	110.3	K412 T427	K412-S429 PolarHBondContact N-O 2.89Å; K412-S429 PolarHBondContact O-N 2.95Å; T427-S429 PolarHBondContact O-N 3.3Å
430	I	91.6	Very high	72.8	Confident	59 Å²	59	62.9 Å²	62.9	30%	0.303	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.6	179.7	-60.9	-179.4	0	0	0	109	Q384 I409 T428 Y432	Q384-I430 PolarHBondContact NE2-O 2.79Å; I409-I430 HydrophobicContact CG2-CG2 3.88Å; T428-I430 PolarHBondContact O-N 3.33Å; I430-Y432 HydrophobicContact CG2-CD2 4.35Å; I430-Y432 HydrophobicContact CG2-CE1 4.02Å; I430-Y432 HydrophobicContact CG2-CE2 3.81Å
431	V	95.4	Very high	74.9	Confident	17 Å²	17	59.3 Å²	59.3	10%	0.103	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.4	175	-175.7	0	0	0	0	110.1	Q384 S410 K412 K433	Q384-V431 VanDerWaalsContact OE1-CA 3.31Å; S410-V431 PolarHBondContact N-O 3.42Å; S410-V431 PolarHBondContact O-N 2.88Å; K412-V431 HydrophobicContact CD-CG2 4.39Å; V431-K433 HydrophobicContact CG1-CG 4.48Å
432	Y	97.3	Very high	77.3	Confident	7 Å²	7	57 Å²	57	3%	0.027	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	138.5	175.1	-59.6	-77.4	0	0	0	110.9	H333 L359 L381 Q384 I407 I409 I430	H333-Y432 WeakPolarHBondContact CA-O 3.43Å; H333-Y432 PolarHBondContact ND1-O 3.34Å; L359-Y432 HydrophobicContact CD1-CE1 4.15Å; L381-Y432 HydrophobicContact CB-CD2 4.27Å; L381-Y432 HydrophobicContact CB-CE2 3.95Å; L381-Y432 HydrophobicContact CD1-CD1 3.62Å; L381-Y432 HydrophobicContact CD1-CD2 4.11Å; L381-Y432 HydrophobicContact CD1-CE1 3.86Å; L381-Y432 HydrophobicContact CD1-CE2 4.32Å; L381-Y432 HydrophobicContact CD1-CG 3.76Å; Q384-Y432 HydrophobicContact CB-CD2 4.16Å; Q384-Y432 HydrophobicContact CG-CD2 4.29Å; I407-Y432 HydrophobicContact CG2-CD1 4.16Å; I409-Y432 HydrophobicContact CD1-CD1 4.46Å; I409-Y432 HydrophobicContact CD1-CE1 4.05Å; I409-Y432 HydrophobicContact CG1-CD1 3.91Å; I409-Y432 HydrophobicContact CG1-CE1 3.97Å; I430-Y432 HydrophobicContact CG2-CD2 4.35Å; I430-Y432 HydrophobicContact CG2-CE1 4.02Å; I430-Y432 HydrophobicContact CG2-CE2 3.81Å
433	K	98.1	Very high	79.4	Confident	16 Å²	16	49.8 Å²	49.8	7%	0.07	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	128.5	-173.7	-74	169.2	166.2	-68.3	0	111.8	P332 H333 V334 V335 E352 I407 F408 V431	P332-K433 WeakPolarHBondContact O-CE 3.39Å; P332-K433 WeakPolarHBondContact O-CG 3.35Å; P332-K433 PolarHBondContact O-NZ 3.17Å; H333-K433 WeakPolarHBondContact O-CA 3.47Å; V334-K433 PolarHBondContact O-NZ 3.18Å; V335-K433 HydrophobicContact CG2-CB 3.88Å; E352-K433 VanDerWaalsContact CD-NZ 3.31Å; E352-K433 WeakPolarHBondContact OE1-CD 3.23Å; E352-K433 VanDerWaalsContact OE1-CE 3.23Å; E352-K433 WeakPolarHBondContact OE1-CE 3.47Å; E352-K433 IonicContact OE1-NZ 2.75Å; E352-K433 PolarHBondContact OE1-NZ 3.1Å; E352-K433 WeakPolarHBondContact OE2-CE 3.46Å; E352-K433 IonicContact OE2-NZ 3.6Å; E352-K433 PolarHBondContact OE2-NZ 3.09Å; I407-K433 CarbonylContact C-O 3.6Å; I407-K433 WeakPolarHBondContact CA-O 3.5Å; F408-K433 HydrophobicContact CB-CB 4.43Å; F408-K433 PolarHBondContact N-O 2.79Å; F408-K433 PolarHBondContact O-N 2.64Å; V431-K433 HydrophobicContact CG1-CG 4.48Å
434	I	98.1	Very high	81.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.8	172.6	-57.5	173.5	0	0	0	109.7	H333 V334 V335 V385 L389 I392 H399 I402	H333-I434 PolarHBondContact O-N 3.41Å; V334-I434 CarbonylContact C-O 3.59Å; V334-I434 WeakPolarHBondContact CA-O 3.48Å; V335-I434 WeakPolarHBondContact CG2-O 3.44Å; V335-I434 PolarHBondContact N-O 3.46Å; V385-I434 HydrophobicContact CG1-CD1 3.99Å; V385-I434 HydrophobicContact CG1-CG1 3.92Å; L389-I434 HydrophobicContact CB-CD1 4.45Å; L389-I434 HydrophobicContact CD2-CD1 3.99Å; L389-I434 HydrophobicContact CG-CD1 3.83Å; I392-I434 HydrophobicContact CD1-CD1 4.06Å; I392-I434 HydrophobicContact CD1-CG2 4.14Å; H399-I434 WeakPolarHBondContact CD2-CG2 3.35Å; H399-I434 WeakPolarHBondContact NE2-CG2 3.41Å; I402-I434 HydrophobicContact CD1-CD1 4.18Å; I402-I434 HydrophobicContact CD1-CG1 4.38Å; I402-I434 HydrophobicContact CD1-CG2 3.86Å
435	G	94.6	Very high	83.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.255	C	S	.	.			trans	-143.9	-174.1	174.8	0	0	0	0	0	113	H399 N406	H399-G435 PolarHBondContact NE2-O 2.88Å; N406-G435 PolarHBondContact O-N 3.3Å
436	D	90.7	Very high	85.5	Confident	40 Å²	40	44.4 Å²	44.4	21%	0.214	24%	0.241	C	C	.	.			trans	60.5	70	-171.4	-152.6	12.9	0	0	0	113.7	K303 G438	K303-D436 IonicContact NZ-OD1 2.68Å; K303-D436 PolarHBondContact NZ-OD1 3.36Å; D436-G438 PolarHBondContact O-N 3.39Å; D436-G438 VanDerWaalsContact O-N 3.13Å
437	L	90.5	Very high	87.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-81.9	18.7	-169.9	-54.3	-167.5	0	0	0	114.7	E321 A324 H325 L328 H399 H439 V440	E321-L437 HydrophobicContact CG-CB 4.22Å; A324-L437 HydrophobicContact CB-CB 3.95Å; A324-L437 HydrophobicContact CB-CD1 3.91Å; H325-L437 WeakPolarHBondContact CE1-CD1 3.31Å; H325-L437 WeakPolarHBondContact ND1-CD1 3.48Å; L328-L437 HydrophobicContact CD1-CD1 3.7Å; H399-L437 WeakPolarHBondContact NE2-CD2 3.32Å; L437-H439 VanDerWaalsContact C-N 3.33Å; L437-H439 PolarHBondContact O-N 2.72Å; L437-V440 HydrophobicContact CB-CB 4.4Å; L437-V440 HydrophobicContact CB-CG2 3.7Å; L437-V440 HydrophobicContact CD2-CG2 4.02Å; L437-V440 HydrophobicContact CG-CG2 4.32Å; L437-V440 WeakPolarHBondContact O-CB 3.39Å; L437-V440 WeakPolarHBondContact O-CG2 3.38Å; L437-V440 PolarHBondContact O-N 3.28Å; L437-V440 VanDerWaalsContact O-N 3.11Å
438	G	87	Confident	88.9	Confident	3 Å²	3	43 Å²	43	3%	0.031	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-60.9	-37.1	-175.1	0	0	0	0	0	114.2	N317 R320 D436 V440	N317-G438 VanDerWaalsContact OD1-C 3.25Å; N317-G438 PolarHBondContact OD1-O 2.96Å; N317-G438 VanDerWaalsContact OD1-O 3.08Å; R320-G438 VanDerWaalsContact CB-O 3.32Å; R320-G438 WeakPolarHBondContact CB-O 3.45Å; R320-G438 PolarHBondContact NE-O 3.28Å; D436-G438 PolarHBondContact O-N 3.39Å; D436-G438 VanDerWaalsContact O-N 3.13Å; G438-V440 VanDerWaalsContact C-N 3.34Å
439	H	89.6	Confident	90.1	Very high	18 Å²	18	42.4 Å²	42.4	8%	0.083	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-85.5	1.4	177.9	-64.8	-98.5	0	0	0	113.9	M400 D401 L437 T441 E449 E450	M400-H439 HydrophobicContact CB-CB 4.12Å; D401-H439 HydrophobicContact CB-CB 4.02Å; D401-H439 IonicContact OD2-CD2 3.04Å; L437-H439 VanDerWaalsContact C-N 3.33Å; L437-H439 PolarHBondContact O-N 2.72Å; H439-T441 PolarHBondContact O-N 3.32Å; H439-E449 IonicContact CE1-OE1 2.75Å; H439-E449 PolarHBondContact ND1-O 3.41Å; H439-E450 PolarHBondContact CE1-O 3.1Å
440	V	93.3	Very high	90.1	Very high	8 Å²	8	45.3 Å²	45.3	5%	0.048	23%	0.228	C	C	.	.			trans	-64.2	127.6	-177.5	169.5	0	0	0	0	111.1	A324 L397 V398 L437 G438	A324-V440 HydrophobicContact CB-CB 3.81Å; A324-V440 HydrophobicContact CB-CG1 3.65Å; A324-V440 HydrophobicContact CB-CG2 4.27Å; L397-V440 HydrophobicContact CB-CG1 4.04Å; L397-V440 HydrophobicContact CD1-CG1 4.04Å; L397-V440 HydrophobicContact CD2-CG1 4.11Å; L397-V440 HydrophobicContact CG-CG1 4.29Å; V398-V440 WeakPolarHBondContact O-CA 3.4Å; L437-V440 HydrophobicContact CB-CB 4.4Å; L437-V440 HydrophobicContact CB-CG2 3.7Å; L437-V440 HydrophobicContact CD2-CG2 4.02Å; L437-V440 HydrophobicContact CG-CG2 4.32Å; L437-V440 WeakPolarHBondContact O-CB 3.39Å; L437-V440 WeakPolarHBondContact O-CG2 3.38Å; L437-V440 PolarHBondContact O-N 3.28Å; L437-V440 VanDerWaalsContact O-N 3.11Å; G438-V440 VanDerWaalsContact C-N 3.34Å
441	T	92.3	Very high	89.9	Confident	10 Å²	10	43 Å²	43	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	165.8	-177.7	-152.8	0	0	0	0	112.1	L397 V398 M400 H439 P446 Q447 L468	L397-T441 WeakPolarHBondContact CA-O 3.45Å; V398-T441 HydrophobicContact CG2-CG2 3.73Å; V398-T441 WeakPolarHBondContact CG2-O 3.46Å; V398-T441 PolarHBondContact N-O 2.95Å; V398-T441 PolarHBondContact O-N 3.1Å; M400-T441 HydrophobicContact CG-CG2 4.18Å; H439-T441 PolarHBondContact O-N 3.32Å; T441-P446 HydrophobicContact CG2-CB 4.07Å; T441-Q447 WeakPolarHBondContact CB-O 3.4Å; T441-Q447 PolarHBondContact OG1-N 2.92Å; T441-Q447 PolarHBondContact OG1-O 3.41Å; T441-L468 HydrophobicContact CG2-CD1 4.25Å
442	R	92.6	Very high	89.8	Confident	117 Å²	117	43.7 Å²	43.7	44%	0.442	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	137.3	-178.1	-60.9	-168.9	-170	99.5	-2.4	111.1	Y323 L397 N444 N445 P446	Y323-R442 PolarHBondContact OH-NH2 2.79Å; L397-R442 HydrophobicContact CD2-CG 3.97Å; R442-N444 VanDerWaalsContact C-N 3.35Å; R442-N444 PolarHBondContact O-N 3.32Å; R442-N445 CarbonylContact O-C 3.56Å; R442-P446 VanDerWaalsContact O-CA 3.23Å; R442-P446 WeakPolarHBondContact O-CA 3.45Å; R442-P446 WeakPolarHBondContact O-CB 3.38Å
443	V	90.5	Very high	89.7	Confident	46 Å²	46	45.5 Å²	45.5	28%	0.279	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-43.7	176.9	177.6	0	0	0	0	112.1	S396 V398 N445 T469	S396-V443 PolarHBondContact O-N 2.93Å; V398-V443 HydrophobicContact CG1-CG2 3.8Å; V443-N445 PolarHBondContact O-N 3Å; V443-T469 HydrophobicContact CG2-CG2 4.07Å
444	N	86.3	Confident	89.7	Confident	143 Å²	143	49 Å²	49	77%	0.765	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-7.3	-170.1	-60.4	3.1	0	0	0	114.7	R442	R442-N444 VanDerWaalsContact C-N 3.35Å; R442-N444 PolarHBondContact O-N 3.32Å
445	N	86.1	Confident	89.6	Confident	103 Å²	103	49.9 Å²	49.9	55%	0.551	25%	0.252	S	S	*	.	B	Isolated β-bridge	trans	-158.3	76.5	173.4	-177.9	27	0	0	0	108	R442 V443 Q447	R442-N445 CarbonylContact O-C 3.56Å; V443-N445 PolarHBondContact O-N 3Å; N445-Q447 PolarHBondContact O-N 3.44Å
446	P	84.4	Confident	89.7	Confident	30 Å²	30	50.4 Å²	50.4	20%	0.195	26%	0.255	C	S	.	.			trans	-77.2	126.1	-169.9	31.2	-34.2	0	0	0	110.5	T441 R442 V448 Y465 L468	T441-P446 HydrophobicContact CG2-CB 4.07Å; R442-P446 VanDerWaalsContact O-CA 3.23Å; R442-P446 WeakPolarHBondContact O-CA 3.45Å; R442-P446 WeakPolarHBondContact O-CB 3.38Å; P446-V448 HydrophobicContact CB-CG2 3.86Å; P446-Y465 HydrophobicContact CG-CD2 4.07Å; P446-Y465 HydrophobicContact CG-CG 4.17Å; P446-L468 HydrophobicContact CB-CD1 3.59Å; P446-L468 HydrophobicContact CG-CD1 4.23Å
447	Q	83.1	Confident	90	Very high	129 Å²	129	48.6 Å²	48.6	60%	0.603	25%	0.245	S	C	*	.			trans	-99.6	94.3	160.5	-63.3	-66.1	-83.8	0	0	105.4	T441 N445	T441-Q447 WeakPolarHBondContact CB-O 3.4Å; T441-Q447 PolarHBondContact OG1-N 2.92Å; T441-Q447 PolarHBondContact OG1-O 3.41Å; N445-Q447 PolarHBondContact O-N 3.44Å
448	V	83.1	Confident	90.2	Very high	37 Å²	37	50.6 Å²	50.6	22%	0.224	26%	0.256	C	S	.	.			trans	-87.3	137.7	-175.5	-176	0	0	0	0	109.8	M400 P446 V460 Y465 L468	M400-V448 HydrophobicContact CE-CG1 4.08Å; P446-V448 HydrophobicContact CB-CG2 3.86Å; V448-V460 HydrophobicContact CG1-CG1 4.11Å; V448-Y465 HydrophobicContact CB-CE1 4.05Å; V448-Y465 HydrophobicContact CG1-CE1 4.13Å; V448-Y465 HydrophobicContact CG2-CD1 3.77Å; V448-Y465 HydrophobicContact CG2-CD2 4.14Å; V448-Y465 HydrophobicContact CG2-CE1 3.68Å; V448-Y465 HydrophobicContact CG2-CE2 4.09Å; V448-Y465 HydrophobicContact CG2-CG 3.99Å; V448-L468 HydrophobicContact CG2-CD1 4.27Å
449	E	83.3	Confident	90.6	Very high	50 Å²	50	50.9 Å²	50.9	23%	0.234	26%	0.256	C	S	.	.			trans	-128.2	123.2	166.7	-171.9	169.7	124	0	0	105.9	V313 N317 R320 H439 G451	V313-E449 WeakPolarHBondContact CG1-OE2 3.15Å; N317-E449 PolarHBondContact ND2-OE1 3.12Å; R320-E449 IonicContact CZ-OE2 3.7Å; R320-E449 IonicContact NH1-OE2 3.72Å; R320-E449 PolarHBondContact NH1-OE2 2.87Å; R320-E449 IonicContact NH2-OE1 2.75Å; R320-E449 PolarHBondContact NH2-OE1 3.29Å; R320-E449 IonicContact NH2-OE2 3.61Å; R320-E449 PolarHBondContact NH2-OE2 2.9Å; H439-E449 IonicContact CE1-OE1 2.75Å; H439-E449 PolarHBondContact ND1-O 3.41Å; E449-G451 PolarHBondContact O-N 3.21Å
450	E	85.2	Confident	90.8	Very high	118 Å²	118	50.1 Å²	50.1	55%	0.551	25%	0.253	S	S	*	.			trans	-57.2	126.4	-172.4	-70	-175	-165.1	0	0	111.4	H439 L456	H439-E450 PolarHBondContact CE1-O 3.1Å; E450-L456 HydrophobicContact CB-CD2 4.46Å; E450-L456 HydrophobicContact CG-CD2 4.36Å
451	G	85.8	Confident	90.7	Very high	12 Å²	12	53.7 Å²	53.7	12%	0.124	27%	0.272	C	S	.	.			trans	-78.4	-169	171.8	0	0	0	0	0	112.3	E449 S453	E449-G451 PolarHBondContact O-N 3.21Å; G451-S453 PolarHBondContact O-N 3.09Å; G451-S453 VanDerWaalsContact O-N 3.12Å
452	D	93.6	Very high	90.7	Very high	30 Å²	30	59.7 Å²	59.7	16%	0.16	30%	0.299	C	S	.	.			trans	-57.5	116.8	-178.9	-170.3	-48.1	0	0	0	112.8	D401 K403 R454 Y455 L456	D401-D452 PolarHBondContact OD1-N 2.72Å; K403-D452 HydrophobicContact CD-CB 3.58Å; D452-R454 PolarHBondContact O-N 2.64Å; D452-R454 VanDerWaalsContact OD1-CB 3.26Å; D452-R454 WeakPolarHBondContact OD1-CB 3.18Å; D452-R454 WeakPolarHBondContact OD1-CG 3.35Å; D452-R454 IonicContact OD1-CZ 3.45Å; D452-R454 PolarHBondContact OD1-N 3.4Å; D452-R454 VanDerWaalsContact OD1-N 3.09Å; D452-R454 IonicContact OD1-NE 3.52Å; D452-R454 PolarHBondContact OD1-NE 3.15Å; D452-R454 IonicContact OD1-NH2 3.53Å; D452-R454 IonicContact OD2-CZ 2.67Å; D452-R454 IonicContact OD2-NE 2.76Å; D452-R454 PolarHBondContact OD2-NE 3.12Å; D452-R454 IonicContact OD2-NH2 3.41Å; D452-R454 PolarHBondContact OD2-NH2 3.26Å; D452-Y455 HydrophobicContact CB-CD2 3.94Å; D452-Y455 PolarHBondContact O-N 2.99Å; D452-L456 PolarHBondContact O-N 2.93Å
453	S	95.6	Very high	90.7	Very high	45 Å²	45	61.1 Å²	61.1	32%	0.315	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.3	-173.2	80.7	0	0	0	0	113.7	G451 Y455 T491 W496 R500	G451-S453 PolarHBondContact O-N 3.09Å; G451-S453 VanDerWaalsContact O-N 3.12Å; S453-Y455 VanDerWaalsContact C-N 3.28Å; S453-Y455 PolarHBondContact O-N 3.03Å; S453-T491 PolarHBondContact OG-O 3.47Å; S453-W496 PolarHBondContact O-NE1 3.49Å; S453-R500 PolarHBondContact O-NH2 3.26Å; S453-R500 VanDerWaalsContact O-NH2 3.16Å
454	R	97.3	Very high	90.8	Very high	90 Å²	90	61.8 Å²	61.8	34%	0.34	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-31.9	177.6	-61	174.3	-70.2	-179.4	-1.6	112	D452 L489 T491 R500	D452-R454 PolarHBondContact O-N 2.64Å; D452-R454 VanDerWaalsContact OD1-CB 3.26Å; D452-R454 WeakPolarHBondContact OD1-CB 3.18Å; D452-R454 WeakPolarHBondContact OD1-CG 3.35Å; D452-R454 IonicContact OD1-CZ 3.45Å; D452-R454 PolarHBondContact OD1-N 3.4Å; D452-R454 VanDerWaalsContact OD1-N 3.09Å; D452-R454 IonicContact OD1-NE 3.52Å; D452-R454 PolarHBondContact OD1-NE 3.15Å; D452-R454 IonicContact OD1-NH2 3.53Å; D452-R454 IonicContact OD2-CZ 2.67Å; D452-R454 IonicContact OD2-NE 2.76Å; D452-R454 PolarHBondContact OD2-NE 3.12Å; D452-R454 IonicContact OD2-NH2 3.41Å; D452-R454 PolarHBondContact OD2-NH2 3.26Å; R454-L489 HydrophobicContact CB-CB 3.98Å; R454-L489 WeakPolarHBondContact CD-O 3.46Å; R454-L489 HydrophobicContact CG-CB 4.47Å; R454-T491 HydrophobicContact CG-CG2 3.77Å; R454-R500 VanDerWaalsContact C-NH2 3.33Å; R454-R500 PolarHBondContact O-NH2 3.11Å
455	Y	97.9	Very high	91.2	Very high	19 Å²	19	58.4 Å²	58.4	8%	0.075	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-17.2	-178.1	-56.7	-90.5	0	0	0	112.8	K403 P404 D452 S453 F474 L478 L489	K403-Y455 HydrophobicContact CB-CD1 4.29Å; K403-Y455 HydrophobicContact CB-CD2 3.68Å; K403-Y455 HydrophobicContact CB-CE1 4.33Å; K403-Y455 HydrophobicContact CB-CE2 3.71Å; K403-Y455 HydrophobicContact CB-CG 4Å; P404-Y455 VanDerWaalsContact CD-CZ 3.43Å; P404-Y455 WeakPolarHBondContact CD-OH 3.2Å; P404-Y455 HydrophobicContact CG-CE1 4.46Å; D452-Y455 HydrophobicContact CB-CD2 3.94Å; D452-Y455 PolarHBondContact O-N 2.99Å; S453-Y455 VanDerWaalsContact C-N 3.28Å; S453-Y455 PolarHBondContact O-N 3.03Å; Y455-F474 VanDerWaalsContact O-CD1 3.32Å; Y455-F474 WeakPolarHBondContact O-CD1 3.47Å; Y455-F474 WeakPolarHBondContact O-CE1 3.46Å; Y455-L478 HydrophobicContact CD1-CB 3.87Å; Y455-L478 HydrophobicContact CE1-CB 4.32Å; Y455-L489 HydrophobicContact CD1-CD1 4.06Å; Y455-L489 HydrophobicContact CE1-CD1 3.58Å
456	L	96.7	Very high	91.5	Very high	11 Å²	11	58.2 Å²	58.2	6%	0.058	30%	0.296	C	S	.	.			trans	-57.8	131.9	-179.8	-169.1	66.1	0	0	0	112.9	E450 D452 V460 L461 R500	E450-L456 HydrophobicContact CB-CD2 4.46Å; E450-L456 HydrophobicContact CG-CD2 4.36Å; D452-L456 PolarHBondContact O-N 2.93Å; L456-V460 HydrophobicContact CD1-CB 3.92Å; L456-V460 HydrophobicContact CD1-CG1 3.8Å; L456-L461 HydrophobicContact CD2-CB 4.42Å; L456-R500 VanDerWaalsContact O-CZ 3.3Å; L456-R500 PolarHBondContact O-NE 2.71Å; L456-R500 PolarHBondContact O-NH2 3.09Å
457	A	96.5	Very high	92	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.008	30%	0.297	C	S	.	.			trans	-83.9	154.4	178.6	0	0	0	0	0	112	E459 V460 A471 F474	A457-E459 WeakPolarHBondContact CB-OE1 3.42Å; A457-E459 WeakPolarHBondContact CB-OE2 3.35Å; A457-E459 PolarHBondContact O-N 3.4Å; A457-V460 HydrophobicContact CB-CG2 4.43Å; A457-V460 PolarHBondContact O-N 3.47Å; A457-A471 HydrophobicContact CB-CB 4.15Å; A457-F474 HydrophobicContact CB-CB 4.07Å; A457-F474 HydrophobicContact CB-CD1 3.64Å; A457-F474 HydrophobicContact CB-CD2 4.31Å; A457-F474 HydrophobicContact CB-CE1 4.12Å; A457-F474 HydrophobicContact CB-CG 3.77Å
458	N	94.5	Very high	92.6	Very high	43 Å²	43	52.7 Å²	52.7	23%	0.23	27%	0.269	C	S	.	.	H	α-helix	trans	-65.8	-37.8	-169.9	-158.9	89.8	0	0	0	113.2	V460 L461 Q462 R500	N458-V460 VanDerWaalsContact C-N 3.28Å; N458-V460 PolarHBondContact O-N 3.31Å; N458-L461 PolarHBondContact O-N 3.04Å; N458-Q462 PolarHBondContact ND2-NE2 3.06Å; N458-Q462 PolarHBondContact ND2-OE1 2.8Å; N458-Q462 WeakPolarHBondContact O-CG 3.43Å; N458-Q462 PolarHBondContact O-N 2.99Å; N458-R500 HydrophobicContact CB-CB 3.98Å; N458-R500 HydrophobicContact CB-CG 3.76Å
459	E	95.3	Very high	93.3	Very high	8 Å²	8	53 Å²	53	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-33.5	-179.5	68.8	-78.1	-174.8	0	0	112.2	A457 Q462 E463 D464 P527 R530	A457-E459 WeakPolarHBondContact CB-OE1 3.42Å; A457-E459 WeakPolarHBondContact CB-OE2 3.35Å; A457-E459 PolarHBondContact O-N 3.4Å; E459-Q462 CarbonylContact O-C 3.45Å; E459-Q462 WeakPolarHBondContact O-CA 3.49Å; E459-Q462 PolarHBondContact O-N 3.1Å; E459-Q462 VanDerWaalsContact O-N 3.13Å; E459-E463 PolarHBondContact O-N 3.47Å; E459-D464 HydrophobicContact CB-CB 4.21Å; E459-D464 PolarHBondContact O-N 3.22Å; E459-P527 HydrophobicContact CB-CG 4.04Å; E459-P527 HydrophobicContact CG-CG 3.68Å; E459-R530 IonicContact OE1-CZ 3.99Å; E459-R530 IonicContact OE1-NH1 2.66Å; E459-R530 PolarHBondContact OE1-NH1 3.06Å; E459-R530 IonicContact OE1-NH2 3.17Å; E459-R530 PolarHBondContact OE1-NH2 3.24Å; E459-R530 IonicContact OE2-CZ 2.68Å; E459-R530 IonicContact OE2-NH1 2.65Å; E459-R530 IonicContact OE2-NH2 3.28Å; E459-R530 PolarHBondContact OE2-NH2 2.67Å
460	V	94.7	Very high	94	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.018	27%	0.265	C	S	.	.	H	α-helix	trans	-69.7	-39.9	178.8	-172.8	0	0	0	0	110.8	M400 V448 L456 A457 N458 Q462 E463 Y465 L468 A471	M400-V460 HydrophobicContact CE-CG1 3.71Å; M400-V460 HydrophobicContact CE-CG2 4.12Å; V448-V460 HydrophobicContact CG1-CG1 4.11Å; L456-V460 HydrophobicContact CD1-CB 3.92Å; L456-V460 HydrophobicContact CD1-CG1 3.8Å; A457-V460 HydrophobicContact CB-CG2 4.43Å; A457-V460 PolarHBondContact O-N 3.47Å; N458-V460 VanDerWaalsContact C-N 3.28Å; N458-V460 PolarHBondContact O-N 3.31Å; V460-Q462 PolarHBondContact O-N 3.33Å; V460-E463 PolarHBondContact O-N 2.96Å; V460-E463 VanDerWaalsContact O-N 3.13Å; V460-Y465 HydrophobicContact CG1-CE1 4.19Å; V460-L468 HydrophobicContact CG2-CD2 4.23Å; V460-A471 HydrophobicContact CG2-CB 3.63Å
461	L	90.1	Very high	94.6	Very high	83 Å²	83	46.6 Å²	46.6	44%	0.435	24%	0.242	S	C	.	.	H	α-helix	trans	-68.6	-16.4	173	-174.8	64.6	0	0	0	112.8	L456 N458 W496	L456-L461 HydrophobicContact CD2-CB 4.42Å; N458-L461 PolarHBondContact O-N 3.04Å; L461-W496 HydrophobicContact CD2-CH2 3.59Å; L461-W496 HydrophobicContact CD2-CZ2 4.17Å; L461-W496 HydrophobicContact CD2-CZ3 4.36Å
462	Q	91.9	Very high	95.2	Very high	135 Å²	135	46 Å²	46	63%	0.631	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	11.1	174.1	-68.5	177	-49.9	0	0	112.6	N458 E459 V460 D464	N458-Q462 PolarHBondContact ND2-NE2 3.06Å; N458-Q462 PolarHBondContact ND2-OE1 2.8Å; N458-Q462 WeakPolarHBondContact O-CG 3.43Å; N458-Q462 PolarHBondContact O-N 2.99Å; E459-Q462 CarbonylContact O-C 3.45Å; E459-Q462 WeakPolarHBondContact O-CA 3.49Å; E459-Q462 PolarHBondContact O-N 3.1Å; E459-Q462 VanDerWaalsContact O-N 3.13Å; V460-Q462 PolarHBondContact O-N 3.33Å; Q462-D464 PolarHBondContact O-N 3.47Å; Q462-D464 VanDerWaalsContact O-N 3.15Å
463	E	92.4	Very high	95.4	Very high	147 Å²	147	44.6 Å²	44.6	69%	0.687	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	14.6	-175.3	-51.9	-172.4	179.7	0	0	115	E459 V460 Y465	E459-E463 PolarHBondContact O-N 3.47Å; V460-E463 PolarHBondContact O-N 2.96Å; V460-E463 VanDerWaalsContact O-N 3.13Å; E463-Y465 HydrophobicContact CB-CE1 4.48Å; E463-Y465 HydrophobicContact CB-CE2 4.27Å; E463-Y465 PolarHBondContact O-N 3.35Å
464	D	93.5	Very high	95.6	Very high	60 Å²	60	42.5 Å²	42.5	32%	0.321	21%	0.214	S	C	.	.			trans	-80	90.3	172.4	176.8	27.3	0	0	0	111	E459 Q462 S466	E459-D464 HydrophobicContact CB-CB 4.21Å; E459-D464 PolarHBondContact O-N 3.22Å; Q462-D464 PolarHBondContact O-N 3.47Å; Q462-D464 VanDerWaalsContact O-N 3.15Å; D464-S466 VanDerWaalsContact C-N 3.27Å; D464-S466 PolarHBondContact O-N 3.31Å; D464-S466 WeakPolarHBondContact OD1-CB 3.49Å; D464-S466 PolarHBondContact OD1-N 3.3Å; D464-S466 PolarHBondContact OD1-OG 2.74Å
465	Y	94.5	Very high	95.6	Very high	73 Å²	73	38.5 Å²	38.5	29%	0.286	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-86.2	11	177.2	-48.4	-40.2	0	0	0	113.7	P446 V448 V460 E463 N467 L468	P446-Y465 HydrophobicContact CG-CD2 4.07Å; P446-Y465 HydrophobicContact CG-CG 4.17Å; V448-Y465 HydrophobicContact CB-CE1 4.05Å; V448-Y465 HydrophobicContact CG1-CE1 4.13Å; V448-Y465 HydrophobicContact CG2-CD1 3.77Å; V448-Y465 HydrophobicContact CG2-CD2 4.14Å; V448-Y465 HydrophobicContact CG2-CE1 3.68Å; V448-Y465 HydrophobicContact CG2-CE2 4.09Å; V448-Y465 HydrophobicContact CG2-CG 3.99Å; V460-Y465 HydrophobicContact CG1-CE1 4.19Å; E463-Y465 HydrophobicContact CB-CE1 4.48Å; E463-Y465 HydrophobicContact CB-CE2 4.27Å; E463-Y465 PolarHBondContact O-N 3.35Å; Y465-N467 PolarHBondContact O-N 2.51Å; Y465-L468 HydrophobicContact CD1-CD2 3.83Å; Y465-L468 HydrophobicContact CG-CD2 4.34Å
466	S	93.1	Very high	95.7	Very high	98 Å²	98	37.6 Å²	37.6	69%	0.685	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-64.7	-23	-179.4	-51.4	0	0	0	0	113.6	D464	D464-S466 VanDerWaalsContact C-N 3.27Å; D464-S466 PolarHBondContact O-N 3.31Å; D464-S466 WeakPolarHBondContact OD1-CB 3.49Å; D464-S466 PolarHBondContact OD1-N 3.3Å; D464-S466 PolarHBondContact OD1-OG 2.74Å
467	N	94.8	Very high	95.8	Very high	41 Å²	41	37 Å²	37	22%	0.219	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-130.6	30.4	-169.9	-73.2	-83.9	0	0	0	114	Y465 T469 K470 P527	Y465-N467 PolarHBondContact O-N 2.51Å; N467-T469 PolarHBondContact O-N 3.25Å; N467-K470 HydrophobicContact CB-CB 4.34Å; N467-K470 HydrophobicContact CB-CG 4.21Å; N467-K470 WeakPolarHBondContact O-CA 3.37Å; N467-K470 VanDerWaalsContact O-CB 3.25Å; N467-K470 WeakPolarHBondContact O-CB 3.38Å; N467-K470 PolarHBondContact O-N 2.92Å; N467-P527 HydrophobicContact CB-CB 3.64Å; N467-P527 HydrophobicContact CB-CG 4.31Å
468	L	95.9	Very high	95.9	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-52	-33.5	-172.8	-65.8	-176	0	0	0	115.5	V398 M400 T441 P446 V448 V460 Y465 K470 A471 D472	V398-L468 HydrophobicContact CB-CB 4.31Å; V398-L468 HydrophobicContact CG1-CB 3.9Å; V398-L468 HydrophobicContact CG2-CB 3.98Å; V398-L468 HydrophobicContact CG2-CD1 3.97Å; M400-L468 HydrophobicContact CE-CD2 3.81Å; M400-L468 HydrophobicContact SD-CB 4.14Å; M400-L468 HydrophobicContact SD-CD1 4.2Å; M400-L468 HydrophobicContact SD-CD2 3.92Å; M400-L468 HydrophobicContact SD-CG 4.31Å; T441-L468 HydrophobicContact CG2-CD1 4.25Å; P446-L468 HydrophobicContact CB-CD1 3.59Å; P446-L468 HydrophobicContact CG-CD1 4.23Å; V448-L468 HydrophobicContact CG2-CD1 4.27Å; V460-L468 HydrophobicContact CG2-CD2 4.23Å; Y465-L468 HydrophobicContact CD1-CD2 3.83Å; Y465-L468 HydrophobicContact CG-CD2 4.34Å; L468-K470 PolarHBondContact O-N 3.49Å; L468-K470 VanDerWaalsContact O-N 3.16Å; L468-A471 WeakPolarHBondContact O-CB 3.36Å; L468-A471 PolarHBondContact O-N 2.91Å; L468-D472 PolarHBondContact O-N 3.34Å
469	T	97.3	Very high	96.1	Very high	43 Å²	43	35 Å²	35	26%	0.264	18%	0.182	S	C	.	.	H	α-helix	trans	-62.6	-20.8	175.3	55	0	0	0	0	113.4	H393 V398 V443 N467	H393-T469 HydrophobicContact CB-CG2 4.28Å; H393-T469 PolarHBondContact CE1-O 3.28Å; H393-T469 VanDerWaalsContact CE1-O 3.25Å; V398-T469 HydrophobicContact CG1-CG2 3.58Å; V443-T469 HydrophobicContact CG2-CG2 4.07Å; N467-T469 PolarHBondContact O-N 3.25Å
470	K	98	Very high	96.2	Very high	27 Å²	27	34.6 Å²	34.6	12%	0.117	18%	0.181	C	C	.	.	H	α-helix	trans	-89.6	-16.2	174.9	-52.7	-63.7	-159.8	74.9	0	112.9	N467 L468 F474 P527 T528 R530	N467-K470 HydrophobicContact CB-CB 4.34Å; N467-K470 HydrophobicContact CB-CG 4.21Å; N467-K470 WeakPolarHBondContact O-CA 3.37Å; N467-K470 VanDerWaalsContact O-CB 3.25Å; N467-K470 WeakPolarHBondContact O-CB 3.38Å; N467-K470 PolarHBondContact O-N 2.92Å; L468-K470 PolarHBondContact O-N 3.49Å; L468-K470 VanDerWaalsContact O-N 3.16Å; K470-F474 PolarHBondContact O-N 3.29Å; K470-P527 HydrophobicContact CB-CB 3.93Å; K470-P527 HydrophobicContact CG-CB 4.4Å; K470-P527 WeakPolarHBondContact CG-O 3.25Å; K470-P527 PolarHBondContact NZ-O 2.9Å; K470-T528 PolarHBondContact NZ-O 2.92Å; K470-R530 HydrophobicContact CD-CB 4.39Å; K470-R530 WeakPolarHBondContact CE-O 3.48Å; K470-R530 PolarHBondContact NZ-O 2.66Å; K470-R530 WeakPolarHBondContact O-CD 3.48Å; K470-R530 PolarHBondContact O-NH1 2.71Å
471	A	97.7	Very high	96.3	Very high	8 Å²	8	34.5 Å²	34.5	7%	0.066	18%	0.18	C	C	.	.	H	α-helix	trans	-71.8	-42.8	169	0	0	0	0	0	110.5	A457 V460 L468 V473 F474 A475	A457-A471 HydrophobicContact CB-CB 4.15Å; V460-A471 HydrophobicContact CG2-CB 3.63Å; L468-A471 WeakPolarHBondContact O-CB 3.36Å; L468-A471 PolarHBondContact O-N 2.91Å; A471-V473 PolarHBondContact O-N 3.25Å; A471-F474 WeakPolarHBondContact O-CB 3.36Å; A471-F474 PolarHBondContact O-N 2.8Å; A471-F474 VanDerWaalsContact O-N 3.13Å; A471-A475 WeakPolarHBondContact O-CB 3.28Å; A471-A475 PolarHBondContact O-N 2.9Å
472	D	98.3	Very high	96.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.6	-36.7	171	-75.1	-23.6	0	0	0	112.1	L389 H393 H399 M400 L468 L476	L389-D472 HydrophobicContact CD1-CB 3.92Å; L389-D472 HydrophobicContact CD2-CB 3.87Å; H393-D472 IonicContact CD2-OD2 2.64Å; H393-D472 IonicContact CE1-OD2 2.69Å; H393-D472 IonicContact NE2-OD2 2.72Å; H393-D472 PolarHBondContact NE2-OD2 2.75Å; H399-D472 WeakPolarHBondContact CB-OD1 3.37Å; H399-D472 PolarHBondContact N-OD1 3.34Å; H399-D472 PolarHBondContact N-OD2 2.9Å; M400-D472 PolarHBondContact N-OD1 2.98Å; L468-D472 PolarHBondContact O-N 3.34Å; D472-L476 VanDerWaalsContact O-CB 3.25Å; D472-L476 WeakPolarHBondContact O-CB 3.43Å; D472-L476 PolarHBondContact O-N 2.58Å
473	V	98.6	Very high	96.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.1	-42.9	175.7	169.3	0	0	0	0	112.1	A471 L476 A477 M522 R530 V533 L536	A471-V473 PolarHBondContact O-N 3.25Å; V473-L476 PolarHBondContact O-N 2.91Å; V473-A477 PolarHBondContact O-N 2.74Å; V473-M522 HydrophobicContact CG1-CB 3.9Å; V473-M522 HydrophobicContact CG1-CE 4.02Å; V473-M522 HydrophobicContact CG1-CG 3.88Å; V473-M522 WeakPolarHBondContact O-CE 3.2Å; V473-R530 HydrophobicContact CG1-CB 4.34Å; V473-V533 HydrophobicContact CG2-CG2 3.69Å; V473-L536 HydrophobicContact CG1-CD1 4.23Å; V473-L536 HydrophobicContact CG2-CD1 4.21Å
474	F	98.6	Very high	96.9	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-62.6	-47.7	176	176.5	-81.2	0	0	0	111	Y455 A457 K470 A471 L476 A477 L478 I499 R500 I523	Y455-F474 VanDerWaalsContact O-CD1 3.32Å; Y455-F474 WeakPolarHBondContact O-CD1 3.47Å; Y455-F474 WeakPolarHBondContact O-CE1 3.46Å; A457-F474 HydrophobicContact CB-CB 4.07Å; A457-F474 HydrophobicContact CB-CD1 3.64Å; A457-F474 HydrophobicContact CB-CD2 4.31Å; A457-F474 HydrophobicContact CB-CE1 4.12Å; A457-F474 HydrophobicContact CB-CG 3.77Å; K470-F474 PolarHBondContact O-N 3.29Å; A471-F474 WeakPolarHBondContact O-CB 3.36Å; A471-F474 PolarHBondContact O-N 2.8Å; A471-F474 VanDerWaalsContact O-N 3.13Å; F474-L476 VanDerWaalsContact C-N 3.34Å; F474-L476 PolarHBondContact O-N 2.76Å; F474-A477 PolarHBondContact O-N 3.28Å; F474-L478 HydrophobicContact CD1-CD1 3.97Å; F474-L478 HydrophobicContact CE1-CD1 3.38Å; F474-L478 HydrophobicContact CE1-CG 4.32Å; F474-L478 HydrophobicContact CZ-CD1 3.91Å; F474-L478 PolarHBondContact O-N 3.44Å; F474-L478 VanDerWaalsContact O-N 3.13Å; F474-I499 HydrophobicContact CZ-CG2 4.12Å; F474-R500 HydrophobicContact CZ-CG 4Å; F474-I523 HydrophobicContact CD2-CB 3.95Å; F474-I523 HydrophobicContact CD2-CG2 4.14Å; F474-I523 HydrophobicContact CE2-CB 3.94Å; F474-I523 HydrophobicContact CE2-CG2 4.29Å
475	A	98.5	Very high	96.8	Very high	5 Å²	5	16.2 Å²	16.2	4%	0.041	10%	0.099	C	C	.	.	H	α-helix	trans	-63.1	-37.7	177.8	0	0	0	0	0	112.5	I402 A471 L478 T479	I402-A475 HydrophobicContact CB-CB 3.95Å; I402-A475 HydrophobicContact CG2-CB 4.42Å; A471-A475 WeakPolarHBondContact O-CB 3.28Å; A471-A475 PolarHBondContact O-N 2.9Å; A475-L478 PolarHBondContact O-N 3.38Å; A475-T479 WeakPolarHBondContact O-CB 3.49Å; A475-T479 PolarHBondContact O-N 2.93Å; A475-T479 PolarHBondContact O-OG1 3.13Å
476	L	98.7	Very high	96.8	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.3	-42	173.9	180	52.4	0	0	0	112.6	L382 V385 L389 I402 D472 V473 F474 L478 T479 V480 M522	L382-L476 HydrophobicContact CD1-CD1 4.32Å; L382-L476 HydrophobicContact CD1-CD2 3.7Å; L382-L476 HydrophobicContact CD1-CG 3.69Å; V385-L476 HydrophobicContact CB-CD1 3.9Å; V385-L476 HydrophobicContact CB-CD2 4.38Å; V385-L476 HydrophobicContact CG1-CD1 3.51Å; V385-L476 HydrophobicContact CG1-CD2 4.05Å; V385-L476 HydrophobicContact CG1-CG 4.43Å; L389-L476 HydrophobicContact CD1-CB 4.38Å; L389-L476 HydrophobicContact CD1-CD2 3.77Å; I402-L476 HydrophobicContact CG2-CB 4.12Å; I402-L476 HydrophobicContact CG2-CD1 4.43Å; D472-L476 VanDerWaalsContact O-CB 3.25Å; D472-L476 WeakPolarHBondContact O-CB 3.43Å; D472-L476 PolarHBondContact O-N 2.58Å; V473-L476 PolarHBondContact O-N 2.91Å; F474-L476 VanDerWaalsContact C-N 3.34Å; F474-L476 PolarHBondContact O-N 2.76Å; L476-L478 PolarHBondContact O-N 2.88Å; L476-T479 WeakPolarHBondContact O-CB 3.4Å; L476-T479 PolarHBondContact O-N 3.32Å; L476-V480 HydrophobicContact CD1-CG2 4.39Å; L476-V480 WeakPolarHBondContact O-CG2 3.32Å; L476-V480 PolarHBondContact O-N 3.05Å; L476-M522 HydrophobicContact CB-CE 4.34Å; L476-M522 HydrophobicContact CG-CE 4.23Å
477	A	98.6	Very high	96.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.9	-45.7	175.2	0	0	0	0	0	111.8	V473 F474 T479 V480 V481 L519 M522 I523	V473-A477 PolarHBondContact O-N 2.74Å; F474-A477 PolarHBondContact O-N 3.28Å; A477-T479 VanDerWaalsContact C-N 3.28Å; A477-T479 PolarHBondContact O-N 2.94Å; A477-V480 PolarHBondContact O-N 3.27Å; A477-V481 VanDerWaalsContact O-CG2 3.31Å; A477-V481 WeakPolarHBondContact O-CG2 3.11Å; A477-V481 PolarHBondContact O-N 3.44Å; A477-L519 HydrophobicContact CB-CD2 4.28Å; A477-M522 HydrophobicContact CB-CB 3.56Å; A477-M522 HydrophobicContact CB-CE 3.83Å; A477-M522 HydrophobicContact CB-CG 4.48Å; A477-M522 HydrophobicContact CB-SD 4.2Å; A477-I523 HydrophobicContact CB-CG2 3.66Å
478	L	98.5	Very high	96.7	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.4	-34.2	176	-67	-176.4	0	0	0	112.5	Y455 F474 A475 L476 V481 S482 L489 I499 P505 I523	Y455-L478 HydrophobicContact CD1-CB 3.87Å; Y455-L478 HydrophobicContact CE1-CB 4.32Å; F474-L478 HydrophobicContact CD1-CD1 3.97Å; F474-L478 HydrophobicContact CE1-CD1 3.38Å; F474-L478 HydrophobicContact CE1-CG 4.32Å; F474-L478 HydrophobicContact CZ-CD1 3.91Å; F474-L478 PolarHBondContact O-N 3.44Å; F474-L478 VanDerWaalsContact O-N 3.13Å; A475-L478 PolarHBondContact O-N 3.38Å; L476-L478 PolarHBondContact O-N 2.88Å; L478-V481 PolarHBondContact O-N 2.96Å; L478-S482 PolarHBondContact O-N 3.22Å; L478-S482 PolarHBondContact O-OG 3.45Å; L478-L489 HydrophobicContact CB-CD1 3.92Å; L478-I499 HydrophobicContact CD1-CG2 3.97Å; L478-I499 HydrophobicContact CD2-CG2 3.65Å; L478-I499 HydrophobicContact CG-CG2 4.42Å; L478-P505 HydrophobicContact CD2-CG 4.4Å; L478-I523 HydrophobicContact CD2-CG2 4.04Å; L478-I523 HydrophobicContact CG-CG2 4.19Å
479	T	98.4	Very high	96.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63	-42.7	172.7	-63.2	0	0	0	0	112.5	L359 K403 P404 I407 A475 L476 A477 T483	L359-T479 HydrophobicContact CD2-CG2 3.91Å; K403-T479 WeakPolarHBondContact CA-OG1 3.37Å; P404-T479 HydrophobicContact CG-CG2 4.01Å; I407-T479 HydrophobicContact CD1-CG2 3.51Å; A475-T479 WeakPolarHBondContact O-CB 3.49Å; A475-T479 PolarHBondContact O-N 2.93Å; A475-T479 PolarHBondContact O-OG1 3.13Å; L476-T479 WeakPolarHBondContact O-CB 3.4Å; L476-T479 PolarHBondContact O-N 3.32Å; A477-T479 VanDerWaalsContact C-N 3.28Å; A477-T479 PolarHBondContact O-N 2.94Å; T479-T483 PolarHBondContact O-N 3.09Å; T479-T483 VanDerWaalsContact O-N 3.1Å; T479-T483 PolarHBondContact O-OG1 2.95Å
480	V	98.1	Very high	96.7	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-66.4	-40.8	174	176.4	0	0	0	0	111	L378 L381 L382 L476 A477 T483 S484 F515 L519	L378-V480 HydrophobicContact CB-CG1 4.18Å; L378-V480 HydrophobicContact CD2-CG1 4.14Å; L381-V480 HydrophobicContact CD2-CG2 4.28Å; L381-V480 HydrophobicContact CG-CG2 4.5Å; L382-V480 HydrophobicContact CB-CG2 4Å; L382-V480 HydrophobicContact CD1-CG2 4.2Å; L476-V480 HydrophobicContact CD1-CG2 4.39Å; L476-V480 WeakPolarHBondContact O-CG2 3.32Å; L476-V480 PolarHBondContact O-N 3.05Å; A477-V480 PolarHBondContact O-N 3.27Å; V480-T483 CarbonylContact O-C 3.46Å; V480-T483 WeakPolarHBondContact O-CA 3.28Å; V480-T483 WeakPolarHBondContact O-CB 3.2Å; V480-T483 PolarHBondContact O-N 2.89Å; V480-T483 VanDerWaalsContact O-N 3.1Å; V480-S484 PolarHBondContact O-N 3.33Å; V480-F515 HydrophobicContact CG1-CZ 3.98Å; V480-L519 HydrophobicContact CB-CD2 4.09Å; V480-L519 HydrophobicContact CG1-CD1 4.41Å; V480-L519 HydrophobicContact CG1-CD2 3.97Å
481	V	97.6	Very high	96.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.1	-47.2	175.9	172.3	0	0	0	0	111.5	A477 L478 T483 S484 A486 L504 P505 I507 L519	A477-V481 VanDerWaalsContact O-CG2 3.31Å; A477-V481 WeakPolarHBondContact O-CG2 3.11Å; A477-V481 PolarHBondContact O-N 3.44Å; L478-V481 PolarHBondContact O-N 2.96Å; V481-T483 PolarHBondContact O-N 2.88Å; V481-S484 PolarHBondContact O-N 3.13Å; V481-S484 VanDerWaalsContact O-N 3.09Å; V481-S484 PolarHBondContact O-OG 2.82Å; V481-A486 HydrophobicContact CG1-CB 3.7Å; V481-A486 WeakPolarHBondContact O-CB 3.41Å; V481-L504 HydrophobicContact CG2-CD1 3.75Å; V481-L504 HydrophobicContact CG2-CG 4.34Å; V481-P505 HydrophobicContact CG1-CB 3.83Å; V481-P505 HydrophobicContact CG1-CG 3.86Å; V481-I507 HydrophobicContact CG1-CD1 4.39Å; V481-I507 HydrophobicContact CG1-CG1 4.22Å; V481-I507 HydrophobicContact CG2-CD1 4.32Å; V481-L519 HydrophobicContact CG2-CD1 4.39Å
482	S	96.3	Very high	96.4	Very high	12 Å²	12	25.2 Å²	25.2	8%	0.084	15%	0.15	C	C	.	.	H	α-helix	trans	-59.4	-33.8	173.4	-61.2	0	0	0	0	112.7	L478 S484 L489	L478-S482 PolarHBondContact O-N 3.22Å; L478-S482 PolarHBondContact O-OG 3.45Å; S482-S484 VanDerWaalsContact C-N 3.34Å; S482-L489 WeakPolarHBondContact OG-CD1 3.4Å; S482-L489 WeakPolarHBondContact OG-CG 3.39Å
483	T	95.3	Very high	96.3	Very high	3 Å²	3	27 Å²	27	2%	0.018	17%	0.169	C	C	.	.	H	α-helix	trans	-72.9	-27	177.5	-50.5	0	0	0	0	112.8	L359 I363 L373 L378 L381 T479 V480 V481 G485	L359-T483 HydrophobicContact CD1-CG2 3.89Å; L359-T483 WeakPolarHBondContact CD2-OG1 2.97Å; L359-T483 HydrophobicContact CG-CG2 4.44Å; I363-T483 HydrophobicContact CG1-CG2 4.5Å; L373-T483 HydrophobicContact CB-CG2 4.32Å; L373-T483 HydrophobicContact CD1-CG2 3.46Å; L373-T483 VanDerWaalsContact CD1-CG2 3.46Å; L373-T483 HydrophobicContact CG-CG2 3.82Å; L378-T483 HydrophobicContact CD2-CG2 3.76Å; L381-T483 HydrophobicContact CD2-CG2 3.89Å; T479-T483 PolarHBondContact O-N 3.09Å; T479-T483 VanDerWaalsContact O-N 3.1Å; T479-T483 PolarHBondContact O-OG1 2.95Å; V480-T483 CarbonylContact O-C 3.46Å; V480-T483 WeakPolarHBondContact O-CA 3.28Å; V480-T483 WeakPolarHBondContact O-CB 3.2Å; V480-T483 PolarHBondContact O-N 2.89Å; V480-T483 VanDerWaalsContact O-N 3.1Å; V481-T483 PolarHBondContact O-N 2.88Å; T483-G485 PolarHBondContact O-N 2.93Å
484	S	94.7	Very high	96.2	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	0.7	178.3	74.8	0	0	0	0	114.9	V480 V481 S482 I507 Q509	V480-S484 PolarHBondContact O-N 3.33Å; V481-S484 PolarHBondContact O-N 3.13Å; V481-S484 VanDerWaalsContact O-N 3.09Å; V481-S484 PolarHBondContact O-OG 2.82Å; S482-S484 VanDerWaalsContact C-N 3.34Å; S484-I507 WeakPolarHBondContact OG-CG1 3.36Å; S484-I507 WeakPolarHBondContact OG-CG2 3.35Å; S484-Q509 PolarHBondContact O-NE2 3.49Å
485	G	91.6	Very high	96.1	Very high	26 Å²	26	37.8 Å²	37.8	27%	0.268	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	11	179.8	0	0	0	0	0	115	T483 P508	T483-G485 PolarHBondContact O-N 2.93Å; G485-P508 VanDerWaalsContact C-CD 3.5Å; G485-P508 WeakPolarHBondContact O-CD 3.24Å; G485-P508 VanDerWaalsContact O-CG 3.28Å; G485-P508 WeakPolarHBondContact O-CG 3.25Å
486	A	93.4	Very high	96	Very high	9 Å²	9	38.1 Å²	38.1	7%	0.074	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-58.8	159.6	175.9	0	0	0	0	0	113	V481 S506	V481-A486 HydrophobicContact CG1-CB 3.7Å; V481-A486 WeakPolarHBondContact O-CB 3.41Å; A486-S506 WeakPolarHBondContact CA-O 3.44Å; A486-S506 VanDerWaalsContact CB-O 3.25Å; A486-S506 WeakPolarHBondContact CB-O 3.47Å
487	E	92.3	Very high	95.9	Very high	121 Å²	121	42 Å²	42	57%	0.565	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-53.3	148.2	171.4	-68.8	-170.5	150.2	0	0	111.4	L489 K495	E487-L489 PolarHBondContact O-N 3.39Å; E487-K495 IonicContact OE2-NZ 2.73Å; E487-K495 PolarHBondContact OE2-NZ 3.13Å
488	P	94.3	Very high	95.9	Very high	107 Å²	107	44.5 Å²	44.5	70%	0.695	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-50.9	124.4	173.1	-27.5	35.4	0	0	0	111.9
489	L	96.7	Very high	95.8	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.063	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-59.7	136.1	-174.4	-65.5	178.4	0	0	0	111.4	R454 Y455 L478 S482 E487 I499 P505	R454-L489 HydrophobicContact CB-CB 3.98Å; R454-L489 WeakPolarHBondContact CD-O 3.46Å; R454-L489 HydrophobicContact CG-CB 4.47Å; Y455-L489 HydrophobicContact CD1-CD1 4.06Å; Y455-L489 HydrophobicContact CE1-CD1 3.58Å; L478-L489 HydrophobicContact CB-CD1 3.92Å; S482-L489 WeakPolarHBondContact OG-CD1 3.4Å; S482-L489 WeakPolarHBondContact OG-CG 3.39Å; E487-L489 PolarHBondContact O-N 3.39Å; L489-I499 HydrophobicContact CD2-CD1 4.33Å; L489-P505 HydrophobicContact CD2-CG 3.9Å
490	P	96.5	Very high	95.8	Very high	29 Å²	29	45.3 Å²	45.3	19%	0.188	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-64.5	143.7	179.5	30	-37.5	0	0	0	110.7	K495 W496 I499	P490-K495 HydrophobicContact CB-CB 4.09Å; P490-K495 HydrophobicContact CG-CB 3.89Å; P490-W496 HydrophobicContact CB-CB 4.25Å; P490-W496 HydrophobicContact CG-CB 4.06Å; P490-I499 HydrophobicContact CG-CD1 3.87Å
491	T	95.3	Very high	95.7	Very high	80 Å²	80	51.9 Å²	51.9	49%	0.491	28%	0.275	S	S	.	.	S	Bend	trans	-83	-27.5	175.7	46.3	0	0	0	0	113	S453 R454	S453-T491 PolarHBondContact OG-O 3.47Å; R454-T491 HydrophobicContact CG-CG2 3.77Å
492	N	94.6	Very high	95.7	Very high	122 Å²	122	52.2 Å²	52.2	65%	0.652	28%	0.279	S	S	*	.	S	Bend	trans	-162.3	-174.4	178.7	59.8	18.8	0	0	0	111	W496	N492-W496 WeakPolarHBondContact O-CB 3Å
493	G	95.7	Very high	95.7	Very high	37 Å²	37	57 Å²	57	38%	0.381	30%	0.298	S	S	.	.	S	Bend	trans	81.1	-170.6	173.4	0	0	0	0	0	115	K495 W496 H497	G493-K495 PolarHBondContact O-N 3.46Å; G493-W496 WeakPolarHBondContact O-CA 3.03Å; G493-W496 WeakPolarHBondContact O-CB 3.46Å; G493-W496 PolarHBondContact O-N 2.92Å; G493-H497 PolarHBondContact O-CD2 3.16Å; G493-H497 VanDerWaalsContact O-CD2 3.26Å; G493-H497 PolarHBondContact O-N 3.19Å; G493-H497 VanDerWaalsContact O-N 3.11Å
494	E	96.3	Very high	95.7	Very high	112 Å²	112	58.5 Å²	58.5	52%	0.523	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-41.8	-167.1	-169.4	53	-143.5	0	0	113.6	W496 H497 E498 R501	E494-W496 PolarHBondContact O-N 3.26Å; E494-H497 PolarHBondContact O-N 3.39Å; E494-H497 VanDerWaalsContact O-N 3.13Å; E494-E498 WeakPolarHBondContact O-CG 3.43Å; E494-E498 PolarHBondContact O-N 2.89Å; E494-R501 IonicContact OE1-CZ 2.68Å; E494-R501 IonicContact OE1-NH1 2.66Å; E494-R501 PolarHBondContact OE1-NH1 3.35Å; E494-R501 IonicContact OE1-NH2 2.65Å; E494-R501 PolarHBondContact OE1-NH2 2.91Å
495	K	96.4	Very high	95.8	Very high	117 Å²	117	59.7 Å²	59.7	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-57.3	-31	171.6	-78.6	-168.7	172.9	-175.7	0	112.1	E487 P490 G493 I499	E487-K495 IonicContact OE2-NZ 2.73Å; E487-K495 PolarHBondContact OE2-NZ 3.13Å; P490-K495 HydrophobicContact CB-CB 4.09Å; P490-K495 HydrophobicContact CG-CB 3.89Å; G493-K495 PolarHBondContact O-N 3.46Å; K495-I499 WeakPolarHBondContact O-CD1 3.39Å; K495-I499 WeakPolarHBondContact O-CG1 3.33Å
496	W	97.1	Very high	95.9	Very high	11 Å²	11	63.2 Å²	63.2	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-70.9	-45.5	176.3	-177.6	103.6	0	0	0	111.1	S453 L461 P490 N492 G493 E494 I499 R500	S453-W496 PolarHBondContact O-NE1 3.49Å; L461-W496 HydrophobicContact CD2-CH2 3.59Å; L461-W496 HydrophobicContact CD2-CZ2 4.17Å; L461-W496 HydrophobicContact CD2-CZ3 4.36Å; P490-W496 HydrophobicContact CB-CB 4.25Å; P490-W496 HydrophobicContact CG-CB 4.06Å; N492-W496 WeakPolarHBondContact O-CB 3Å; G493-W496 WeakPolarHBondContact O-CA 3.03Å; G493-W496 WeakPolarHBondContact O-CB 3.46Å; G493-W496 PolarHBondContact O-N 2.92Å; E494-W496 PolarHBondContact O-N 3.26Å; W496-I499 PolarHBondContact O-N 3.48Å; W496-R500 VanDerWaalsContact CD1-NH1 3.31Å; W496-R500 HydrophobicContact CE3-CG 4.47Å; W496-R500 HydrophobicContact CH2-CG 3.96Å; W496-R500 HydrophobicContact CZ2-CG 4.41Å; W496-R500 VanDerWaalsContact CZ2-NE 3.34Å; W496-R500 HydrophobicContact CZ3-CG 4.01Å; W496-R500 VanDerWaalsContact NE1-CZ 3.3Å; W496-R500 WeakPolarHBondContact O-CD 3.25Å; W496-R500 PolarHBondContact O-N 3.33Å; W496-R500 PolarHBondContact O-NH1 3.18Å
497	H	96.6	Very high	96	Very high	82 Å²	82	64.1 Å²	64.1	38%	0.38	34%	0.337	S	S	.	.	H	α-helix	trans	-66.8	-38.2	177.4	-67.5	-69	0	0	0	112.3	G493 E494 I499 R500 R501	G493-H497 PolarHBondContact O-CD2 3.16Å; G493-H497 VanDerWaalsContact O-CD2 3.26Å; G493-H497 PolarHBondContact O-N 3.19Å; G493-H497 VanDerWaalsContact O-N 3.11Å; E494-H497 PolarHBondContact O-N 3.39Å; E494-H497 VanDerWaalsContact O-N 3.13Å; H497-I499 VanDerWaalsContact C-N 3.26Å; H497-I499 PolarHBondContact O-N 3.19Å; H497-R500 CarbonylContact O-C 3.55Å; H497-R500 PolarHBondContact O-N 3.1Å; H497-R501 WeakPolarHBondContact O-CG 3.35Å; H497-R501 PolarHBondContact O-N 3.41Å
498	E	97.5	Very high	96	Very high	52 Å²	52	62.2 Å²	62.2	24%	0.243	34%	0.336	C	S	.	.	H	α-helix	trans	-51.6	-44.8	174.2	-80.3	-162.7	135.3	0	0	112.6	E494 R500 R501 G502 K503	E494-E498 WeakPolarHBondContact O-CG 3.43Å; E494-E498 PolarHBondContact O-N 2.89Å; E498-R500 PolarHBondContact O-N 3.4Å; E498-R501 CarbonylContact O-C 3.43Å; E498-R501 WeakPolarHBondContact O-CA 3.31Å; E498-R501 PolarHBondContact O-N 3.36Å; E498-R501 VanDerWaalsContact O-N 3.15Å; E498-G502 PolarHBondContact O-N 3.38Å; E498-K503 HydrophobicContact CB-CB 4.23Å; E498-K503 HydrophobicContact CB-CD 3.89Å; E498-K503 VanDerWaalsContact CD-CD 3.43Å; E498-K503 HydrophobicContact CG-CD 4.04Å; E498-K503 VanDerWaalsContact O-CB 3.24Å; E498-K503 WeakPolarHBondContact O-CB 3.48Å; E498-K503 PolarHBondContact O-N 2.98Å; E498-K503 WeakPolarHBondContact OE1-CD 3.37Å; E498-K503 IonicContact OE1-NZ 3.46Å; E498-K503 PolarHBondContact OE1-NZ 3.31Å; E498-K503 WeakPolarHBondContact OE2-CD 3.38Å; E498-K503 IonicContact OE2-NZ 3.34Å; E498-K503 PolarHBondContact OE2-NZ 3.05Å
499	I	97.8	Very high	95.8	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.046	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-43	177.8	-64.6	166.3	0	0	0	110.8	F474 L478 L489 P490 K495 W496 H497 R501 G502 K503 P505	F474-I499 HydrophobicContact CZ-CG2 4.12Å; L478-I499 HydrophobicContact CD1-CG2 3.97Å; L478-I499 HydrophobicContact CD2-CG2 3.65Å; L478-I499 HydrophobicContact CG-CG2 4.42Å; L489-I499 HydrophobicContact CD2-CD1 4.33Å; P490-I499 HydrophobicContact CG-CD1 3.87Å; K495-I499 WeakPolarHBondContact O-CD1 3.39Å; K495-I499 WeakPolarHBondContact O-CG1 3.33Å; W496-I499 PolarHBondContact O-N 3.48Å; H497-I499 VanDerWaalsContact C-N 3.26Å; H497-I499 PolarHBondContact O-N 3.19Å; I499-R501 PolarHBondContact O-N 3.46Å; I499-G502 PolarHBondContact O-N 3.29Å; I499-K503 WeakPolarHBondContact CA-O 3.39Å; I499-P505 HydrophobicContact CD1-CG 3.9Å; I499-P505 HydrophobicContact CG1-CG 4Å
500	R	97.3	Very high	95.5	Very high	8 Å²	8	64.6 Å²	64.6	3%	0.03	35%	0.347	C	S	.	.	H	α-helix	trans	-70.9	-19.2	178.1	-79.7	77.4	-168.1	163	4.6	112.5	S453 R454 L456 N458 F474 W496 H497 E498 G502 P525	S453-R500 PolarHBondContact O-NH2 3.26Å; S453-R500 VanDerWaalsContact O-NH2 3.16Å; R454-R500 VanDerWaalsContact C-NH2 3.33Å; R454-R500 PolarHBondContact O-NH2 3.11Å; L456-R500 VanDerWaalsContact O-CZ 3.3Å; L456-R500 PolarHBondContact O-NE 2.71Å; L456-R500 PolarHBondContact O-NH2 3.09Å; N458-R500 HydrophobicContact CB-CB 3.98Å; N458-R500 HydrophobicContact CB-CG 3.76Å; F474-R500 HydrophobicContact CZ-CG 4Å; W496-R500 VanDerWaalsContact CD1-NH1 3.31Å; W496-R500 HydrophobicContact CE3-CG 4.47Å; W496-R500 HydrophobicContact CH2-CG 3.96Å; W496-R500 HydrophobicContact CZ2-CG 4.41Å; W496-R500 VanDerWaalsContact CZ2-NE 3.34Å; W496-R500 HydrophobicContact CZ3-CG 4.01Å; W496-R500 VanDerWaalsContact NE1-CZ 3.3Å; W496-R500 WeakPolarHBondContact O-CD 3.25Å; W496-R500 PolarHBondContact O-N 3.33Å; W496-R500 PolarHBondContact O-NH1 3.18Å; H497-R500 CarbonylContact O-C 3.55Å; H497-R500 PolarHBondContact O-N 3.1Å; E498-R500 PolarHBondContact O-N 3.4Å; R500-G502 VanDerWaalsContact C-N 3.27Å; R500-P525 WeakPolarHBondContact O-CB 3.5Å; R500-P525 WeakPolarHBondContact O-CG 3.42Å
501	R	97.2	Very high	95.4	Very high	139 Å²	139	63.7 Å²	63.7	53%	0.525	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	9.7	167.4	-61.8	-172.1	-51.9	-110.4	6.1	113.3	E494 H497 E498 I499	E494-R501 IonicContact OE1-CZ 2.68Å; E494-R501 IonicContact OE1-NH1 2.66Å; E494-R501 PolarHBondContact OE1-NH1 3.35Å; E494-R501 IonicContact OE1-NH2 2.65Å; E494-R501 PolarHBondContact OE1-NH2 2.91Å; H497-R501 WeakPolarHBondContact O-CG 3.35Å; H497-R501 PolarHBondContact O-N 3.41Å; E498-R501 CarbonylContact O-C 3.43Å; E498-R501 WeakPolarHBondContact O-CA 3.31Å; E498-R501 PolarHBondContact O-N 3.36Å; E498-R501 VanDerWaalsContact O-N 3.15Å; I499-R501 PolarHBondContact O-N 3.46Å
502	G	96.3	Very high	95.4	Very high	7 Å²	7	61.7 Å²	61.7	7%	0.072	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	16.2	175	0	0	0	0	0	115	E498 I499 R500 L504 K520	E498-G502 PolarHBondContact O-N 3.38Å; I499-G502 PolarHBondContact O-N 3.29Å; R500-G502 VanDerWaalsContact C-N 3.27Å; G502-L504 PolarHBondContact O-N 2.89Å; G502-K520 WeakPolarHBondContact O-CE 3.44Å
503	K	97.3	Very high	95.4	Very high	113 Å²	113	63 Å²	63	49%	0.491	34%	0.335	S	S	.	.			trans	-84.1	107	170.9	-167.7	-167	-176.4	-173.6	0	108.8	E498 I499	E498-K503 HydrophobicContact CB-CB 4.23Å; E498-K503 HydrophobicContact CB-CD 3.89Å; E498-K503 VanDerWaalsContact CD-CD 3.43Å; E498-K503 HydrophobicContact CG-CD 4.04Å; E498-K503 VanDerWaalsContact O-CB 3.24Å; E498-K503 WeakPolarHBondContact O-CB 3.48Å; E498-K503 PolarHBondContact O-N 2.98Å; E498-K503 WeakPolarHBondContact OE1-CD 3.37Å; E498-K503 IonicContact OE1-NZ 3.46Å; E498-K503 PolarHBondContact OE1-NZ 3.31Å; E498-K503 WeakPolarHBondContact OE2-CD 3.38Å; E498-K503 IonicContact OE2-NZ 3.34Å; E498-K503 PolarHBondContact OE2-NZ 3.05Å; I499-K503 WeakPolarHBondContact CA-O 3.39Å
504	L	95.8	Very high	95.4	Very high	35 Å²	35	67.1 Å²	67.1	18%	0.183	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-61.1	137	176.8	-161.9	70	0	0	0	109.8	V481 G502 I507 L516 L519 I523	V481-L504 HydrophobicContact CG2-CD1 3.75Å; V481-L504 HydrophobicContact CG2-CG 4.34Å; G502-L504 PolarHBondContact O-N 2.89Å; L504-I507 HydrophobicContact CD2-CD1 4.19Å; L504-L516 HydrophobicContact CD2-CD2 3.99Å; L504-L519 HydrophobicContact CD1-CB 4.11Å; L504-L519 HydrophobicContact CD2-CB 4.27Å; L504-I523 HydrophobicContact CB-CD1 4.24Å; L504-I523 HydrophobicContact CD1-CD1 3.75Å; L504-I523 HydrophobicContact CD1-CG1 4.23Å
505	P	95.9	Very high	95.4	Very high	26 Å²	26	61.8 Å²	61.8	17%	0.169	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-56.5	156.7	171.6	-24.5	33.4	0	0	0	112.4	L478 V481 L489 I499	L478-P505 HydrophobicContact CD2-CG 4.4Å; V481-P505 HydrophobicContact CG1-CB 3.83Å; V481-P505 HydrophobicContact CG1-CG 3.86Å; L489-P505 HydrophobicContact CD2-CG 3.9Å; I499-P505 HydrophobicContact CD1-CG 3.9Å; I499-P505 HydrophobicContact CG1-CG 4Å
506	S	94.3	Very high	95.4	Very high	100 Å²	100	58.9 Å²	58.9	70%	0.699	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-67.8	133.1	175.2	-165.2	0	0	0	0	110.8	A486	A486-S506 WeakPolarHBondContact CA-O 3.44Å; A486-S506 VanDerWaalsContact CB-O 3.25Å; A486-S506 WeakPolarHBondContact CB-O 3.47Å
507	I	94.8	Very high	95.4	Very high	27 Å²	27	62 Å²	62	14%	0.138	33%	0.332	C	S	.	.			trans	-115.4	127.5	179.6	-63.8	174.5	0	0	0	107.3	V481 S484 L504 Q509 L511 L516	V481-I507 HydrophobicContact CG1-CD1 4.39Å; V481-I507 HydrophobicContact CG1-CG1 4.22Å; V481-I507 HydrophobicContact CG2-CD1 4.32Å; S484-I507 WeakPolarHBondContact OG-CG1 3.36Å; S484-I507 WeakPolarHBondContact OG-CG2 3.35Å; L504-I507 HydrophobicContact CD2-CD1 4.19Å; I507-Q509 VanDerWaalsContact C-N 3.26Å; I507-Q509 HydrophobicContact CG2-CG 3.69Å; I507-Q509 PolarHBondContact O-N 3.3Å; I507-L511 HydrophobicContact CD1-CD1 3.86Å; I507-L511 HydrophobicContact CG2-CD1 4Å; I507-L511 HydrophobicContact CG2-CG 4.37Å; I507-L516 HydrophobicContact CD1-CD2 3.97Å
508	P	91.5	Very high	95.5	Very high	82 Å²	82	58.2 Å²	58.2	53%	0.532	32%	0.315	S	S	.	.	S	Bend	trans	-79.7	-4.1	-173	34.3	-39.5	0	0	0	114.2	Y372 G485	Y372-P508 HydrophobicContact CD1-CG 4.45Å; G485-P508 VanDerWaalsContact C-CD 3.5Å; G485-P508 WeakPolarHBondContact O-CD 3.24Å; G485-P508 VanDerWaalsContact O-CG 3.28Å; G485-P508 WeakPolarHBondContact O-CG 3.25Å
509	Q	90.6	Very high	95.5	Very high	24 Å²	24	55.8 Å²	55.8	11%	0.112	30%	0.304	C	S	.	.	S	Bend	trans	-112.6	150.5	179.8	67.6	172.2	-66.7	0	0	111.8	Y372 L373 S484 I507 L511	Y372-Q509 HydrophobicContact CD2-CB 3.99Å; Y372-Q509 VanDerWaalsContact CD2-CD 3.5Å; Y372-Q509 HydrophobicContact CD2-CG 4.23Å; Y372-Q509 VanDerWaalsContact CD2-NE2 3.25Å; Y372-Q509 HydrophobicContact CE1-CB 4.24Å; Y372-Q509 HydrophobicContact CE2-CB 3.46Å; Y372-Q509 VanDerWaalsContact CE2-CB 3.46Å; Y372-Q509 HydrophobicContact CE2-CG 4.18Å; L373-Q509 PolarHBondContact O-NE2 2.96Å; L373-Q509 PolarHBondContact O-OE1 3.44Å; S484-Q509 PolarHBondContact O-NE2 3.49Å; I507-Q509 VanDerWaalsContact C-N 3.26Å; I507-Q509 HydrophobicContact CG2-CG 3.69Å; I507-Q509 PolarHBondContact O-N 3.3Å; Q509-L511 HydrophobicContact CG-CD2 3.96Å; Q509-L511 HydrophobicContact CG-CG 4.09Å; Q509-L511 PolarHBondContact O-N 2.86Å
510	V	91.5	Very high	95.5	Very high	145 Å²	145	61.1 Å²	61.1	88%	0.879	33%	0.327	S	S	*	.			trans	-75.2	111.4	174.8	-179.3	0	0	0	0	109
511	L	94.5	Very high	95.6	Very high	9 Å²	9	64.2 Å²	64.2	5%	0.047	34%	0.343	C	S	.	.			trans	-106.4	151.3	170.5	-61.2	179.3	0	0	0	109.8	E375 L378 I507 Q509 F515 L516	E375-L511 HydrophobicContact CB-CD2 3.73Å; E375-L511 HydrophobicContact CG-CD2 4.02Å; E375-L511 WeakPolarHBondContact OE2-CA 3.38Å; L378-L511 HydrophobicContact CD1-CD1 4.48Å; L378-L511 HydrophobicContact CD1-CD2 4.03Å; I507-L511 HydrophobicContact CD1-CD1 3.86Å; I507-L511 HydrophobicContact CG2-CD1 4Å; I507-L511 HydrophobicContact CG2-CG 4.37Å; Q509-L511 HydrophobicContact CG-CD2 3.96Å; Q509-L511 HydrophobicContact CG-CG 4.09Å; Q509-L511 PolarHBondContact O-N 2.86Å; L511-F515 HydrophobicContact CB-CD1 4.31Å; L511-F515 HydrophobicContact CD1-CD1 4Å; L511-F515 HydrophobicContact CD1-CE1 4.11Å; L511-F515 HydrophobicContact CD2-CD1 4.33Å; L511-F515 HydrophobicContact CD2-CE1 4.48Å; L511-F515 HydrophobicContact CG-CD1 4.45Å; L511-L516 HydrophobicContact CB-CD1 4.28Å; L511-L516 HydrophobicContact CB-CD2 3.99Å; L511-L516 HydrophobicContact CB-CG 3.88Å; L511-L516 HydrophobicContact CD1-CD2 4.01Å; L511-L516 WeakPolarHBondContact O-CD1 3.23Å
512	S	94.7	Very high	95.6	Very high	39 Å²	39	57.6 Å²	57.6	27%	0.273	32%	0.318	S	S	.	.			trans	-59.6	144.6	176.7	71.7	0	0	0	0	112.1	E375 E514 F515 L516	E375-S512 VanDerWaalsContact OE1-CB 3.25Å; E375-S512 WeakPolarHBondContact OE1-CB 3.48Å; E375-S512 PolarHBondContact OE1-OG 3.38Å; E375-S512 PolarHBondContact OE2-N 3.41Å; S512-E514 PolarHBondContact O-N 2.78Å; S512-F515 PolarHBondContact O-N 3.27Å; S512-F515 WeakPolarHBondContact OG-CB 3.2Å; S512-F515 PolarHBondContact OG-N 3.31Å; S512-L516 PolarHBondContact O-N 3.11Å
513	I	94.9	Very high	95.7	Very high	148 Å²	148	57.2 Å²	57.2	76%	0.759	32%	0.315	S	S	*	.	H	α-helix	trans	-58.4	-35.5	-179.2	-59.7	173	0	0	0	110.7	S517	I513-S517 WeakPolarHBondContact O-CB 3.21Å; I513-S517 PolarHBondContact O-N 2.9Å
514	E	95.4	Very high	95.8	Very high	124 Å²	124	54.3 Å²	54.3	58%	0.579	30%	0.303	S	S	*	.	H	α-helix	trans	-65	-40.1	176.6	-48.6	-173.5	151.7	0	0	112.5	S512 L518 V541	S512-E514 PolarHBondContact O-N 2.78Å; E514-L518 PolarHBondContact O-N 2.99Å; E514-V541 HydrophobicContact CB-CG1 4.44Å; E514-V541 HydrophobicContact CB-CG2 3.54Å
515	F	96.3	Very high	95.9	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-74.7	-40.2	179.3	-172.1	-129.7	0	0	0	112	E375 L378 K379 L382 V480 L511 S512 S517 L518 L519 V541 L542	E375-F515 HydrophobicContact CG-CD1 3.79Å; E375-F515 HydrophobicContact CG-CE1 4.19Å; E375-F515 HydrophobicContact CG-CG 4.41Å; L378-F515 HydrophobicContact CB-CE1 3.88Å; L378-F515 HydrophobicContact CB-CZ 3.89Å; L378-F515 HydrophobicContact CD1-CE1 4.39Å; K379-F515 HydrophobicContact CG-CD2 3.88Å; K379-F515 HydrophobicContact CG-CE1 4.43Å; K379-F515 HydrophobicContact CG-CE2 3.63Å; K379-F515 HydrophobicContact CG-CG 4.39Å; K379-F515 HydrophobicContact CG-CZ 3.93Å; L382-F515 HydrophobicContact CD2-CE2 3.96Å; V480-F515 HydrophobicContact CG1-CZ 3.98Å; L511-F515 HydrophobicContact CB-CD1 4.31Å; L511-F515 HydrophobicContact CD1-CD1 4Å; L511-F515 HydrophobicContact CD1-CE1 4.11Å; L511-F515 HydrophobicContact CD2-CD1 4.33Å; L511-F515 HydrophobicContact CD2-CE1 4.48Å; L511-F515 HydrophobicContact CG-CD1 4.45Å; S512-F515 PolarHBondContact O-N 3.27Å; S512-F515 WeakPolarHBondContact OG-CB 3.2Å; S512-F515 PolarHBondContact OG-N 3.31Å; F515-S517 VanDerWaalsContact C-N 3.32Å; F515-S517 PolarHBondContact O-N 3.02Å; F515-L518 PolarHBondContact O-N 2.82Å; F515-L519 HydrophobicContact CD1-CD1 4.31Å; F515-L519 HydrophobicContact CE1-CD1 4.07Å; F515-L519 HydrophobicContact CE2-CG 4.47Å; F515-L519 HydrophobicContact CZ-CD1 4.21Å; F515-L519 WeakPolarHBondContact O-CG 3.25Å; F515-L519 PolarHBondContact O-N 3.11Å; F515-V541 HydrophobicContact CB-CG1 3.85Å; F515-V541 HydrophobicContact CD2-CG1 3.93Å; F515-V541 HydrophobicContact CG-CG1 4.33Å; F515-L542 HydrophobicContact CD2-CD2 4.3Å; F515-L542 HydrophobicContact CE2-CD2 4.05Å
516	L	96.8	Very high	96	Very high	57 Å²	57	56.6 Å²	56.6	30%	0.298	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-40	170.8	-69.2	172.1	0	0	0	111.8	L504 I507 L511 S512 L519 K520	L504-L516 HydrophobicContact CD2-CD2 3.99Å; I507-L516 HydrophobicContact CD1-CD2 3.97Å; L511-L516 HydrophobicContact CB-CD1 4.28Å; L511-L516 HydrophobicContact CB-CD2 3.99Å; L511-L516 HydrophobicContact CB-CG 3.88Å; L511-L516 HydrophobicContact CD1-CD2 4.01Å; L511-L516 WeakPolarHBondContact O-CD1 3.23Å; S512-L516 PolarHBondContact O-N 3.11Å; L516-L519 PolarHBondContact O-N 3.35Å; L516-K520 WeakPolarHBondContact O-CB 3.43Å; L516-K520 PolarHBondContact O-N 3.13Å
517	S	97.1	Very high	96.1	Very high	75 Å²	75	52.5 Å²	52.5	52%	0.524	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-44.3	174.9	-171.6	0	0	0	0	111.7	I513 F515 K520 L521	I513-S517 WeakPolarHBondContact O-CB 3.21Å; I513-S517 PolarHBondContact O-N 2.9Å; F515-S517 VanDerWaalsContact C-N 3.32Å; F515-S517 PolarHBondContact O-N 3.02Å; S517-K520 PolarHBondContact O-N 2.82Å; S517-L521 WeakPolarHBondContact O-CB 3.4Å; S517-L521 PolarHBondContact O-N 2.87Å
518	L	98.1	Very high	96.2	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-48.7	175.2	179.4	62	0	0	0	112.2	L382 E514 F515 K520 L521 M522 L536 V541 L542	L382-L518 HydrophobicContact CD2-CD2 4.26Å; E514-L518 PolarHBondContact O-N 2.99Å; F515-L518 PolarHBondContact O-N 2.82Å; L518-K520 VanDerWaalsContact C-N 3.3Å; L518-K520 PolarHBondContact O-N 2.86Å; L518-L521 WeakPolarHBondContact O-CB 3.31Å; L518-L521 PolarHBondContact O-N 2.68Å; L518-M522 HydrophobicContact CG-SD 4.33Å; L518-M522 WeakPolarHBondContact O-CG 3.19Å; L518-M522 PolarHBondContact O-N 3.39Å; L518-L536 HydrophobicContact CD1-CD2 3.87Å; L518-V541 HydrophobicContact CD2-CB 4.45Å; L518-L542 HydrophobicContact CD2-CD1 4.39Å; L518-L542 HydrophobicContact CD2-CD2 3.86Å; L518-L542 HydrophobicContact CD2-CG 4.06Å
519	L	98.2	Very high	96.5	Very high	1 Å²	1	57 Å²	57	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-40	177.5	-69.9	172.6	0	0	0	111.5	L382 A477 V480 V481 L504 F515 L516 M522 I523	L382-L519 HydrophobicContact CD2-CD2 4.44Å; A477-L519 HydrophobicContact CB-CD2 4.28Å; V480-L519 HydrophobicContact CB-CD2 4.09Å; V480-L519 HydrophobicContact CG1-CD1 4.41Å; V480-L519 HydrophobicContact CG1-CD2 3.97Å; V481-L519 HydrophobicContact CG2-CD1 4.39Å; L504-L519 HydrophobicContact CD1-CB 4.11Å; L504-L519 HydrophobicContact CD2-CB 4.27Å; F515-L519 HydrophobicContact CD1-CD1 4.31Å; F515-L519 HydrophobicContact CE1-CD1 4.07Å; F515-L519 HydrophobicContact CE2-CG 4.47Å; F515-L519 HydrophobicContact CZ-CD1 4.21Å; F515-L519 WeakPolarHBondContact O-CG 3.25Å; F515-L519 PolarHBondContact O-N 3.11Å; L516-L519 PolarHBondContact O-N 3.35Å; L519-M522 HydrophobicContact CD2-SD 4.41Å; L519-M522 PolarHBondContact O-N 3Å; L519-I523 PolarHBondContact O-N 3.18Å
520	K	97.9	Very high	96.9	Very high	122 Å²	122	56 Å²	56	53%	0.53	30%	0.3	S	S	.	.	H	α-helix	trans	-65.3	-37.4	175	-170	176.7	-179.6	-179.2	0	112.6	G502 L516 S517 L518 I523 H524	G502-K520 WeakPolarHBondContact O-CE 3.44Å; L516-K520 WeakPolarHBondContact O-CB 3.43Å; L516-K520 PolarHBondContact O-N 3.13Å; S517-K520 PolarHBondContact O-N 2.82Å; L518-K520 VanDerWaalsContact C-N 3.3Å; L518-K520 PolarHBondContact O-N 2.86Å; K520-I523 WeakPolarHBondContact O-CG1 3.36Å; K520-I523 PolarHBondContact O-N 2.91Å; K520-H524 PolarHBondContact O-N 3.16Å
521	L	98.3	Very high	97.2	Very high	72 Å²	72	50 Å²	50	38%	0.377	26%	0.264	S	S	.	.	H	α-helix	trans	-67.6	-37	175	-172.1	67.7	0	0	0	111.9	S517 L518 I523 H524	S517-L521 WeakPolarHBondContact O-CB 3.4Å; S517-L521 PolarHBondContact O-N 2.87Å; L518-L521 WeakPolarHBondContact O-CB 3.31Å; L518-L521 PolarHBondContact O-N 2.68Å; L521-I523 VanDerWaalsContact C-N 3.3Å; L521-I523 PolarHBondContact O-N 2.84Å; L521-H524 VanDerWaalsContact O-CB 3.24Å; L521-H524 WeakPolarHBondContact O-CB 3.46Å; L521-H524 PolarHBondContact O-N 3.33Å
522	M	98.6	Very high	97.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-28.7	175.3	-69.4	171.2	69.2	0	0	113.2	L382 V473 L476 A477 L518 L519 R530 P531 L536	L382-M522 HydrophobicContact CD1-CE 3.6Å; L382-M522 HydrophobicContact CD1-SD 4.17Å; L382-M522 HydrophobicContact CD2-SD 4.05Å; V473-M522 HydrophobicContact CG1-CB 3.9Å; V473-M522 HydrophobicContact CG1-CE 4.02Å; V473-M522 HydrophobicContact CG1-CG 3.88Å; V473-M522 WeakPolarHBondContact O-CE 3.2Å; L476-M522 HydrophobicContact CB-CE 4.34Å; L476-M522 HydrophobicContact CG-CE 4.23Å; A477-M522 HydrophobicContact CB-CB 3.56Å; A477-M522 HydrophobicContact CB-CE 3.83Å; A477-M522 HydrophobicContact CB-CG 4.48Å; A477-M522 HydrophobicContact CB-SD 4.2Å; L518-M522 HydrophobicContact CG-SD 4.33Å; L518-M522 WeakPolarHBondContact O-CG 3.19Å; L518-M522 PolarHBondContact O-N 3.39Å; L519-M522 HydrophobicContact CD2-SD 4.41Å; L519-M522 PolarHBondContact O-N 3Å; M522-R530 VanDerWaalsContact O-CD 3.25Å; M522-R530 WeakPolarHBondContact O-CD 3.33Å; M522-R530 WeakPolarHBondContact O-CG 3.33Å; M522-P531 HydrophobicContact CG-CG 3.97Å; M522-L536 HydrophobicContact CE-CD1 3.87Å; M522-L536 HydrophobicContact CE-CD2 4.37Å; M522-L536 HydrophobicContact CG-CD2 3.94Å; M522-L536 HydrophobicContact SD-CD1 4.35Å; M522-L536 HydrophobicContact SD-CD2 3.76Å
523	I	98.3	Very high	97.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	16.1	172.7	67.9	157.9	0	0	0	114.1	F474 A477 L478 L504 L519 K520 L521	F474-I523 HydrophobicContact CD2-CB 3.95Å; F474-I523 HydrophobicContact CD2-CG2 4.14Å; F474-I523 HydrophobicContact CE2-CB 3.94Å; F474-I523 HydrophobicContact CE2-CG2 4.29Å; A477-I523 HydrophobicContact CB-CG2 3.66Å; L478-I523 HydrophobicContact CD2-CG2 4.04Å; L478-I523 HydrophobicContact CG-CG2 4.19Å; L504-I523 HydrophobicContact CB-CD1 4.24Å; L504-I523 HydrophobicContact CD1-CD1 3.75Å; L504-I523 HydrophobicContact CD1-CG1 4.23Å; L519-I523 PolarHBondContact O-N 3.18Å; K520-I523 WeakPolarHBondContact O-CG1 3.36Å; K520-I523 PolarHBondContact O-N 2.91Å; L521-I523 VanDerWaalsContact C-N 3.3Å; L521-I523 PolarHBondContact O-N 2.84Å
524	H	98.5	Very high	97.5	Very high	52 Å²	52	44.9 Å²	44.9	24%	0.241	24%	0.242	C	C	.	.			trans	-59.1	136.7	-179.5	-176	-78.9	0	0	0	111.1	K520 L521 D526 R530	K520-H524 PolarHBondContact O-N 3.16Å; L521-H524 VanDerWaalsContact O-CB 3.24Å; L521-H524 WeakPolarHBondContact O-CB 3.46Å; L521-H524 PolarHBondContact O-N 3.33Å; H524-D526 PolarHBondContact ND1-N 3.44Å; H524-D526 PolarHBondContact ND1-O 3.47Å; H524-D526 VanDerWaalsContact ND1-O 3.1Å; H524-D526 PolarHBondContact O-N 2.79Å; H524-R530 HydrophobicContact CB-CG 4.22Å; H524-R530 PolarHBondContact O-NE 3.39Å; H524-R530 PolarHBondContact O-NH2 2.94Å
525	P	97.6	Very high	97.5	Very high	51 Å²	51	42.7 Å²	42.7	33%	0.331	23%	0.234	S	C	.	.	S	Bend	trans	-54.7	-57.4	-174	-27.7	34.8	0	0	0	113.2	R500 P527 R530	R500-P525 WeakPolarHBondContact O-CB 3.5Å; R500-P525 WeakPolarHBondContact O-CG 3.42Å; P525-P527 VanDerWaalsContact O-CD 3.32Å; P525-P527 WeakPolarHBondContact O-CD 3.48Å; P525-R530 PolarHBondContact O-NH2 2.75Å
526	D	97.7	Very high	97.4	Very high	58 Å²	58	42.7 Å²	42.7	31%	0.31	23%	0.234	S	C	.	.	S	Bend	trans	-62	116.8	171.1	173.4	-6.5	0	0	0	110.2	H524 T528 K529	H524-D526 PolarHBondContact ND1-N 3.44Å; H524-D526 PolarHBondContact ND1-O 3.47Å; H524-D526 VanDerWaalsContact ND1-O 3.1Å; H524-D526 PolarHBondContact O-N 2.79Å; D526-T528 VanDerWaalsContact CG-OG1 3.25Å; D526-T528 PolarHBondContact O-N 3.21Å; D526-T528 VanDerWaalsContact OD1-CB 3.29Å; D526-T528 WeakPolarHBondContact OD1-CB 3.2Å; D526-T528 WeakPolarHBondContact OD1-CG2 3.3Å; D526-T528 PolarHBondContact OD1-N 2.84Å; D526-T528 PolarHBondContact OD1-OG1 3.31Å; D526-T528 PolarHBondContact OD2-OG1 2.95Å; D526-K529 HydrophobicContact CB-CG 4.38Å; D526-K529 PolarHBondContact O-N 2.86Å; D526-K529 WeakPolarHBondContact OD2-CE 3.31Å
527	P	97.7	Very high	97.3	Very high	14 Å²	14	41.4 Å²	41.4	9%	0.091	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.6	-178.5	-19.4	31.6	0	0	0	113.8	E459 N467 K470 P525 K529 R530	E459-P527 HydrophobicContact CB-CG 4.04Å; E459-P527 HydrophobicContact CG-CG 3.68Å; N467-P527 HydrophobicContact CB-CB 3.64Å; N467-P527 HydrophobicContact CB-CG 4.31Å; K470-P527 HydrophobicContact CB-CB 3.93Å; K470-P527 HydrophobicContact CG-CB 4.4Å; K470-P527 WeakPolarHBondContact CG-O 3.25Å; K470-P527 PolarHBondContact NZ-O 2.9Å; P525-P527 VanDerWaalsContact O-CD 3.32Å; P525-P527 WeakPolarHBondContact O-CD 3.48Å; P527-K529 VanDerWaalsContact C-N 3.32Å; P527-K529 PolarHBondContact O-N 2.64Å; P527-R530 PolarHBondContact O-N 2.65Å
528	T	97	Very high	97.1	Very high	85 Å²	85	44.4 Å²	44.4	52%	0.521	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-37.6	-177.3	70.1	0	0	0	0	111.1	K470 D526	K470-T528 PolarHBondContact NZ-O 2.92Å; D526-T528 VanDerWaalsContact CG-OG1 3.25Å; D526-T528 PolarHBondContact O-N 3.21Å; D526-T528 VanDerWaalsContact OD1-CB 3.29Å; D526-T528 WeakPolarHBondContact OD1-CB 3.2Å; D526-T528 WeakPolarHBondContact OD1-CG2 3.3Å; D526-T528 PolarHBondContact OD1-N 2.84Å; D526-T528 PolarHBondContact OD1-OG1 3.31Å; D526-T528 PolarHBondContact OD2-OG1 2.95Å
529	K	97.8	Very high	96.9	Very high	118 Å²	118	47.1 Å²	47.1	51%	0.513	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-17.6	-179.7	-50.6	-168.4	-154.2	173.4	0	114.6	D526 P527	D526-K529 HydrophobicContact CB-CG 4.38Å; D526-K529 PolarHBondContact O-N 2.86Å; D526-K529 WeakPolarHBondContact OD2-CE 3.31Å; P527-K529 VanDerWaalsContact C-N 3.32Å; P527-K529 PolarHBondContact O-N 2.64Å
530	R	98.2	Very high	96.5	Very high	3 Å²	3	51.2 Å²	51.2	1%	0.011	27%	0.271	C	S	.	.	S	Bend	trans	-62.6	136.7	170.8	-56.8	177.1	-162.7	155.3	13.5	108.4	E459 K470 V473 M522 H524 P525 P527	E459-R530 IonicContact OE1-CZ 3.99Å; E459-R530 IonicContact OE1-NH1 2.66Å; E459-R530 PolarHBondContact OE1-NH1 3.06Å; E459-R530 IonicContact OE1-NH2 3.17Å; E459-R530 PolarHBondContact OE1-NH2 3.24Å; E459-R530 IonicContact OE2-CZ 2.68Å; E459-R530 IonicContact OE2-NH1 2.65Å; E459-R530 IonicContact OE2-NH2 3.28Å; E459-R530 PolarHBondContact OE2-NH2 2.67Å; K470-R530 HydrophobicContact CD-CB 4.39Å; K470-R530 WeakPolarHBondContact CE-O 3.48Å; K470-R530 PolarHBondContact NZ-O 2.66Å; K470-R530 WeakPolarHBondContact O-CD 3.48Å; K470-R530 PolarHBondContact O-NH1 2.71Å; V473-R530 HydrophobicContact CG1-CB 4.34Å; M522-R530 VanDerWaalsContact O-CD 3.25Å; M522-R530 WeakPolarHBondContact O-CD 3.33Å; M522-R530 WeakPolarHBondContact O-CG 3.33Å; H524-R530 HydrophobicContact CB-CG 4.22Å; H524-R530 PolarHBondContact O-NE 3.39Å; H524-R530 PolarHBondContact O-NH2 2.94Å; P525-R530 PolarHBondContact O-NH2 2.75Å; P527-R530 PolarHBondContact O-N 2.65Å
531	P	97.7	Very high	96.2	Very high	19 Å²	19	45.7 Å²	45.7	12%	0.123	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-60.7	152.3	179.2	26.9	-36	0	0	0	111.1	M522 D535 L536	M522-P531 HydrophobicContact CG-CG 3.97Å; P531-D535 HydrophobicContact CB-CB 4.29Å; P531-L536 HydrophobicContact CB-CD2 4.1Å; P531-L536 HydrophobicContact CB-CG 4.2Å; P531-L536 HydrophobicContact CG-CD2 3.47Å; P531-L536 VanDerWaalsContact CG-CD2 3.47Å; P531-L536 HydrophobicContact CG-CG 3.9Å
532	S	97.2	Very high	95.7	Very high	40 Å²	40	42.3 Å²	42.3	28%	0.28	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-73.6	158.8	165.8	85.5	0	0	0	0	109.8	S534 D535 L536	S532-S534 PolarHBondContact O-N 3.38Å; S532-S534 PolarHBondContact OG-N 2.79Å; S532-D535 WeakPolarHBondContact CA-OD2 3.42Å; S532-D535 WeakPolarHBondContact CB-OD2 3.29Å; S532-D535 PolarHBondContact N-OD2 3.29Å; S532-D535 WeakPolarHBondContact O-CA 3.43Å; S532-D535 WeakPolarHBondContact O-CB 3.33Å; S532-D535 PolarHBondContact O-N 3.1Å; S532-D535 PolarHBondContact OG-N 3.22Å; S532-D535 PolarHBondContact OG-OD2 3.12Å; S532-L536 PolarHBondContact O-N 2.79Å
533	V	96.8	Very high	94.7	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.03	25%	0.25	C	C	.	.	H	α-helix	trans	-63	-25.7	176.2	-165.4	0	0	0	0	112	S386 L389 K390 H393 V473 D535 I537	S386-V533 WeakPolarHBondContact O-CG1 3.31Å; L389-V533 HydrophobicContact CB-CG1 3.89Å; L389-V533 HydrophobicContact CB-CG2 4.14Å; L389-V533 HydrophobicContact CD1-CG2 4.48Å; K390-V533 HydrophobicContact CB-CB 4.41Å; K390-V533 HydrophobicContact CB-CG1 3.98Å; H393-V533 WeakPolarHBondContact ND1-CG2 3.15Å; V473-V533 HydrophobicContact CG2-CG2 3.69Å; V533-D535 VanDerWaalsContact C-N 3.28Å; V533-D535 PolarHBondContact O-N 3.45Å; V533-I537 HydrophobicContact CG1-CD1 4.33Å; V533-I537 WeakPolarHBondContact O-CD1 3.32Å; V533-I537 VanDerWaalsContact O-CG1 3.32Å; V533-I537 WeakPolarHBondContact O-CG1 3.43Å; V533-I537 PolarHBondContact O-N 3.05Å
534	S	95.9	Very high	93.2	Very high	44 Å²	44	49.8 Å²	49.8	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-72.7	-19	172.5	-73.9	0	0	0	0	113.9	K390 S532 K538	K390-S534 WeakPolarHBondContact CE-OG 3.43Å; S532-S534 PolarHBondContact O-N 3.38Å; S532-S534 PolarHBondContact OG-N 2.79Å; S534-K538 WeakPolarHBondContact O-CD 3.49Å; S534-K538 WeakPolarHBondContact O-CE 3.42Å; S534-K538 WeakPolarHBondContact O-CG 3.35Å
535	D	96.1	Very high	91	Very high	77 Å²	77	48.4 Å²	48.4	41%	0.412	27%	0.269	S	S	.	.	H	α-helix	trans	-90.1	-40.7	174.5	-48.7	-48.3	0	0	0	110.4	P531 S532 V533 I537 K538 H539	P531-D535 HydrophobicContact CB-CB 4.29Å; S532-D535 WeakPolarHBondContact CA-OD2 3.42Å; S532-D535 WeakPolarHBondContact CB-OD2 3.29Å; S532-D535 PolarHBondContact N-OD2 3.29Å; S532-D535 WeakPolarHBondContact O-CA 3.43Å; S532-D535 WeakPolarHBondContact O-CB 3.33Å; S532-D535 PolarHBondContact O-N 3.1Å; S532-D535 PolarHBondContact OG-N 3.22Å; S532-D535 PolarHBondContact OG-OD2 3.12Å; V533-D535 VanDerWaalsContact C-N 3.28Å; V533-D535 PolarHBondContact O-N 3.45Å; D535-I537 VanDerWaalsContact C-N 3.33Å; D535-I537 PolarHBondContact O-N 3.42Å; D535-K538 CarbonylContact O-C 3.56Å; D535-K538 WeakPolarHBondContact O-CA 3.47Å; D535-K538 PolarHBondContact O-N 2.88Å; D535-H539 PolarHBondContact O-N 2.95Å
536	L	95.1	Very high	88.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-51.4	-49.6	173.4	-72.8	177.9	0	0	0	112.1	V473 L518 M522 P531 S532 K538 H539 L542	V473-L536 HydrophobicContact CG1-CD1 4.23Å; V473-L536 HydrophobicContact CG2-CD1 4.21Å; L518-L536 HydrophobicContact CD1-CD2 3.87Å; M522-L536 HydrophobicContact CE-CD1 3.87Å; M522-L536 HydrophobicContact CE-CD2 4.37Å; M522-L536 HydrophobicContact CG-CD2 3.94Å; M522-L536 HydrophobicContact SD-CD1 4.35Å; M522-L536 HydrophobicContact SD-CD2 3.76Å; P531-L536 HydrophobicContact CB-CD2 4.1Å; P531-L536 HydrophobicContact CB-CG 4.2Å; P531-L536 HydrophobicContact CG-CD2 3.47Å; P531-L536 VanDerWaalsContact CG-CD2 3.47Å; P531-L536 HydrophobicContact CG-CG 3.9Å; S532-L536 PolarHBondContact O-N 2.79Å; L536-K538 PolarHBondContact O-N 3.35Å; L536-K538 VanDerWaalsContact O-N 3.15Å; L536-H539 VanDerWaalsContact O-CB 3.28Å; L536-H539 WeakPolarHBondContact O-CB 3.48Å; L536-H539 PolarHBondContact O-N 3.4Å; L536-L542 WeakPolarHBondContact O-CD1 3.36Å
537	I	93.7	Very high	86.6	Confident	31 Å²	31	55.3 Å²	55.3	16%	0.159	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.9	-179.5	-64.2	162	0	0	0	112.6	L383 R387 K390 V533 D535	L383-I537 HydrophobicContact CD1-CB 4.34Å; L383-I537 HydrophobicContact CD1-CG1 4.45Å; L383-I537 HydrophobicContact CD1-CG2 4.12Å; R387-I537 HydrophobicContact CB-CD1 4.5Å; R387-I537 HydrophobicContact CG-CD1 4.12Å; R387-I537 HydrophobicContact CG-CG1 4.26Å; R387-I537 HydrophobicContact CG-CG2 4.41Å; K390-I537 HydrophobicContact CB-CD1 3.69Å; K390-I537 HydrophobicContact CD-CD1 3.56Å; K390-I537 HydrophobicContact CG-CD1 4.23Å; V533-I537 HydrophobicContact CG1-CD1 4.33Å; V533-I537 WeakPolarHBondContact O-CD1 3.32Å; V533-I537 VanDerWaalsContact O-CG1 3.32Å; V533-I537 WeakPolarHBondContact O-CG1 3.43Å; V533-I537 PolarHBondContact O-N 3.05Å; D535-I537 VanDerWaalsContact C-N 3.33Å; D535-I537 PolarHBondContact O-N 3.42Å
538	K	92.6	Very high	84.5	Confident	137 Å²	137	57.6 Å²	57.6	60%	0.596	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-5.2	176.6	-60.2	173.1	-171.4	169.4	0	113	S534 D535 L536 L543	S534-K538 WeakPolarHBondContact O-CD 3.49Å; S534-K538 WeakPolarHBondContact O-CE 3.42Å; S534-K538 WeakPolarHBondContact O-CG 3.35Å; D535-K538 CarbonylContact O-C 3.56Å; D535-K538 WeakPolarHBondContact O-CA 3.47Å; D535-K538 PolarHBondContact O-N 2.88Å; L536-K538 PolarHBondContact O-N 3.35Å; L536-K538 VanDerWaalsContact O-N 3.15Å; K538-L543 WeakPolarHBondContact O-CD1 3.26Å
539	H	93.3	Very high	82.6	Confident	60 Å²	60	56.5 Å²	56.5	28%	0.278	30%	0.302	S	S	.	.			trans	-68.9	127.7	-169	-164.5	-94.1	0	0	0	110.4	D535 L536 V541 L542 L543	D535-H539 PolarHBondContact O-N 2.95Å; L536-H539 VanDerWaalsContact O-CB 3.28Å; L536-H539 WeakPolarHBondContact O-CB 3.48Å; L536-H539 PolarHBondContact O-N 3.4Å; H539-V541 VanDerWaalsContact CE1-CG2 3.48Å; H539-V541 WeakPolarHBondContact CE1-CG2 3.25Å; H539-V541 PolarHBondContact O-N 2.85Å; H539-V541 VanDerWaalsContact O-N 3.09Å; H539-L542 PolarHBondContact O-N 3.38Å; H539-L543 PolarHBondContact O-N 3.06Å
540	P	90.3	Very high	80.6	Confident	88 Å²	88	53.8 Å²	53.8	57%	0.571	30%	0.302	S	S	*	.	H	α-helix	trans	-51.9	-41.1	-171.6	-30.4	35.7	0	0	0	113.8	L542 L543 T544	P540-L542 PolarHBondContact O-N 2.86Å; P540-L542 VanDerWaalsContact O-N 3.14Å; P540-L543 CarbonylContact O-C 3.49Å; P540-L543 PolarHBondContact O-N 2.64Å; P540-T544 PolarHBondContact O-N 2.69Å; P540-T544 PolarHBondContact O-OG1 2.67Å; P540-T544 VanDerWaalsContact O-OG1 3.1Å
541	V	91.1	Very high	78.8	Confident	6 Å²	6	58.2 Å²	58.2	4%	0.036	33%	0.326	C	S	.	.	H	α-helix	trans	-54.1	-33.6	178.4	-179.9	0	0	0	0	113.5	K379 E514 F515 L518 H539	K379-V541 WeakPolarHBondContact CD-O 3.34Å; K379-V541 WeakPolarHBondContact CE-O 3.07Å; E514-V541 HydrophobicContact CB-CG1 4.44Å; E514-V541 HydrophobicContact CB-CG2 3.54Å; F515-V541 HydrophobicContact CB-CG1 3.85Å; F515-V541 HydrophobicContact CD2-CG1 3.93Å; F515-V541 HydrophobicContact CG-CG1 4.33Å; L518-V541 HydrophobicContact CD2-CB 4.45Å; H539-V541 VanDerWaalsContact CE1-CG2 3.48Å; H539-V541 WeakPolarHBondContact CE1-CG2 3.25Å; H539-V541 PolarHBondContact O-N 2.85Å; H539-V541 VanDerWaalsContact O-N 3.09Å
542	L	88.3	Confident	77.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-89.7	-32.2	178.4	-51.2	-168.1	0	0	0	111.8	K379 L382 L383 F515 L518 L536 H539 P540 T544 A545 A546	K379-L542 HydrophobicContact CB-CD2 4.14Å; K379-L542 HydrophobicContact CG-CD2 3.89Å; L382-L542 HydrophobicContact CB-CD1 4.46Å; L382-L542 HydrophobicContact CD2-CD1 3.9Å; L382-L542 HydrophobicContact CD2-CD2 3.91Å; L382-L542 HydrophobicContact CG-CD1 3.8Å; L382-L542 HydrophobicContact CG-CD2 4.43Å; L383-L542 HydrophobicContact CB-CD1 4.47Å; L383-L542 HydrophobicContact CD1-CB 4.43Å; F515-L542 HydrophobicContact CD2-CD2 4.3Å; F515-L542 HydrophobicContact CE2-CD2 4.05Å; L518-L542 HydrophobicContact CD2-CD1 4.39Å; L518-L542 HydrophobicContact CD2-CD2 3.86Å; L518-L542 HydrophobicContact CD2-CG 4.06Å; L536-L542 WeakPolarHBondContact O-CD1 3.36Å; H539-L542 PolarHBondContact O-N 3.38Å; P540-L542 PolarHBondContact O-N 2.86Å; P540-L542 VanDerWaalsContact O-N 3.14Å; L542-T544 PolarHBondContact O-N 3.22Å; L542-A545 WeakPolarHBondContact O-CB 3.39Å; L542-A545 PolarHBondContact O-N 3.09Å; L542-A545 VanDerWaalsContact O-N 3.09Å; L542-A546 PolarHBondContact O-N 3.12Å
543	L	79	Confident	75.8	Confident	83 Å²	83	64.1 Å²	64.1	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-66.7	-26.8	172.6	-61.6	-179.4	0	0	0	112.2	K538 H539 P540 A545 A546 R547	K538-L543 WeakPolarHBondContact O-CD1 3.26Å; H539-L543 PolarHBondContact O-N 3.06Å; P540-L543 CarbonylContact O-C 3.49Å; P540-L543 PolarHBondContact O-N 2.64Å; L543-A545 VanDerWaalsContact C-N 3.27Å; L543-A545 PolarHBondContact O-N 2.72Å; L543-A546 CarbonylContact O-C 3.35Å; L543-A546 PolarHBondContact O-N 3.34Å; L543-A546 VanDerWaalsContact O-N 3.12Å; L543-R547 PolarHBondContact O-N 3.44Å
544	T	65.4	Low	74.9	Confident	75 Å²	75	70.7 Å²	70.7	46%	0.46	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-29.3	169.9	-60.1	0	0	0	0	112.6	P540 L542 R547	P540-T544 PolarHBondContact O-N 2.69Å; P540-T544 PolarHBondContact O-OG1 2.67Å; P540-T544 VanDerWaalsContact O-OG1 3.1Å; L542-T544 PolarHBondContact O-N 3.22Å; T544-R547 WeakPolarHBondContact O-CB 3.07Å; T544-R547 PolarHBondContact O-N 3.16Å
545	A	53	Low	74	Confident	22 Å²	22	73.4 Å²	73.4	18%	0.182	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-28.7	171.9	0	0	0	0	0	112.6	L376 K379 L542 L543 R547	L376-A545 HydrophobicContact CD1-CB 3.73Å; K379-A545 HydrophobicContact CB-CB 3.57Å; K379-A545 HydrophobicContact CD-CB 4.03Å; K379-A545 HydrophobicContact CG-CB 4.44Å; L542-A545 WeakPolarHBondContact O-CB 3.39Å; L542-A545 PolarHBondContact O-N 3.09Å; L542-A545 VanDerWaalsContact O-N 3.09Å; L543-A545 VanDerWaalsContact C-N 3.27Å; L543-A545 PolarHBondContact O-N 2.72Å; A545-R547 PolarHBondContact O-N 3.15Å
546	A	51.3	Low	73.1	Confident	57 Å²	57	75.1 Å²	75.1	47%	0.471	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-1.7	172.5	0	0	0	0	0	113.4	L542 L543 M548	L542-A546 PolarHBondContact O-N 3.12Å; L543-A546 CarbonylContact O-C 3.35Å; L543-A546 PolarHBondContact O-N 3.34Å; L543-A546 VanDerWaalsContact O-N 3.12Å; A546-M548 VanDerWaalsContact C-N 3.32Å; A546-M548 PolarHBondContact O-N 2.93Å
547	R	51.7	Low	72.6	Confident	198 Å²	198	79.8 Å²	79.8	75%	0.747	42%	0.418	S	S	*	.			trans	-79.2	82.4	169	-76.1	-178.5	151.1	-166.4	-6.5	110.5	L543 T544 A545	L543-R547 PolarHBondContact O-N 3.44Å; T544-R547 WeakPolarHBondContact O-CB 3.07Å; T544-R547 PolarHBondContact O-N 3.16Å; A545-R547 PolarHBondContact O-N 3.15Å
548	M	53.7	Low	72.4	Confident	62 Å²	62	82.6 Å²	82.6	31%	0.305	43%	0.434	S	S	.	.			trans	-44.1	142.8	139.7	-71.9	165.9	71.3	0	0	108.6	A546 Q552 L553 E556	A546-M548 VanDerWaalsContact C-N 3.32Å; A546-M548 PolarHBondContact O-N 2.93Å; M548-Q552 HydrophobicContact CB-CB 4.2Å; M548-Q552 HydrophobicContact CB-CG 4.37Å; M548-Q552 HydrophobicContact CE-CB 4.47Å; M548-Q552 HydrophobicContact CE-CG 3.77Å; M548-L553 HydrophobicContact CB-CD2 3.9Å; M548-L553 HydrophobicContact CB-CG 3.85Å; M548-L553 HydrophobicContact SD-CD2 4.32Å; M548-E556 HydrophobicContact CE-CB 4.14Å; M548-E556 WeakPolarHBondContact CE-OE2 3.45Å
549	S	55.8	Low	72.2	Confident	61 Å²	61	78.8 Å²	78.8	43%	0.427	43%	0.428	S	S	.	.			trans	-59.3	158.5	-176.3	81	0	0	0	0	110.8	D551 Q552 L553	S549-D551 PolarHBondContact O-N 3.2Å; S549-D551 PolarHBondContact OG-N 3.49Å; S549-Q552 PolarHBondContact O-N 3.46Å; S549-Q552 WeakPolarHBondContact OG-CB 3.48Å; S549-Q552 PolarHBondContact OG-N 3.45Å; S549-L553 WeakPolarHBondContact O-CB 3.21Å; S549-L553 WeakPolarHBondContact O-CG 3.36Å; S549-L553 PolarHBondContact O-N 2.91Å
550	A	57	Low	72	Confident	62 Å²	62	79.9 Å²	79.9	51%	0.512	43%	0.433	S	S	.	.	H	α-helix	trans	-54.7	-29	177	0	0	0	0	0	112	R554	A550-R554 VanDerWaalsContact O-CD 3.29Å; A550-R554 WeakPolarHBondContact O-CD 3.39Å; A550-R554 WeakPolarHBondContact O-CG 3.32Å; A550-R554 PolarHBondContact O-N 3.16Å
551	D	59.1	Low	72	Confident	95 Å²	95	81.1 Å²	81.1	51%	0.508	43%	0.429	S	S	.	.	H	α-helix	trans	-82.7	-38.6	177.9	-53.8	-60.3	0	0	0	112.6	S549 L553 R554 V555	S549-D551 PolarHBondContact O-N 3.2Å; S549-D551 PolarHBondContact OG-N 3.49Å; D551-L553 VanDerWaalsContact C-N 3.34Å; D551-L553 PolarHBondContact O-N 2.82Å; D551-R554 WeakPolarHBondContact O-CA 3.43Å; D551-R554 WeakPolarHBondContact O-CB 3.4Å; D551-R554 PolarHBondContact O-N 2.81Å; D551-R554 VanDerWaalsContact O-N 3.1Å; D551-R554 IonicContact OD1-CZ 3.94Å; D551-R554 IonicContact OD1-NH1 3.22Å; D551-R554 PolarHBondContact OD1-NH1 3.39Å; D551-V555 WeakPolarHBondContact O-CG2 3.46Å; D551-V555 PolarHBondContact O-N 3.2Å
552	Q	65.9	Low	72.1	Confident	104 Å²	104	88.2 Å²	88.2	49%	0.486	46%	0.46	S	S	.	.	H	α-helix	trans	-66.7	-36.9	174.1	-160.6	-177.3	15.2	0	0	111.5	M548 S549 V555 E556	M548-Q552 HydrophobicContact CB-CB 4.2Å; M548-Q552 HydrophobicContact CB-CG 4.37Å; M548-Q552 HydrophobicContact CE-CB 4.47Å; M548-Q552 HydrophobicContact CE-CG 3.77Å; S549-Q552 PolarHBondContact O-N 3.46Å; S549-Q552 WeakPolarHBondContact OG-CB 3.48Å; S549-Q552 PolarHBondContact OG-N 3.45Å; Q552-V555 PolarHBondContact O-N 3.39Å; Q552-E556 PolarHBondContact O-N 2.76Å
553	L	67.8	Low	72.3	Confident	80 Å²	80	93 Å²	93	42%	0.419	48%	0.481	S	S	.	.	H	α-helix	trans	-64.9	-35.4	169	-71.5	172.6	0	0	0	112.4	M548 S549 D551 L557	M548-L553 HydrophobicContact CB-CD2 3.9Å; M548-L553 HydrophobicContact CB-CG 3.85Å; M548-L553 HydrophobicContact SD-CD2 4.32Å; S549-L553 WeakPolarHBondContact O-CB 3.21Å; S549-L553 WeakPolarHBondContact O-CG 3.36Å; S549-L553 PolarHBondContact O-N 2.91Å; D551-L553 VanDerWaalsContact C-N 3.34Å; D551-L553 PolarHBondContact O-N 2.82Å; L553-L557 WeakPolarHBondContact O-CB 3.46Å; L553-L557 PolarHBondContact O-N 2.94Å
554	R	76.4	Confident	72.8	Confident	142 Å²	142	92.6 Å²	92.6	54%	0.536	48%	0.479	S	S	.	.	H	α-helix	trans	-66.2	-41.7	172.8	-75.8	159.6	-179.9	144.9	-0.3	111.4	A550 D551 N558	A550-R554 VanDerWaalsContact O-CD 3.29Å; A550-R554 WeakPolarHBondContact O-CD 3.39Å; A550-R554 WeakPolarHBondContact O-CG 3.32Å; A550-R554 PolarHBondContact O-N 3.16Å; D551-R554 WeakPolarHBondContact O-CA 3.43Å; D551-R554 WeakPolarHBondContact O-CB 3.4Å; D551-R554 PolarHBondContact O-N 2.81Å; D551-R554 VanDerWaalsContact O-N 3.1Å; D551-R554 IonicContact OD1-CZ 3.94Å; D551-R554 IonicContact OD1-NH1 3.22Å; D551-R554 PolarHBondContact OD1-NH1 3.39Å; R554-N558 VanDerWaalsContact O-CB 3.28Å; R554-N558 WeakPolarHBondContact O-CB 3.32Å; R554-N558 PolarHBondContact O-N 3.42Å; R554-N558 PolarHBondContact O-ND2 3.24Å
555	V	77.4	Confident	74.2	Confident	102 Å²	102	91.6 Å²	91.6	62%	0.618	48%	0.479	S	S	*	.	H	α-helix	trans	-61.7	-53.4	176.9	170.2	0	0	0	0	110.7	D551 Q552 L557 N558 A559	D551-V555 WeakPolarHBondContact O-CG2 3.46Å; D551-V555 PolarHBondContact O-N 3.2Å; Q552-V555 PolarHBondContact O-N 3.39Å; V555-L557 PolarHBondContact O-N 3.21Å; V555-N558 PolarHBondContact O-N 2.98Å; V555-N558 VanDerWaalsContact O-N 3.13Å; V555-A559 PolarHBondContact O-N 2.96Å
556	E	78.1	Confident	76.2	Confident	113 Å²	113	94.7 Å²	94.7	53%	0.528	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-42.2	-179.8	-170.2	179	-132.6	0	0	112	M548 Q552 N558 A559 E560	M548-E556 HydrophobicContact CE-CB 4.14Å; M548-E556 WeakPolarHBondContact CE-OE2 3.45Å; Q552-E556 PolarHBondContact O-N 2.76Å; E556-N558 VanDerWaalsContact C-N 3.27Å; E556-N558 PolarHBondContact O-N 2.59Å; E556-A559 PolarHBondContact O-N 3.14Å; E556-E560 PolarHBondContact O-N 2.76Å
557	L	84.6	Confident	78.1	Confident	97 Å²	97	96.4 Å²	96.4	51%	0.508	49%	0.492	S	S	.	.	H	α-helix	trans	-60	-36.8	174.2	178.1	63.4	0	0	0	112.2	L553 V555 K561	L553-L557 WeakPolarHBondContact O-CB 3.46Å; L553-L557 PolarHBondContact O-N 2.94Å; V555-L557 PolarHBondContact O-N 3.21Å; L557-K561 HydrophobicContact CG-CD 4.35Å; L557-K561 WeakPolarHBondContact O-CB 3.43Å; L557-K561 WeakPolarHBondContact O-CD 3.39Å; L557-K561 WeakPolarHBondContact O-CG 3.32Å; L557-K561 PolarHBondContact O-N 3.25Å
558	N	87.9	Confident	80.1	Confident	90 Å²	90	93.3 Å²	93.3	48%	0.481	49%	0.486	S	S	.	.	H	α-helix	trans	-75.9	-37.7	178.4	-72	-15.7	0	0	0	112.1	R554 V555 E556 K561 F562	R554-N558 VanDerWaalsContact O-CB 3.28Å; R554-N558 WeakPolarHBondContact O-CB 3.32Å; R554-N558 PolarHBondContact O-N 3.42Å; R554-N558 PolarHBondContact O-ND2 3.24Å; V555-N558 PolarHBondContact O-N 2.98Å; V555-N558 VanDerWaalsContact O-N 3.13Å; E556-N558 VanDerWaalsContact C-N 3.27Å; E556-N558 PolarHBondContact O-N 2.59Å; N558-K561 PolarHBondContact O-N 3.42Å; N558-K561 PolarHBondContact OD1-NZ 3.01Å; N558-F562 WeakPolarHBondContact O-CB 3.26Å; N558-F562 PolarHBondContact O-N 2.91Å
559	A	90.1	Very high	82	Confident	58 Å²	58	97 Å²	97	48%	0.479	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-47.2	172.1	0	0	0	0	0	111.4	V555 E556 K561 F562 K563	V555-A559 PolarHBondContact O-N 2.96Å; E556-A559 PolarHBondContact O-N 3.14Å; A559-K561 PolarHBondContact O-N 2.82Å; A559-F562 WeakPolarHBondContact O-CB 3.41Å; A559-F562 PolarHBondContact O-N 2.8Å; A559-K563 WeakPolarHBondContact O-CB 3.47Å; A559-K563 PolarHBondContact O-N 2.75Å
560	E	87.4	Confident	83.8	Confident	82 Å²	82	99.5 Å²	99.5	38%	0.383	51%	0.506	S	S	.	.	H	α-helix	trans	-72.3	-30.3	-179.8	-163.2	58.5	-153.4	0	0	112.2	E556 K563 N564	E556-E560 PolarHBondContact O-N 2.76Å; E560-K563 IonicContact OE1-NZ 2.74Å; E560-K563 PolarHBondContact OE1-NZ 2.68Å; E560-K563 IonicContact OE2-NZ 2.79Å; E560-K563 PolarHBondContact OE2-NZ 3.38Å; E560-N564 WeakPolarHBondContact O-CB 3.45Å; E560-N564 PolarHBondContact O-N 3.04Å; E560-N564 PolarHBondContact O-ND2 2.74Å
561	K	90.3	Very high	85.5	Confident	114 Å²	114	101.4 Å²	101.4	50%	0.496	51%	0.507	S	S	.	.	H	α-helix	trans	-61	-46.5	166.6	-80.6	167.9	-173.7	164.9	0	112	L557 N558 A559 N564 A565	L557-K561 HydrophobicContact CG-CD 4.35Å; L557-K561 WeakPolarHBondContact O-CB 3.43Å; L557-K561 WeakPolarHBondContact O-CD 3.39Å; L557-K561 WeakPolarHBondContact O-CG 3.32Å; L557-K561 PolarHBondContact O-N 3.25Å; N558-K561 PolarHBondContact O-N 3.42Å; N558-K561 PolarHBondContact OD1-NZ 3.01Å; A559-K561 PolarHBondContact O-N 2.82Å; K561-N564 PolarHBondContact O-N 3.39Å; K561-A565 WeakPolarHBondContact O-CB 3.38Å; K561-A565 PolarHBondContact O-N 3.15Å
562	F	94.6	Very high	87.2	Confident	155 Å²	155	103.1 Å²	103.1	68%	0.68	51%	0.51	S	S	*	.	H	α-helix	trans	-61.4	-45.6	178.4	177.8	-96.4	0	0	0	111.3	N558 A559 N564 A565 L566	N558-F562 WeakPolarHBondContact O-CB 3.26Å; N558-F562 PolarHBondContact O-N 2.91Å; A559-F562 WeakPolarHBondContact O-CB 3.41Å; A559-F562 PolarHBondContact O-N 2.8Å; F562-N564 PolarHBondContact O-N 3.08Å; F562-A565 PolarHBondContact O-N 3.46Å; F562-L566 PolarHBondContact O-N 3.45Å
563	K	91.9	Very high	88.5	Confident	102 Å²	102	104.4 Å²	104.4	44%	0.443	51%	0.514	S	S	.	.	H	α-helix	trans	-59.8	-42.1	174.3	175.4	156.9	156	-92	0	112.7	A559 E560 L566 L567	A559-K563 WeakPolarHBondContact O-CB 3.47Å; A559-K563 PolarHBondContact O-N 2.75Å; E560-K563 IonicContact OE1-NZ 2.74Å; E560-K563 PolarHBondContact OE1-NZ 2.68Å; E560-K563 IonicContact OE2-NZ 2.79Å; E560-K563 PolarHBondContact OE2-NZ 3.38Å; K563-L566 PolarHBondContact O-N 3.27Å; K563-L567 HydrophobicContact CG-CD1 4.33Å; K563-L567 WeakPolarHBondContact O-CG 3.24Å; K563-L567 PolarHBondContact O-N 3.06Å
564	N	90.1	Very high	89.6	Confident	73 Å²	73	103.6 Å²	103.6	39%	0.39	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-41.3	172.8	-85.6	-82.4	0	0	0	112.6	E560 K561 F562 L566 L567 Q568	E560-N564 WeakPolarHBondContact O-CB 3.45Å; E560-N564 PolarHBondContact O-N 3.04Å; E560-N564 PolarHBondContact O-ND2 2.74Å; K561-N564 PolarHBondContact O-N 3.39Å; F562-N564 PolarHBondContact O-N 3.08Å; N564-L566 VanDerWaalsContact C-N 3.33Å; N564-L566 PolarHBondContact O-N 3.37Å; N564-L567 PolarHBondContact O-N 3.31Å; N564-Q568 WeakPolarHBondContact O-CB 3.46Å; N564-Q568 VanDerWaalsContact O-CG 3.27Å; N564-Q568 WeakPolarHBondContact O-CG 3.37Å; N564-Q568 PolarHBondContact O-N 3.4Å
565	A	94	Very high	90.3	Very high	55 Å²	55	102.6 Å²	102.6	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-37.4	176	0	0	0	0	0	112.3	K561 F562 K569	K561-A565 WeakPolarHBondContact O-CB 3.38Å; K561-A565 PolarHBondContact O-N 3.15Å; F562-A565 PolarHBondContact O-N 3.46Å; A565-K569 WeakPolarHBondContact O-CB 3.48Å; A565-K569 PolarHBondContact O-N 3.08Å
566	L	94.6	Very high	90.9	Very high	87 Å²	87	103.4 Å²	103.4	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-50.1	173	-177.3	61.2	0	0	0	111.2	F562 K563 N564 Q568 K569 E570	F562-L566 PolarHBondContact O-N 3.45Å; K563-L566 PolarHBondContact O-N 3.27Å; N564-L566 VanDerWaalsContact C-N 3.33Å; N564-L566 PolarHBondContact O-N 3.37Å; L566-Q568 VanDerWaalsContact C-N 3.33Å; L566-Q568 PolarHBondContact O-N 3.4Å; L566-K569 WeakPolarHBondContact O-CA 3.43Å; L566-K569 WeakPolarHBondContact O-CB 3.23Å; L566-K569 PolarHBondContact O-N 2.71Å; L566-E570 PolarHBondContact O-N 3.01Å
567	L	91.3	Very high	91.4	Very high	92 Å²	92	101.1 Å²	101.1	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-60.4	-39.1	177.3	-72.3	168.9	0	0	0	112.4	K563 N564 K569 E570 L571	K563-L567 HydrophobicContact CG-CD1 4.33Å; K563-L567 WeakPolarHBondContact O-CG 3.24Å; K563-L567 PolarHBondContact O-N 3.06Å; N564-L567 PolarHBondContact O-N 3.31Å; L567-K569 VanDerWaalsContact C-N 3.35Å; L567-K569 PolarHBondContact O-N 3.12Å; L567-E570 PolarHBondContact O-N 2.78Å; L567-L571 VanDerWaalsContact O-CB 3.25Å; L567-L571 WeakPolarHBondContact O-CB 3.29Å; L567-L571 PolarHBondContact O-N 2.96Å
568	Q	93.3	Very high	91.7	Very high	133 Å²	133	104.4 Å²	104.4	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-63.4	-38.9	173.1	-74	174.3	8.7	0	0	112.2	N564 L566 K572	N564-Q568 WeakPolarHBondContact O-CB 3.46Å; N564-Q568 VanDerWaalsContact O-CG 3.27Å; N564-Q568 WeakPolarHBondContact O-CG 3.37Å; N564-Q568 PolarHBondContact O-N 3.4Å; L566-Q568 VanDerWaalsContact C-N 3.33Å; L566-Q568 PolarHBondContact O-N 3.4Å; Q568-K572 WeakPolarHBondContact O-CB 3.38Å; Q568-K572 PolarHBondContact O-N 2.76Å
569	K	94.2	Very high	91.7	Very high	140 Å²	140	102.7 Å²	102.7	61%	0.609	52%	0.521	S	S	*	.	H	α-helix	trans	-66	-39.3	176.2	-171.2	177.8	-176	177	0	111.8	A565 L566 L567 K573	A565-K569 WeakPolarHBondContact O-CB 3.48Å; A565-K569 PolarHBondContact O-N 3.08Å; L566-K569 WeakPolarHBondContact O-CA 3.43Å; L566-K569 WeakPolarHBondContact O-CB 3.23Å; L566-K569 PolarHBondContact O-N 2.71Å; L567-K569 VanDerWaalsContact C-N 3.35Å; L567-K569 PolarHBondContact O-N 3.12Å; K569-K573 WeakPolarHBondContact O-CG 3.43Å; K569-K573 PolarHBondContact O-N 2.81Å; K569-K573 VanDerWaalsContact O-N 3.12Å
570	E	94.3	Very high	91.5	Very high	113 Å²	113	101.9 Å²	101.9	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-70.4	-44	174.3	-64.3	-154.6	137.2	0	0	112.6	L566 L567 K572 K573 A574	L566-E570 PolarHBondContact O-N 3.01Å; L567-E570 PolarHBondContact O-N 2.78Å; E570-K572 VanDerWaalsContact C-N 3.3Å; E570-K572 PolarHBondContact O-N 3.16Å; E570-K573 WeakPolarHBondContact O-CB 3.34Å; E570-K573 PolarHBondContact O-N 3Å; E570-K573 VanDerWaalsContact O-N 3.13Å; E570-A574 WeakPolarHBondContact O-CB 3.32Å; E570-A574 PolarHBondContact O-N 3.04Å
571	L	92.6	Very high	91.2	Very high	102 Å²	102	100.5 Å²	100.5	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-59.9	-40.6	176.4	-173.4	149.9	0	0	0	111.3	L567 A574 Q575	L567-L571 VanDerWaalsContact O-CB 3.25Å; L567-L571 WeakPolarHBondContact O-CB 3.29Å; L567-L571 PolarHBondContact O-N 2.96Å; L571-A574 PolarHBondContact O-N 3.43Å; L571-Q575 HydrophobicContact CD2-CG 4.3Å; L571-Q575 WeakPolarHBondContact O-CG 3.32Å; L571-Q575 PolarHBondContact O-N 3.49Å
572	K	93.7	Very high	90.9	Very high	132 Å²	132	99.1 Å²	99.1	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-65.2	-41.3	173.8	-170.1	172	-176.3	175.2	0	112.5	Q568 E570 Q575 Q576	Q568-K572 WeakPolarHBondContact O-CB 3.38Å; Q568-K572 PolarHBondContact O-N 2.76Å; E570-K572 VanDerWaalsContact C-N 3.3Å; E570-K572 PolarHBondContact O-N 3.16Å; K572-Q575 PolarHBondContact O-N 3.15Å; K572-Q576 WeakPolarHBondContact O-CG 3.06Å; K572-Q576 PolarHBondContact O-N 2.91Å
573	K	93.6	Very high	90.1	Very high	131 Å²	131	98.2 Å²	98.2	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-60.5	-44.5	171.8	-78.6	178.2	173.5	-176.3	0	111.7	K569 E570 Q576 A577	K569-K573 WeakPolarHBondContact O-CG 3.43Å; K569-K573 PolarHBondContact O-N 2.81Å; K569-K573 VanDerWaalsContact O-N 3.12Å; E570-K573 WeakPolarHBondContact O-CB 3.34Å; E570-K573 PolarHBondContact O-N 3Å; E570-K573 VanDerWaalsContact O-N 3.13Å; K573-Q576 PolarHBondContact O-N 2.89Å; K573-A577 WeakPolarHBondContact O-CB 3.43Å; K573-A577 PolarHBondContact O-N 3.27Å
574	A	90.4	Very high	89.4	Confident	63 Å²	63	100.4 Å²	100.4	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-64.6	-40.8	179.8	0	0	0	0	0	111.9	E570 L571 A577 R578	E570-A574 WeakPolarHBondContact O-CB 3.32Å; E570-A574 PolarHBondContact O-N 3.04Å; L571-A574 PolarHBondContact O-N 3.43Å; A574-A577 PolarHBondContact O-N 3.39Å; A574-R578 VanDerWaalsContact O-CB 3.31Å; A574-R578 WeakPolarHBondContact O-CB 3.16Å; A574-R578 PolarHBondContact O-N 2.87Å
575	Q	92.5	Very high	88.8	Confident	120 Å²	120	101.1 Å²	101.1	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-61.6	-44.6	172	-75	174.7	-21.6	0	0	112.2	L571 K572 R578 A579	L571-Q575 HydrophobicContact CD2-CG 4.3Å; L571-Q575 WeakPolarHBondContact O-CG 3.32Å; L571-Q575 PolarHBondContact O-N 3.49Å; K572-Q575 PolarHBondContact O-N 3.15Å; Q575-R578 PolarHBondContact O-N 3.13Å; Q575-A579 WeakPolarHBondContact O-CB 3.49Å; Q575-A579 PolarHBondContact O-N 3.11Å
576	Q	90.4	Very high	87.6	Confident	119 Å²	119	104 Å²	104	56%	0.556	53%	0.534	S	S	*	.	H	α-helix	trans	-64.8	-42.9	176.7	-73.8	176.1	-33.1	0	0	112.3	K572 K573 R578 A579 A580	K572-Q576 WeakPolarHBondContact O-CG 3.06Å; K572-Q576 PolarHBondContact O-N 2.91Å; K573-Q576 PolarHBondContact O-N 2.89Å; Q576-R578 VanDerWaalsContact C-N 3.33Å; Q576-R578 PolarHBondContact O-N 3.23Å; Q576-A579 PolarHBondContact O-N 2.66Å; Q576-A580 WeakPolarHBondContact O-CB 3.47Å; Q576-A580 PolarHBondContact O-N 2.92Å
577	A	88.6	Confident	86.2	Confident	66 Å²	66	102.3 Å²	102.3	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-63.3	-39.1	175.6	0	0	0	0	0	111.9	K573 A574 A581	K573-A577 WeakPolarHBondContact O-CB 3.43Å; K573-A577 PolarHBondContact O-N 3.27Å; A574-A577 PolarHBondContact O-N 3.39Å; A577-A581 WeakPolarHBondContact O-CB 3.32Å; A577-A581 PolarHBondContact O-N 3.38Å
578	R	89.3	Confident	84.9	Confident	166 Å²	166	101.5 Å²	101.5	63%	0.626	53%	0.529	S	S	*	.	H	α-helix	trans	-64.2	-49.2	173.8	178.5	178.6	168.4	173.2	-1.6	111.8	A574 Q575 Q576 A580 A581 E582	A574-R578 VanDerWaalsContact O-CB 3.31Å; A574-R578 WeakPolarHBondContact O-CB 3.16Å; A574-R578 PolarHBondContact O-N 2.87Å; Q575-R578 PolarHBondContact O-N 3.13Å; Q576-R578 VanDerWaalsContact C-N 3.33Å; Q576-R578 PolarHBondContact O-N 3.23Å; R578-A580 VanDerWaalsContact C-N 3.32Å; R578-A580 PolarHBondContact O-N 3.2Å; R578-A581 WeakPolarHBondContact O-CA 3.33Å; R578-A581 WeakPolarHBondContact O-CB 3.04Å; R578-A581 PolarHBondContact O-N 3.45Å; R578-E582 HydrophobicContact CG-CG 4.47Å; R578-E582 IonicContact CZ-OE1 3.46Å; R578-E582 VanDerWaalsContact CZ-OE1 3.22Å; R578-E582 IonicContact NE-OE1 2.67Å; R578-E582 PolarHBondContact NE-OE1 3.25Å; R578-E582 IonicContact NE-OE2 3.94Å; R578-E582 IonicContact NH2-OE1 3.39Å; R578-E582 PolarHBondContact NH2-OE1 3.28Å; R578-E582 WeakPolarHBondContact O-CG 3.02Å; R578-E582 PolarHBondContact O-N 3.44Å
579	A	87.8	Confident	83.3	Confident	53 Å²	53	99.4 Å²	99.4	44%	0.438	52%	0.521	S	S	.	.	H	α-helix	trans	-60.1	-42.5	178.5	0	0	0	0	0	111.7	Q575 Q576 A581 E582 E583	Q575-A579 WeakPolarHBondContact O-CB 3.49Å; Q575-A579 PolarHBondContact O-N 3.11Å; Q576-A579 PolarHBondContact O-N 2.66Å; A579-A581 VanDerWaalsContact C-N 3.28Å; A579-A581 PolarHBondContact O-N 2.97Å; A579-E582 PolarHBondContact O-N 3.17Å; A579-E583 WeakPolarHBondContact O-CB 3.5Å; A579-E583 PolarHBondContact O-N 3.07Å
580	A	86.5	Confident	81.6	Confident	42 Å²	42	102.2 Å²	102.2	35%	0.347	53%	0.528	S	S	.	.	H	α-helix	trans	-67.6	-25	174.9	0	0	0	0	0	113.5	Q576 R578 K584	Q576-A580 WeakPolarHBondContact O-CB 3.47Å; Q576-A580 PolarHBondContact O-N 2.92Å; R578-A580 VanDerWaalsContact C-N 3.32Å; R578-A580 PolarHBondContact O-N 3.2Å; A580-K584 WeakPolarHBondContact O-CB 3.22Å; A580-K584 VanDerWaalsContact O-CG 3.23Å; A580-K584 WeakPolarHBondContact O-CG 3.41Å; A580-K584 PolarHBondContact O-N 3.06Å
581	A	82.2	Confident	80	Confident	52 Å²	52	102.6 Å²	102.6	43%	0.43	53%	0.533	S	S	.	.	H	α-helix	trans	-76.6	-42.1	171.2	0	0	0	0	0	111.6	A577 R578 A579 K584 V585	A577-A581 WeakPolarHBondContact O-CB 3.32Å; A577-A581 PolarHBondContact O-N 3.38Å; R578-A581 WeakPolarHBondContact O-CA 3.33Å; R578-A581 WeakPolarHBondContact O-CB 3.04Å; R578-A581 PolarHBondContact O-N 3.45Å; A579-A581 VanDerWaalsContact C-N 3.28Å; A579-A581 PolarHBondContact O-N 2.97Å; A581-K584 WeakPolarHBondContact O-CB 3.42Å; A581-K584 PolarHBondContact O-N 3.46Å; A581-V585 WeakPolarHBondContact O-CG2 3.48Å; A581-V585 PolarHBondContact O-N 2.74Å
582	E	82.9	Confident	78.3	Confident	86 Å²	86	103 Å²	103	40%	0.402	54%	0.535	S	S	.	.	H	α-helix	trans	-63.3	-40.7	175.2	-70.9	170.9	167.9	0	0	111.2	R578 A579 V585 L586	R578-E582 HydrophobicContact CG-CG 4.47Å; R578-E582 IonicContact CZ-OE1 3.46Å; R578-E582 VanDerWaalsContact CZ-OE1 3.22Å; R578-E582 IonicContact NE-OE1 2.67Å; R578-E582 PolarHBondContact NE-OE1 3.25Å; R578-E582 IonicContact NE-OE2 3.94Å; R578-E582 IonicContact NH2-OE1 3.39Å; R578-E582 PolarHBondContact NH2-OE1 3.28Å; R578-E582 WeakPolarHBondContact O-CG 3.02Å; R578-E582 PolarHBondContact O-N 3.44Å; A579-E582 PolarHBondContact O-N 3.17Å; E582-V585 PolarHBondContact O-N 3.41Å; E582-L586 WeakPolarHBondContact O-CG 3.17Å; E582-L586 PolarHBondContact O-N 3.07Å
583	E	78.9	Confident	76.4	Confident	136 Å²	136	100.9 Å²	100.9	64%	0.636	53%	0.533	S	S	*	.	H	α-helix	trans	-64.1	-38.5	171.5	-173.4	-179.1	-165.4	0	0	112.6	A579 L586 S587	A579-E583 WeakPolarHBondContact O-CB 3.5Å; A579-E583 PolarHBondContact O-N 3.07Å; E583-L586 PolarHBondContact O-N 2.96Å; E583-S587 WeakPolarHBondContact O-CB 3.41Å; E583-S587 PolarHBondContact O-N 3.38Å; E583-S587 PolarHBondContact O-OG 3.48Å
584	K	77.1	Confident	74.4	Confident	148 Å²	148	104.7 Å²	104.7	64%	0.643	54%	0.544	S	S	*	.	H	α-helix	trans	-63.9	-40.9	173.9	-81.7	173.6	-178.6	179.7	0	112.2	A580 A581 S587 T588	A580-K584 WeakPolarHBondContact O-CB 3.22Å; A580-K584 VanDerWaalsContact O-CG 3.23Å; A580-K584 WeakPolarHBondContact O-CG 3.41Å; A580-K584 PolarHBondContact O-N 3.06Å; A581-K584 WeakPolarHBondContact O-CB 3.42Å; A581-K584 PolarHBondContact O-N 3.46Å; K584-S587 WeakPolarHBondContact CA-OG 3.45Å; K584-S587 PolarHBondContact O-N 2.86Å; K584-S587 PolarHBondContact O-OG 3.15Å; K584-S587 VanDerWaalsContact O-OG 3.06Å; K584-T588 WeakPolarHBondContact O-CG2 3.42Å; K584-T588 PolarHBondContact O-N 2.9Å; K584-T588 PolarHBondContact O-OG1 3.3Å; K584-T588 VanDerWaalsContact O-OG1 3.08Å
585	V	76.3	Confident	72.4	Confident	87 Å²	87	105.9 Å²	105.9	53%	0.527	55%	0.548	S	S	.	.	H	α-helix	trans	-61.9	-51.3	173.7	172.8	0	0	0	0	110.5	A581 E582 S587 T588 D589	A581-V585 WeakPolarHBondContact O-CG2 3.48Å; A581-V585 PolarHBondContact O-N 2.74Å; E582-V585 PolarHBondContact O-N 3.41Å; V585-S587 VanDerWaalsContact C-N 3.29Å; V585-S587 PolarHBondContact O-N 3.47Å; V585-T588 WeakPolarHBondContact CA-OG1 3.42Å; V585-T588 PolarHBondContact O-N 3.13Å; V585-T588 VanDerWaalsContact O-N 3.12Å; V585-T588 PolarHBondContact O-OG1 3.33Å; V585-D589 PolarHBondContact O-N 3.13Å
586	L	69.4	Low	70.3	Confident	116 Å²	116	105.3 Å²	105.3	61%	0.607	55%	0.553	S	S	*	*	H	α-helix	trans	-60.6	-34.5	179.5	-73.4	165.2	0	0	0	113.4	E582 E583 R590	E582-L586 WeakPolarHBondContact O-CG 3.17Å; E582-L586 PolarHBondContact O-N 3.07Å; E583-L586 PolarHBondContact O-N 2.96Å; L586-R590 WeakPolarHBondContact O-CG 3.46Å; L586-R590 PolarHBondContact O-N 3.17Å; L586-R590 VanDerWaalsContact O-N 3.14Å
587	S	64.8	Low	68.2	Low	52 Å²	52	106.8 Å²	106.8	36%	0.364	56%	0.564	S	S	.	*	H	α-helix	trans	-76.5	-35.4	174.8	50.9	0	0	0	0	112.6	E583 K584 V585 R590 I591	E583-S587 WeakPolarHBondContact O-CB 3.41Å; E583-S587 PolarHBondContact O-N 3.38Å; E583-S587 PolarHBondContact O-OG 3.48Å; K584-S587 WeakPolarHBondContact CA-OG 3.45Å; K584-S587 PolarHBondContact O-N 2.86Å; K584-S587 PolarHBondContact O-OG 3.15Å; K584-S587 VanDerWaalsContact O-OG 3.06Å; V585-S587 VanDerWaalsContact C-N 3.29Å; V585-S587 PolarHBondContact O-N 3.47Å; S587-R590 PolarHBondContact O-N 3.32Å; S587-I591 WeakPolarHBondContact O-CG1 3.41Å; S587-I591 PolarHBondContact O-N 3.43Å
588	T	63.8	Low	66.3	Low	75 Å²	75	112.3 Å²	112.3	46%	0.46	58%	0.579	S	S	.	*	H	α-helix	trans	-64.6	-40.3	170.8	50.1	0	0	0	0	112.8	K584 V585 R590 I591 L592	K584-T588 WeakPolarHBondContact O-CG2 3.42Å; K584-T588 PolarHBondContact O-N 2.9Å; K584-T588 PolarHBondContact O-OG1 3.3Å; K584-T588 VanDerWaalsContact O-OG1 3.08Å; V585-T588 WeakPolarHBondContact CA-OG1 3.42Å; V585-T588 PolarHBondContact O-N 3.13Å; V585-T588 VanDerWaalsContact O-N 3.12Å; V585-T588 PolarHBondContact O-OG1 3.33Å; T588-R590 VanDerWaalsContact C-N 3.35Å; T588-R590 PolarHBondContact O-N 2.88Å; T588-I591 PolarHBondContact O-N 3.26Å; T588-I591 VanDerWaalsContact O-N 3.14Å; T588-L592 WeakPolarHBondContact O-CG 3.35Å; T588-L592 PolarHBondContact O-N 3.26Å
589	D	59.4	Low	63.9	Low	88 Å²	88	109.4 Å²	109.4	47%	0.471	58%	0.584	S	S	.	*	H	α-helix	trans	-63.3	-39.4	173.6	-93.8	-14.3	0	0	0	111.9	V585 I591 L592 T593	V585-D589 PolarHBondContact O-N 3.13Å; D589-I591 VanDerWaalsContact C-N 3.29Å; D589-I591 PolarHBondContact O-N 2.75Å; D589-L592 PolarHBondContact O-N 3.28Å; D589-T593 WeakPolarHBondContact O-CB 3.37Å; D589-T593 WeakPolarHBondContact O-CG2 3.29Å; D589-T593 PolarHBondContact O-N 3.49Å; D589-T593 PolarHBondContact O-OG1 3.17Å
590	R	59.9	Low	61.5	Low	200 Å²	200	114.6 Å²	114.6	76%	0.755	60%	0.604	S	S	*	*	H	α-helix	trans	-64.6	-30	173	-81	179.8	166	-171.6	-3.2	113.4	L586 S587 T588 T593 R594	L586-R590 WeakPolarHBondContact O-CG 3.46Å; L586-R590 PolarHBondContact O-N 3.17Å; L586-R590 VanDerWaalsContact O-N 3.14Å; S587-R590 PolarHBondContact O-N 3.32Å; T588-R590 VanDerWaalsContact C-N 3.35Å; T588-R590 PolarHBondContact O-N 2.88Å; R590-T593 WeakPolarHBondContact CA-OG1 3.5Å; R590-T593 PolarHBondContact O-OG1 2.93Å; R590-R594 VanDerWaalsContact O-CB 3.27Å; R590-R594 WeakPolarHBondContact O-CB 3.5Å; R590-R594 PolarHBondContact O-N 3.31Å
591	I	59.8	Low	59.9	Low	121 Å²	121	117.7 Å²	117.7	62%	0.621	62%	0.62	S	S	*	*	H	α-helix	trans	-75.8	-44.2	174.9	-69	163.4	0	0	0	110.4	S587 T588 D589 R594 S595	S587-I591 WeakPolarHBondContact O-CG1 3.41Å; S587-I591 PolarHBondContact O-N 3.43Å; T588-I591 PolarHBondContact O-N 3.26Å; T588-I591 VanDerWaalsContact O-N 3.14Å; D589-I591 VanDerWaalsContact C-N 3.29Å; D589-I591 PolarHBondContact O-N 2.75Å; I591-R594 PolarHBondContact O-N 3.42Å; I591-S595 PolarHBondContact O-N 3.5Å; I591-S595 VanDerWaalsContact O-N 3.11Å
592	L	57.1	Low	57.8	Low	111 Å²	111	126.4 Å²	126.4	58%	0.581	64%	0.642	S	S	*	*	H	α-helix	trans	-60.9	-46.9	176.2	-73.7	165.8	0	0	0	111.9	T588 D589 R594 S595	T588-L592 WeakPolarHBondContact O-CG 3.35Å; T588-L592 PolarHBondContact O-N 3.26Å; D589-L592 PolarHBondContact O-N 3.28Å; L592-R594 VanDerWaalsContact C-N 3.32Å; L592-R594 PolarHBondContact O-N 3.02Å; L592-S595 WeakPolarHBondContact O-CB 3.38Å; L592-S595 PolarHBondContact O-N 3.13Å
593	T	54.3	Low	56.1	Low	87 Å²	87	128.9 Å²	128.9	53%	0.534	66%	0.663	S	S	.	*	H	α-helix	trans	-72.5	-18.8	178.8	51.9	0	0	0	0	114.3	D589 R590 T596	D589-T593 WeakPolarHBondContact O-CB 3.37Å; D589-T593 WeakPolarHBondContact O-CG2 3.29Å; D589-T593 PolarHBondContact O-N 3.49Å; D589-T593 PolarHBondContact O-OG1 3.17Å; R590-T593 WeakPolarHBondContact CA-OG1 3.5Å; R590-T593 PolarHBondContact O-OG1 2.93Å; T593-T596 PolarHBondContact O-OG1 3Å
594	R	51.2	Low	54.2	Low	211 Å²	211	128 Å²	128	80%	0.796	67%	0.672	S	S	*	*	H	α-helix	trans	-82.6	-26.9	170.8	-165.2	173.3	-173.1	-176.6	2.1	112.6	R590 I591 L592	R590-R594 VanDerWaalsContact O-CB 3.27Å; R590-R594 WeakPolarHBondContact O-CB 3.5Å; R590-R594 PolarHBondContact O-N 3.31Å; I591-R594 PolarHBondContact O-N 3.42Å; L592-R594 VanDerWaalsContact C-N 3.32Å; L592-R594 PolarHBondContact O-N 3.02Å
595	S	49.3	Very low	52.9	Low	88 Å²	88	132.3 Å²	132.3	62%	0.615	68%	0.684	S	S	*	*	H	α-helix	trans	-68.8	-31.5	177.1	-165.4	0	0	0	0	112.9	I591 L592 L597	I591-S595 PolarHBondContact O-N 3.5Å; I591-S595 VanDerWaalsContact O-N 3.11Å; L592-S595 WeakPolarHBondContact O-CB 3.38Å; L592-S595 PolarHBondContact O-N 3.13Å; S595-L597 VanDerWaalsContact C-N 3.28Å; S595-L597 PolarHBondContact O-N 3.23Å
596	T	48.1	Very low	51.4	Low	108 Å²	108	135.5 Å²	135.5	66%	0.663	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-1.7	-175.4	47.2	0	0	0	0	115.6	T593	T593-T596 PolarHBondContact O-OG1 3Å
597	L	46	Very low	50.3	Low	150 Å²	150	137.3 Å²	137.3	79%	0.785	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	5.3	178.1	-69	176.7	0	0	0	114.7	S595	S595-L597 VanDerWaalsContact C-N 3.28Å; S595-L597 PolarHBondContact O-N 3.23Å
598	Q	47.3	Very low	49.5	Very low	182 Å²	182	138.2 Å²	138.2	85%	0.85	72%	0.724	S	S	*	*	S	Bend	trans	-132.5	61.2	175	-73.8	-166.8	-23.8	0	0	113.9
599	S	39	Very low	48.5	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	74%	0.744	S	S	*	*			trans	-156.3	102.3	152.7	41.7	0	0	0	0	113
600	N	37.5	Very low	47.9	Very low	162 Å²	162	149.2 Å²	149.2	87%	0.866	76%	0.761	S	S	*	*			trans	-99.1	155.8	162.5	-124.1	-6.5	0	0	0	108.6
601	P	54	Low	47.1	Very low	106 Å²	106	148 Å²	148	69%	0.688	77%	0.766	S	S	*	*				-125.6	117.3	-117.8	28.4	-9.2	0	0	0	113.4
602	R	37.9	Very low	46.3	Very low	236 Å²	236	149.6 Å²	149.6	89%	0.891	78%	0.776	S	S	*	*			trans	-139.2	107.4	172.3	-73.7	-166.7	172.3	162	0.2	114.5
603	T	47.5	Very low	45.9	Very low	137 Å²	137	155.2 Å²	155.2	84%	0.84	79%	0.789	S	S	*	*			trans	46.1	100.3	136.4	58.4	0	0	0	0	119.6
604	S	37.9	Very low	45.5	Very low	118 Å²	118	156.9 Å²	156.9	83%	0.825	81%	0.805	S	S	*	*			trans	-154.4	144.9	134.3	59.2	0	0	0	0	111.7
605	R	51.1	Low	45.1	Very low	238 Å²	238	153 Å²	153	90%	0.898	80%	0.804	S	S	*	*			trans	-104.2	125	168.1	-88.5	-176.1	172.9	178.2	-1.3	108.8
606	L	43.9	Very low	44.7	Very low	155 Å²	155	154 Å²	154	81%	0.812	81%	0.811	S	S	*	*			trans	-141.5	105.1	158.4	-83.6	158.3	0	0	0	105.2
607	I	45.5	Very low	44.5	Very low	153 Å²	153	155.9 Å²	155.9	79%	0.785	82%	0.817	S	S	*	*				47.1	89.6	73.3	-52.2	-177.5	0	0	0	109.8
608	G	49.3	Very low	44.6	Very low	71 Å²	71	154.5 Å²	154.5	73%	0.732	81%	0.814	S	S	*	*			trans	-84.1	-179.8	-172.4	0	0	0	0	0	114.9
609	K	43	Very low	44.7	Very low	202 Å²	202	152.3 Å²	152.3	88%	0.878	81%	0.807	S	S	*	*			trans	-145.9	129.8	174.3	-96.8	163.5	-176.6	169.9	0	111.9
610	K	45.6	Very low	45.3	Very low	192 Å²	192	161.3 Å²	161.3	84%	0.835	83%	0.827	S	S	*	*			trans	44.2	102.5	154.4	-61.9	-171.5	174.9	-173.2	0	118.6
611	M	44.2	Very low	45.7	Very low	174 Å²	174	161.3 Å²	161.3	86%	0.857	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-65.5	138.2	147.4	-60.9	153.4	63.6	0	0	109.5
612	N	42.4	Very low	45.2	Very low	155 Å²	155	164.2 Å²	164.2	83%	0.829	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-102.8	126.8	161.1	-76.3	-17	0	0	0	108.6
613	R	47.7	Very low	45.6	Very low	229 Å²	229	160.2 Å²	160.2	86%	0.864	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-82.2	133.3	173.4	-71.2	175.2	169.2	170	-5.8	109.6
614	S	47	Very low	45.5	Very low	123 Å²	123	161.6 Å²	161.6	86%	0.86	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-76	148.4	154.4	43.7	0	0	0	0	109.5
615	V	42.4	Very low	46	Very low	129 Å²	129	164.3 Å²	164.3	78%	0.782	83%	0.829	S	S	*	*			trans	-105.8	126.6	-178.3	178.4	0	0	0	0	109	L617	V615-L617 PolarHBondContact O-N 3.42Å
616	S	42.1	Very low	45.7	Very low	109 Å²	109	159.4 Å²	159.4	76%	0.762	82%	0.824	S	S	*	*			trans	-78.4	114.7	170.2	51.7	0	0	0	0	109.8
617	L	43.8	Very low	45.8	Very low	148 Å²	148	159.7 Å²	159.7	78%	0.775	83%	0.825	S	S	*	*			trans	-90.8	113.8	174.1	-164.9	78	0	0	0	109.4	V615 I619	V615-L617 PolarHBondContact O-N 3.42Å; L617-I619 HydrophobicContact CD1-CD1 4.45Å; L617-I619 HydrophobicContact CD2-CD1 3.88Å; L617-I619 HydrophobicContact CD2-CG1 4.39Å; L617-I619 HydrophobicContact CG-CD1 4.14Å; L617-I619 HydrophobicContact CG-CG1 4.18Å
618	T	46.3	Very low	45.8	Very low	120 Å²	120	160.2 Å²	160.2	74%	0.736	83%	0.828	S	S	*	*			trans	-109.7	120	167.1	-54.5	0	0	0	0	107.8
619	I	50.5	Low	45.5	Very low	137 Å²	137	167.7 Å²	167.7	70%	0.703	84%	0.836	S	S	*	*			trans	-126.2	139.3	169.9	-63.2	177.9	0	0	0	106.1	L617	L617-I619 HydrophobicContact CD1-CD1 4.45Å; L617-I619 HydrophobicContact CD2-CD1 3.88Å; L617-I619 HydrophobicContact CD2-CG1 4.39Å; L617-I619 HydrophobicContact CG-CD1 4.14Å; L617-I619 HydrophobicContact CG-CG1 4.18Å
620	Y	51.2	Low	45.7	Very low	294 Å²	294	164.5 Å²	164.5	100%	1.153	83%	0.832	S	S	*	*			trans	-80.7	0	177	-78.8	-90.4	0	0	0	111.5

Retrieved 620 of 620 residues in 108.7 ms (Link to these results)

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