A0A087Y628_POEFO Loading...

YTH domain-containing family protein

Specifically recognizes and binds N6-methyladenosine (m6A)-containing RNAs, and regulates mRNA stability. M6A is a modification present at internal sites of mRNAs and some non-coding RNAs and plays a role in mRNA stability and processing.

AlphaFold DB , UniProt , Accession A0A087Y628, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 663 aa.

Structure Viewer

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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	38.2	Very low	37.7	Very low	238 Å²	238	146.8 Å²	146.8	100%	1.172	78%	0.779	S	S	*	*				0	95.6	0	-57.4	172.8	-171.5	0	0	104.6
2	A	36.1	Very low	37.7	Very low	100 Å²	100	150.7 Å²	150.7	83%	0.826	79%	0.79	S	S	*	*				72.5	108.4	59.7	0	0	0	0	0	110.6
3	A	34.8	Very low	38.6	Very low	107 Å²	107	151.6 Å²	151.6	88%	0.884	80%	0.795	S	S	*	*			trans	-134.1	94.4	175.7	0	0	0	0	0	107.7
4	D	42	Very low	38.7	Very low	139 Å²	139	149.1 Å²	149.1	74%	0.743	78%	0.782	S	S	*	*			trans	-94.8	160.5	165.5	-90.5	-54.4	0	0	0	107.5
5	R	39.8	Very low	39.5	Very low	192 Å²	192	147.1 Å²	147.1	73%	0.725	78%	0.778	S	S	*	*			cis	-178.1	157.7	-22.6	-134.1	-175	-169.1	-155.1	-0.3	106
6	R	38.9	Very low	39.9	Very low	175 Å²	175	147.1 Å²	147.1	66%	0.66	78%	0.778	S	S	*	*			trans	75	128.3	158.2	-64	-172.8	134.6	163.5	-5.9	117.1
7	E	40.5	Very low	40.5	Very low	147 Å²	147	145.7 Å²	145.7	69%	0.687	77%	0.766	S	S	*	*				79.1	138	95.5	-63.4	154	-164.3	0	0	110.7
8	E	36.2	Very low	40.6	Very low	146 Å²	146	145.6 Å²	145.6	68%	0.682	77%	0.766	S	S	*	*			cis	-152.5	168.7	18.2	-129.3	-174.6	148.3	0	0	111
9	K	36	Very low	40.9	Very low	153 Å²	153	145.8 Å²	145.8	67%	0.665	77%	0.767	S	S	*	*			trans	37.7	156.5	142.3	-71.8	174.5	172.8	151.5	0	123.2
10	D	38.1	Very low	41.2	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	77%	0.771	S	S	*	*			cis	-158.8	168.4	-4.1	-110.1	-28.6	0	0	0	109.2
11	G	34.2	Very low	41.7	Very low	73 Å²	73	145 Å²	145	75%	0.753	77%	0.767	S	S	*	*			trans	106.5	84.4	154.6	0	0	0	0	0	118.8
12	E	37.5	Very low	41.9	Very low	193 Å²	193	143 Å²	143	90%	0.902	76%	0.755	S	S	*	*			trans	-115.1	132.8	155.1	-70.8	-172	150.9	0	0	109
13	L	49.3	Very low	42.4	Very low	163 Å²	163	142.3 Å²	142.3	85%	0.853	75%	0.749	S	S	*	*			trans	-93.6	124.4	-176	-71.1	167.9	0	0	0	111.6	V15	L13-V15 HydrophobicContact CB-CG2 4.37Å; L13-V15 PolarHBondContact O-N 3.45Å
14	N	40.2	Very low	43	Very low	116 Å²	116	143.2 Å²	143.2	62%	0.62	75%	0.746	S	S	*	*			trans	-77.4	75.9	176.1	-88	-0.1	0	0	0	112.2	L16 E17	N14-L16 PolarHBondContact O-N 3.36Å; N14-E17 HydrophobicContact CB-CB 4.46Å; N14-E17 PolarHBondContact ND2-OE2 2.87Å; N14-E17 PolarHBondContact O-N 2.77Å
15	V	50.9	Low	43.3	Very low	119 Å²	119	144.5 Å²	144.5	72%	0.721	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	26.2	174.6	-157.7	0	0	0	0	113	L13	L13-V15 HydrophobicContact CB-CG2 4.37Å; L13-V15 PolarHBondContact O-N 3.45Å
16	L	44.9	Very low	43.4	Very low	148 Å²	148	143.6 Å²	143.6	78%	0.775	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.5	3.6	-178.8	-74	173.3	0	0	0	113	N14	N14-L16 PolarHBondContact O-N 3.36Å
17	E	50.5	Low	43.2	Very low	123 Å²	123	142.7 Å²	142.7	58%	0.575	77%	0.765	S	S	*	*	S	Bend	trans	-99.3	-30.3	-177.7	-136.1	149.5	-178.1	0	0	112.6	N14 L19 T21	N14-E17 HydrophobicContact CB-CB 4.46Å; N14-E17 PolarHBondContact ND2-OE2 2.87Å; N14-E17 PolarHBondContact O-N 2.77Å; E17-L19 PolarHBondContact O-N 3.02Å; E17-T21 PolarHBondContact O-OG1 3.24Å
18	D	42.6	Very low	43.5	Very low	144 Å²	144	143.7 Å²	143.7	77%	0.77	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-73.5	-24.9	177.5	-63.3	-33.2	0	0	0	113.8	L20	D18-L20 PolarHBondContact O-N 2.74Å; D18-L20 VanDerWaalsContact O-N 3.12Å
19	L	46.5	Very low	44.1	Very low	150 Å²	150	145.3 Å²	145.3	79%	0.785	78%	0.783	S	S	*	*	G	3₁₀ helix	trans	-82.1	13.8	-170.2	-119.1	167.4	0	0	0	114.9	E17	E17-L19 PolarHBondContact O-N 3.02Å
20	L	47.5	Very low	44.6	Very low	162 Å²	162	145.8 Å²	145.8	85%	0.848	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-143.7	9.7	-174.5	-88.4	173	0	0	0	114.6	D18	D18-L20 PolarHBondContact O-N 2.74Å; D18-L20 VanDerWaalsContact O-N 3.12Å
21	T	50.5	Low	44.8	Very low	112 Å²	112	148.7 Å²	148.7	69%	0.687	79%	0.793	S	S	*	*	S	Bend	trans	-111.7	-12.8	-163.6	-50	0	0	0	0	114.3	E17	E17-T21 PolarHBondContact O-OG1 3.24Å
22	E	43.2	Very low	45.2	Very low	197 Å²	197	150.5 Å²	150.5	92%	0.921	79%	0.786	S	S	*	*			trans	-107.4	116.1	175.2	-68.7	-171.9	138	0	0	112.6
23	A	46.4	Very low	45.4	Very low	85 Å²	85	146.2 Å²	146.2	70%	0.702	77%	0.774	S	S	*	*			trans	-138.5	134.6	151.5	0	0	0	0	0	105.8	D25	A23-D25 PolarHBondContact O-N 2.79Å
24	P	47.2	Very low	44.7	Very low	125 Å²	125	146.6 Å²	146.6	81%	0.812	77%	0.772	S	S	*	*			trans	-74.4	129	-170.2	28.2	-34.3	0	0	0	112.3
25	D	48.5	Very low	44.9	Very low	167 Å²	167	147 Å²	147	89%	0.893	78%	0.779	S	S	*	*			trans	-85.6	111.8	162.7	-73.2	-40.1	0	0	0	108.6	A23	A23-D25 PolarHBondContact O-N 2.79Å
26	Q	41	Very low	44.4	Very low	172 Å²	172	150 Å²	150	80%	0.804	79%	0.785	S	S	*	*			trans	-142.3	155.7	167	-73.2	-163.3	-46.9	0	0	111.7
27	D	35.5	Very low	44.3	Very low	156 Å²	156	153.8 Å²	153.8	83%	0.834	79%	0.789	S	S	*	*			trans	64.7	86.4	168.6	-56.6	-13.7	0	0	0	118.3
28	D	46.2	Very low	43.8	Very low	168 Å²	168	155.8 Å²	155.8	90%	0.898	80%	0.803	S	S	*	*			trans	-139.8	56.6	170.9	-154.8	14.1	0	0	0	110.6
29	E	48.6	Very low	43.5	Very low	181 Å²	181	156.3 Å²	156.3	85%	0.846	81%	0.812	S	S	*	*			trans	-135.6	155.8	171.7	-82.1	-152	173	0	0	113.7
30	L	47.4	Very low	42.9	Very low	163 Å²	163	152.2 Å²	152.2	85%	0.853	81%	0.806	S	S	*	*			trans	71.3	80.8	169.8	-61.9	173	0	0	0	119.4
31	Y	41.6	Very low	42.4	Very low	205 Å²	205	150.8 Å²	150.8	80%	0.804	80%	0.799	S	S	*	*			trans	-136.5	127.7	134.4	-171.5	-100.6	0	0	0	110.8	P33	Y31-P33 HydrophobicContact CE1-CB 4.13Å
32	N	43	Very low	41.9	Very low	112 Å²	112	154.7 Å²	154.7	60%	0.599	81%	0.806	S	S	*	*			trans	-123.9	112.1	-176.1	-179.1	24.4	0	0	0	110.7	E34	N32-E34 PolarHBondContact O-N 3.1Å
33	P	41.5	Very low	41.6	Very low	102 Å²	102	154.6 Å²	154.6	66%	0.662	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	25.4	-162.9	36.1	-39	0	0	0	116	Y31	Y31-P33 HydrophobicContact CE1-CB 4.13Å
34	E	35.5	Very low	41	Very low	172 Å²	172	154.1 Å²	154.1	80%	0.804	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	5.3	-172	-68.7	-134.3	127.5	0	0	116.3	N32	N32-E34 PolarHBondContact O-N 3.1Å
35	T	43.3	Very low	40.3	Very low	125 Å²	125	155.2 Å²	155.2	77%	0.767	81%	0.81	S	S	*	*			trans	-103.3	-6.4	-172	44.9	0	0	0	0	117.2	R37	T35-R37 PolarHBondContact O-N 3.33Å
36	E	40.2	Very low	39.7	Very low	181 Å²	181	156.3 Å²	156.3	85%	0.846	81%	0.807	S	S	*	*			trans	-100.4	65.7	179.4	-69.6	-150.2	125.3	0	0	114.2
37	R	43.2	Very low	39.5	Very low	228 Å²	228	159.6 Å²	159.6	86%	0.86	81%	0.812	S	S	*	*			trans	-146.6	83.7	161.5	-71.7	-167.3	-179.3	152.7	4.6	112.4	T35	T35-R37 PolarHBondContact O-N 3.33Å
38	D	40.2	Very low	39.5	Very low	164 Å²	164	160.6 Å²	160.6	88%	0.877	81%	0.809	S	S	*	*			trans	160.4	93.7	138.2	-89.8	-25.2	0	0	0	111.8
39	V	36.2	Very low	38.8	Very low	156 Å²	156	156.7 Å²	156.7	95%	0.945	80%	0.795	S	S	*	*			trans	-134.1	76.7	159.9	-171.1	0	0	0	0	110
40	G	34.8	Very low	38	Very low	64 Å²	64	155.3 Å²	155.3	66%	0.66	79%	0.789	S	S	*	*			trans	-103.6	116.6	172.3	0	0	0	0	0	112.4
41	D	37	Very low	37.3	Very low	131 Å²	131	157 Å²	157	70%	0.701	78%	0.784	S	S	*	*			trans	47.6	120.9	157	-104	-44.3	0	0	0	119
42	K	38.8	Very low	36.9	Very low	194 Å²	194	152.1 Å²	152.1	84%	0.843	78%	0.779	S	S	*	*				-176.3	158.5	113.3	-95.1	149.2	-140.7	89.2	0	115.8
43	K	36.7	Very low	36.5	Very low	196 Å²	196	153 Å²	153	85%	0.852	78%	0.784	S	S	*	*			trans	-87.6	113.9	-168.2	-62.7	160.7	-179.8	167.3	0	114.2
44	G	33.8	Very low	36.1	Very low	75 Å²	75	152.6 Å²	152.6	77%	0.773	78%	0.784	S	S	*	*			trans	68.3	-161.7	130.5	0	0	0	0	0	121.7
45	V	32.4	Very low	36	Very low	148 Å²	148	154.1 Å²	154.1	90%	0.897	79%	0.791	S	S	*	*			trans	98.3	139.5	-175.5	-175.3	0	0	0	0	116
46	K	36.4	Very low	35.6	Very low	189 Å²	189	154.3 Å²	154.3	82%	0.822	79%	0.787	S	S	*	*			trans	-94	149.6	-169.9	-55.7	168.7	177.8	175.8	0	113.2
47	R	38.3	Very low	35.3	Very low	241 Å²	241	152.4 Å²	152.4	91%	0.909	79%	0.788	S	S	*	*			trans	164.6	166.1	136.3	-87.5	146.1	-173.2	169.5	0.1	109.3
48	K	33.7	Very low	34.9	Very low	178 Å²	178	149.5 Å²	149.5	77%	0.774	78%	0.781	S	S	*	*			cis	172.4	139.2	-39.2	-175	-158	171.2	-165.1	0	105.8
49	S	33.1	Very low	34.7	Very low	86 Å²	86	153 Å²	153	60%	0.601	78%	0.782	S	S	*	*			trans	66.4	151.8	168	19.7	0	0	0	0	115.5
50	E	32	Very low	34.4	Very low	152 Å²	152	153.8 Å²	153.8	71%	0.71	78%	0.78	S	S	*	*			cis	-161.9	159.7	-9.5	-126.3	177.2	131.8	0	0	110.9
51	R	32.4	Very low	34.5	Very low	199 Å²	199	161.6 Å²	161.6	75%	0.751	79%	0.79	S	S	*	*			trans	44.1	134.5	139.7	-125	166.9	179.4	152.4	-4.2	119.8
52	S	32.9	Very low	34.8	Very low	102 Å²	102	161 Å²	161	71%	0.713	79%	0.793	S	S	*	*				-169.1	167.7	54.6	-54.5	0	0	0	0	115
53	D	34.6	Very low	34.5	Very low	130 Å²	130	156.9 Å²	156.9	70%	0.695	79%	0.788	S	S	*	*			trans	-19.8	163.9	155	-70.1	-83.7	0	0	0	120.6
54	S	32.7	Very low	34.3	Very low	94 Å²	94	153.4 Å²	153.4	66%	0.657	79%	0.789	S	S	*	*			cis	174.8	149	-19.8	-92.1	0	0	0	0	108.2
55	Q	32.6	Very low	34	Very low	203 Å²	203	152.9 Å²	152.9	95%	0.949	78%	0.783	S	S	*	*				169	139.4	126.9	-94.2	179.9	1.7	0	0	115
56	D	35.1	Very low	34	Very low	129 Å²	129	155.6 Å²	155.6	69%	0.69	79%	0.786	S	S	*	*			trans	-109.8	138.8	178.7	-145.9	-45.7	0	0	0	109.3
57	V	34.8	Very low	33.7	Very low	142 Å²	142	151 Å²	151	86%	0.861	78%	0.783	S	S	*	*			trans	-161.8	87.5	147.5	-102.2	0	0	0	0	115
58	K	34.3	Very low	34.1	Very low	167 Å²	167	145 Å²	145	73%	0.726	78%	0.775	S	S	*	*				26.7	118.9	127.6	-64.3	164.9	-176.2	163.8	0	121.4
59	R	35.2	Very low	34.1	Very low	237 Å²	237	141.2 Å²	141.2	89%	0.894	77%	0.771	S	S	*	*				53.4	142.6	126.6	-64.6	-174.2	173.5	-157.6	-2.6	121.8
60	L	31.6	Very low	34	Very low	173 Å²	173	148.6 Å²	148.6	91%	0.906	79%	0.786	S	S	*	*				-165.8	158	115.3	-103.1	167.1	0	0	0	113.6
61	R	35.5	Very low	33.9	Very low	228 Å²	228	146.1 Å²	146.1	86%	0.86	79%	0.786	S	S	*	*			trans	-128.7	152.6	165.2	-92.8	-174.2	170.5	-176.1	-2.3	106.4
62	P	44	Very low	33.9	Very low	118 Å²	118	142.5 Å²	142.5	77%	0.766	79%	0.79	S	S	*	*				-159.9	138	107.8	38.4	-17.9	0	0	0	119.4
63	S	31.9	Very low	33.7	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	79%	0.792	S	S	*	*			trans	53.7	149	132.6	71.5	0	0	0	0	126.3
64	S	32.1	Very low	33.6	Very low	124 Å²	124	144.6 Å²	144.6	87%	0.867	80%	0.801	S	S	*	*			trans	83.5	146	158.1	78.3	0	0	0	0	118.1
65	G	28.4	Very low	33.6	Very low	63 Å²	63	152 Å²	152	65%	0.649	82%	0.815	S	S	*	*			cis	170.5	177.4	-8.1	0	0	0	0	0	114.8
66	H	32.5	Very low	33.5	Very low	206 Å²	206	146.4 Å²	146.4	95%	0.954	80%	0.803	S	S	*	*			trans	90.5	152.3	171.1	-57.8	-37.2	0	0	0	120.8
67	A	30.8	Very low	33.5	Very low	91 Å²	91	148 Å²	148	75%	0.752	81%	0.811	S	S	*	*			trans	-144.9	165.4	166.1	0	0	0	0	0	107.1
68	P	47	Very low	33.2	Very low	117 Å²	117	146 Å²	146	76%	0.76	80%	0.803	S	S	*	*				-156.1	141.2	121	36.3	-17.1	0	0	0	118.9
69	S	33	Very low	33	Very low	98 Å²	98	142.3 Å²	142.3	69%	0.685	80%	0.799	S	S	*	*			trans	74	133.3	130.2	77.2	0	0	0	0	124.6
70	R	31.2	Very low	32.9	Very low	240 Å²	240	140.5 Å²	140.5	91%	0.906	80%	0.797	S	S	*	*			trans	72.3	151.7	135.1	-79.2	171.6	161.4	-176.8	-8.6	118.9
71	S	30.3	Very low	33	Very low	101 Å²	101	141.8 Å²	141.8	71%	0.706	80%	0.795	S	S	*	*			cis	-158.3	139	0	47	0	0	0	0	115.6
72	S	31.3	Very low	33.5	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	79%	0.792	S	S	*	*			trans	30.6	127.7	144.5	63.3	0	0	0	0	123.9
73	G	29.6	Very low	32.8	Very low	73 Å²	73	136.4 Å²	136.4	75%	0.753	79%	0.793	S	S	*	*			trans	-154.2	148.1	153	0	0	0	0	0	112
74	K	32.6	Very low	32.9	Very low	203 Å²	203	136.5 Å²	136.5	88%	0.883	79%	0.793	S	S	*	*			trans	-152.6	157.4	-177.8	-75	-173.3	176.6	178	0	112.6
75	R	31.8	Very low	33.6	Very low	250 Å²	250	136.8 Å²	136.8	94%	0.943	79%	0.792	S	S	*	*			trans	71	157.5	170.4	-69.8	175.2	168.7	-178.6	-4.9	114.3
76	A	31.2	Very low	33.6	Very low	85 Å²	85	143.3 Å²	143.3	70%	0.702	80%	0.797	S	S	*	*			cis	-176.4	171.9	-15	0	0	0	0	0	107.9
77	L	33.7	Very low	33.5	Very low	163 Å²	163	142.2 Å²	142.2	85%	0.853	79%	0.785	S	S	*	*			cis	-165.6	169.7	-1.3	-128.2	172.4	0	0	0	109.9
78	S	30	Very low	33.4	Very low	99 Å²	99	145.9 Å²	145.9	69%	0.692	79%	0.786	S	S	*	*			trans	74.4	148.2	153.7	144.6	0	0	0	0	119.4
79	S	30.4	Very low	32.6	Very low	91 Å²	91	144.4 Å²	144.4	64%	0.636	78%	0.784	S	S	*	*			cis	-168.1	164.9	-16.7	58.6	0	0	0	0	115
80	K	32.3	Very low	32.4	Very low	199 Å²	199	147 Å²	147	87%	0.865	80%	0.796	S	S	*	*			trans	74.5	105.7	149.3	-76.4	164.3	-179.3	176.9	0	123
81	K	33.8	Very low	32.5	Very low	200 Å²	200	140 Å²	140	87%	0.87	79%	0.789	S	S	*	*			trans	-70.1	179.3	137.5	-78.3	-178.4	179.8	178.9	0	110.5
82	P	45.9	Very low	32.3	Very low	120 Å²	120	145.9 Å²	145.9	78%	0.779	80%	0.797	S	S	*	*			cis	-131.1	-148.4	19.5	40.4	-16.6	0	0	0	112.8
83	S	30	Very low	32.2	Very low	113 Å²	113	147.7 Å²	147.7	79%	0.79	79%	0.792	S	S	*	*			cis	-162.9	171	12.5	22.4	0	0	0	0	112.9
84	S	33.6	Very low	32.1	Very low	108 Å²	108	150.2 Å²	150.2	76%	0.755	78%	0.784	S	S	*	*			trans	-126.4	159.3	167.2	173.9	0	0	0	0	109.9
85	P	45.6	Very low	31.9	Very low	131 Å²	131	147.7 Å²	147.7	85%	0.851	78%	0.775	S	S	*	*				-144.9	174.2	124.4	37.1	-21.1	0	0	0	117.7
86	R	29.7	Very low	31.8	Very low	199 Å²	199	147 Å²	147	75%	0.751	77%	0.774	S	S	*	*			trans	-79.4	158.4	-169.7	-97.7	172.5	158	-173.8	-1.6	118.2
87	R	30.1	Very low	31.7	Very low	183 Å²	183	152.8 Å²	152.8	69%	0.691	78%	0.779	S	S	*	*			trans	66.6	156.3	147.1	-65.6	166.7	173.2	-155.6	0.4	116.7
88	H	27.8	Very low	31.6	Very low	168 Å²	168	152.5 Å²	152.5	78%	0.778	77%	0.774	S	S	*	*			cis	-143.6	-166.9	25.7	-111.1	-79.5	0	0	0	111.8
89	A	31.4	Very low	31.5	Very low	87 Å²	87	153.2 Å²	153.2	72%	0.719	77%	0.766	S	S	*	*			trans	-141.5	150.4	179.8	0	0	0	0	0	113.7
90	T	28.7	Very low	31.5	Very low	153 Å²	153	158 Å²	158	94%	0.939	77%	0.77	S	S	*	*			trans	-167.9	168.3	161.7	20.7	0	0	0	0	110.5
91	A	32.7	Very low	31.5	Very low	91 Å²	91	157.8 Å²	157.8	75%	0.752	77%	0.769	S	S	*	*			trans	-137.8	149.4	-173.5	0	0	0	0	0	114.8
92	Y	26.9	Very low	31.3	Very low	226 Å²	226	151.4 Å²	151.4	89%	0.886	76%	0.76	S	S	*	*			trans	-160	158.5	170.5	-83.9	-95.1	0	0	0	108.4
93	H	27.9	Very low	30.6	Very low	159 Å²	159	156.6 Å²	156.6	74%	0.736	76%	0.764	S	S	*	*			cis	-166.6	-153.8	-28	-167.8	26.6	0	0	0	110
94	H	27.7	Very low	30.6	Very low	126 Å²	126	161.5 Å²	161.5	58%	0.583	77%	0.765	S	S	*	*			trans	-62	141.3	-178.5	-96.3	-47.7	0	0	0	115.5
95	E	29.7	Very low	30.5	Very low	151 Å²	151	159.7 Å²	159.7	71%	0.706	76%	0.764	S	S	*	*				71.9	144	88.9	-92.3	177.6	-130.7	0	0	117.6
96	Y	29.1	Very low	30.7	Very low	234 Å²	234	159.5 Å²	159.5	92%	0.918	76%	0.763	S	S	*	*			trans	-148.1	161.2	167	-115.8	-88.8	0	0	0	111.5
97	Y	29.8	Very low	30.9	Very low	207 Å²	207	160.7 Å²	160.7	81%	0.812	77%	0.767	S	S	*	*			trans	-104	136.1	-153.4	-127.1	-121.1	0	0	0	115.8
98	E	29.7	Very low	30.9	Very low	158 Å²	158	160 Å²	160	74%	0.738	77%	0.771	S	S	*	*			trans	45.6	159.5	131.8	-88	-76.8	-159.7	0	0	126.7
99	E	28.9	Very low	30.9	Very low	114 Å²	114	155 Å²	155	53%	0.533	77%	0.766	S	S	.	*			trans	87.3	122.2	150.4	-76.4	-135.4	123.7	0	0	123.8
100	R	31.1	Very low	31.6	Very low	192 Å²	192	156.1 Å²	156.1	73%	0.725	77%	0.766	S	S	*	*			trans	77.9	142	135.3	-78.1	-179.8	-172.6	163.3	20.1	118.9
101	K	31.9	Very low	31.7	Very low	194 Å²	194	159.8 Å²	159.8	84%	0.843	76%	0.763	S	S	*	*			cis	-145.6	171.6	7.5	-53.3	176	-174.8	162.9	0	108.8
102	G	30	Very low	31.6	Very low	66 Å²	66	160.1 Å²	160.1	68%	0.68	76%	0.759	S	S	*	*			cis	130.6	130.9	-6	0	0	0	0	0	114.9
103	R	30.4	Very low	31.7	Very low	228 Å²	228	161.6 Å²	161.6	86%	0.86	76%	0.763	S	S	*	*			trans	97.5	148.1	176.7	-60.2	179.5	174.6	-141.8	0.4	116.6
104	R	30.3	Very low	31.7	Very low	217 Å²	217	157.2 Å²	157.2	82%	0.819	76%	0.761	S	S	*	*			cis	-162.1	157.8	-21.2	-108.6	178.3	-174.7	-162.4	-0.6	109
105	G	30.2	Very low	32	Very low	70 Å²	70	155.6 Å²	155.6	72%	0.722	77%	0.77	S	S	*	*			trans	-82.2	-166.6	175.9	0	0	0	0	0	115
106	P	50.1	Low	32.1	Very low	127 Å²	127	157.1 Å²	157.1	83%	0.825	78%	0.777	S	S	*	*				-152.5	152.2	62.9	40.7	-20.9	0	0	0	120.4
107	R	35.1	Very low	32.3	Very low	224 Å²	224	152.7 Å²	152.7	85%	0.845	77%	0.769	S	S	*	*				39.3	126.6	127.4	-142.8	-175	-155	175.3	6.7	123.4
108	E	30.1	Very low	32.5	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	76%	0.757	S	S	*	*				158.4	167.4	124.6	-81.4	-61.7	130.7	0	0	110.8
109	G	27.5	Very low	32.7	Very low	65 Å²	65	148.5 Å²	148.5	67%	0.67	75%	0.753	S	S	*	*			trans	-128.6	-146.9	-178.3	0	0	0	0	0	113.2
110	P	46.2	Very low	33	Very low	109 Å²	109	153.1 Å²	153.1	71%	0.708	77%	0.765	S	S	*	*			cis	-142.2	-170.3	-10.8	44	-25.9	0	0	0	115.2
111	R	29.8	Very low	32.9	Very low	231 Å²	231	155 Å²	155	87%	0.872	77%	0.772	S	S	*	*			trans	69.1	167.7	160.7	-63.7	170.8	-173.5	177.7	2.2	117.5
112	S	30.7	Very low	32.9	Very low	97 Å²	97	153.1 Å²	153.1	68%	0.678	77%	0.767	S	S	*	*			cis	-174.2	147.1	-35.7	-83.4	0	0	0	0	111
113	R	28.9	Very low	33	Very low	257 Å²	257	154.3 Å²	154.3	97%	0.97	77%	0.765	S	S	*	*			trans	68.8	158.5	171.6	-57.9	169.1	177.6	167.8	-2.9	115.2
114	G	28.4	Very low	33	Very low	67 Å²	67	150.3 Å²	150.3	69%	0.691	76%	0.756	S	S	*	*			cis	160.1	175.3	-5.9	0	0	0	0	0	112.1
115	A	33.3	Very low	33.1	Very low	93 Å²	93	150.7 Å²	150.7	77%	0.769	76%	0.757	S	S	*	*			trans	64.9	135	178.5	0	0	0	0	0	115.8
116	E	32.6	Very low	33.1	Very low	182 Å²	182	150.8 Å²	150.8	85%	0.85	76%	0.758	S	S	*	*			cis	102.1	133.1	32.6	-79.3	-177.6	151.3	0	0	113.7
117	D	34.1	Very low	32.2	Very low	142 Å²	142	151.4 Å²	151.4	76%	0.759	76%	0.759	S	S	*	*			trans	55.3	169.5	161.8	-82	20.9	0	0	0	120.7
118	D	34.1	Very low	32	Very low	106 Å²	106	149.4 Å²	149.4	57%	0.567	76%	0.76	S	S	*	*			cis	-167.7	167.8	-47.6	-165.8	2	0	0	0	108.2
119	R	33.1	Very low	32.2	Very low	171 Å²	171	145.6 Å²	145.6	65%	0.645	76%	0.757	S	S	*	*			trans	68	118.8	154.4	-75.3	161.2	-143.9	158.9	29.2	122.8
120	R	35.4	Very low	32.3	Very low	211 Å²	211	150.4 Å²	150.4	80%	0.796	77%	0.766	S	S	*	*				74.7	132.7	118.6	-66.4	171.7	177.3	-129.6	0.2	123.1
121	R	29.1	Very low	31.6	Very low	231 Å²	231	150.3 Å²	150.3	87%	0.872	77%	0.768	S	S	*	*				-162.4	143.5	126.9	-115.8	170.4	170.9	168.6	-4.3	107.7
122	E	31.8	Very low	31.8	Very low	154 Å²	154	150 Å²	150	72%	0.72	77%	0.767	S	S	*	*			cis	67	121.9	31.4	-138.8	177.2	-170.8	0	0	111.1
123	S	32.3	Very low	31.8	Very low	92 Å²	92	153.7 Å²	153.7	64%	0.643	77%	0.771	S	S	*	*			cis	-157.3	-175.2	32.6	-38.9	0	0	0	0	109.8
124	Q	30.9	Very low	31.9	Very low	144 Å²	144	146.7 Å²	146.7	67%	0.673	75%	0.752	S	S	*	*			cis	-160.7	-162.9	-7.7	-134.1	175.6	98.8	0	0	112.2
125	R	31.4	Very low	32	Very low	225 Å²	225	153.9 Å²	153.9	85%	0.849	76%	0.758	S	S	*	*			trans	-37.2	159.6	168.4	-59.6	154.9	-170.6	-175.2	1.1	117.4
126	G	29.7	Very low	31.9	Very low	72 Å²	72	158.9 Å²	158.9	74%	0.742	76%	0.757	S	S	*	*			cis	129.8	146.2	-4.2	0	0	0	0	0	114.8
127	V	32.7	Very low	31.9	Very low	140 Å²	140	155.5 Å²	155.5	85%	0.848	75%	0.745	S	S	*	*			trans	-149.3	127.9	168.9	-97.3	0	0	0	0	113.6
128	E	30.8	Very low	31.8	Very low	182 Å²	182	155.2 Å²	155.2	85%	0.85	74%	0.739	S	S	*	*			trans	32	115.5	144.9	-53	-166.4	131.1	0	0	120.9
129	A	33	Very low	31.6	Very low	87 Å²	87	160.2 Å²	160.2	72%	0.719	75%	0.75	S	S	*	*				90.1	132.1	66.9	0	0	0	0	0	112.7
130	L	30.4	Very low	31.6	Very low	166 Å²	166	163.3 Å²	163.3	87%	0.869	76%	0.762	S	S	*	*				-155.2	-177.1	56.6	-86.4	167.6	0	0	0	114.5
131	S	31.9	Very low	31.4	Very low	107 Å²	107	159.4 Å²	159.4	75%	0.748	76%	0.761	S	S	*	*			trans	82.5	67.4	155.9	-63.7	0	0	0	0	121.7
132	R	32.8	Very low	31.7	Very low	223 Å²	223	153.6 Å²	153.6	84%	0.842	76%	0.756	S	S	*	*				47.6	120.7	117.9	-63.8	178.5	175.8	-159.1	-0.4	121.1
133	K	32.1	Very low	32.1	Very low	176 Å²	176	152 Å²	152	77%	0.765	76%	0.759	S	S	*	*			trans	72	151	131.6	-67.8	-173.4	168.2	-176.7	0	117.3
134	L	30.8	Very low	32.1	Very low	110 Å²	110	153.5 Å²	153.5	58%	0.576	77%	0.769	S	S	*	*			cis	-164.6	137.9	-3	-111.1	167.7	0	0	0	109
135	R	30.4	Very low	33.1	Very low	218 Å²	218	152.6 Å²	152.6	82%	0.823	78%	0.776	S	S	*	*			trans	63	165.2	146.1	-76.5	-179.9	-171.2	160.3	3.5	118.4
136	R	30.3	Very low	33.1	Very low	197 Å²	197	151.4 Å²	151.4	74%	0.743	78%	0.779	S	S	*	*			cis	-170.7	137.9	-22.5	169	170.7	-171	-172.2	-1.7	110.7
137	D	31.9	Very low	33.1	Very low	111 Å²	111	150.8 Å²	150.8	59%	0.594	77%	0.773	S	S	*	*			trans	42.8	145.6	152.6	-57.2	-1.9	0	0	0	124.1
138	E	32.6	Very low	33.1	Very low	136 Å²	136	153 Å²	153	64%	0.636	78%	0.775	S	S	*	*				101.2	138.6	129.6	-83.5	-96.1	71.6	0	0	123.3
139	R	30.8	Very low	33.2	Very low	212 Å²	212	150.8 Å²	150.8	80%	0.8	77%	0.768	S	S	*	*			trans	75.8	137.4	155	-71	159.5	-154.6	-130	-5	122.5
140	R	32.8	Very low	33	Very low	236 Å²	236	151.6 Å²	151.6	89%	0.891	76%	0.761	S	S	*	*			trans	-102.4	159.4	160.1	-64.9	175.6	168.4	-152.5	-3.2	109.1
141	V	31.6	Very low	33	Very low	128 Å²	128	151.7 Å²	151.7	78%	0.776	76%	0.756	S	S	*	*				147.2	124.3	127.1	165.1	0	0	0	0	111.8
142	S	34.5	Very low	33	Very low	109 Å²	109	150.5 Å²	150.5	76%	0.762	75%	0.748	S	S	*	*			trans	60.7	146.7	165.4	-57.6	0	0	0	0	119
143	P	40.8	Very low	33	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	74%	0.743	S	S	*	*				-144.5	158.7	105.7	39.8	-27.5	0	0	0	115.6
144	S	31.3	Very low	32.9	Very low	122 Å²	122	147.3 Å²	147.3	85%	0.853	75%	0.745	S	S	*	*			trans	-160.8	132.7	158.2	-70.3	0	0	0	0	110.1
145	P	53.4	Low	33	Very low	126 Å²	126	150.8 Å²	150.8	82%	0.818	76%	0.759	S	S	*	*			trans	-127.1	176.6	162.9	34.8	-18.9	0	0	0	113.9
146	H	30.7	Very low	33.1	Very low	199 Å²	199	144.5 Å²	144.5	92%	0.921	75%	0.753	S	S	*	*			trans	-109.1	169.9	-169.7	-80.3	-107.7	0	0	0	115
147	G	28.9	Very low	33.2	Very low	59 Å²	59	143.9 Å²	143.9	61%	0.608	76%	0.759	S	S	*	*			trans	148.4	118.1	166.7	0	0	0	0	0	109.5
148	E	33.9	Very low	33.1	Very low	188 Å²	188	147.6 Å²	147.6	88%	0.879	77%	0.766	S	S	*	*				70	129	57.3	-60.4	172.8	177.2	0	0	111
149	D	31.4	Very low	32.9	Very low	135 Å²	135	145.3 Å²	145.3	72%	0.722	77%	0.765	S	S	*	*			cis	-161.8	168	14.1	-156	8.2	0	0	0	114.6
150	N	29.6	Very low	32.9	Very low	104 Å²	104	139.5 Å²	139.5	56%	0.556	76%	0.757	S	S	*	*			trans	41.1	137	153	-84.1	-52.3	0	0	0	126.9
151	Q	30.4	Very low	33.1	Very low	167 Å²	167	136.9 Å²	136.9	78%	0.78	76%	0.755	S	S	*	*			trans	61	154.2	134.3	-66.1	166.2	34.1	0	0	121.5
152	S	32.5	Very low	33.9	Very low	82 Å²	82	136.4 Å²	136.4	57%	0.573	75%	0.754	S	S	*	*			cis	-165.6	178.4	-14.2	44.8	0	0	0	0	111.4
153	E	31.8	Very low	33.7	Very low	158 Å²	158	135.4 Å²	135.4	74%	0.738	75%	0.753	S	S	*	*			trans	87.3	131.9	157.6	-73.7	138.6	-124.1	0	0	123.3
154	E	31.4	Very low	33.5	Very low	174 Å²	174	136 Å²	136	81%	0.813	76%	0.76	S	S	*	*			trans	43.9	154.4	136.2	-63.5	177.2	168.9	0	0	122.3
155	E	32.7	Very low	33.3	Very low	184 Å²	184	133.9 Å²	133.9	86%	0.86	76%	0.757	S	S	*	*			cis	-143.7	-154.9	3.5	-143.4	-178.6	-174.8	0	0	111.8
156	A	31.6	Very low	32.3	Very low	85 Å²	85	133.5 Å²	133.5	70%	0.702	76%	0.757	S	S	*	*			trans	-118.2	-165	-169.4	0	0	0	0	0	115
157	E	33	Very low	32.4	Very low	184 Å²	184	129.6 Å²	129.6	86%	0.86	75%	0.753	S	S	*	*			trans	68.4	158.8	174	-60	-163.2	128.5	0	0	116.9
158	Y	28.6	Very low	32.7	Very low	190 Å²	190	132.1 Å²	132.1	75%	0.745	76%	0.761	S	S	*	*			cis	-143.9	147.9	5.6	-174.5	-102.1	0	0	0	113.9
159	S	28.4	Very low	33.5	Very low	88 Å²	88	129.6 Å²	129.6	62%	0.615	76%	0.761	S	S	*	*			trans	-21.3	161.8	168.6	-156.2	0	0	0	0	124.5
160	S	32.3	Very low	33.4	Very low	90 Å²	90	127.9 Å²	127.9	63%	0.629	77%	0.766	S	S	*	*			trans	82.7	102.9	139.8	45.3	0	0	0	0	123.3
161	E	35.8	Very low	33.7	Very low	181 Å²	181	127.6 Å²	127.6	85%	0.846	78%	0.778	S	S	*	*				7.5	158.1	106.5	-77.1	-158.4	153.5	0	0	119.9
162	P	49	Very low	33.6	Very low	117 Å²	117	125.3 Å²	125.3	76%	0.76	78%	0.78	S	S	*	*			cis	-158.4	-172.3	47.4	45	-22.6	0	0	0	120.5
163	A	30.9	Very low	33.6	Very low	89 Å²	89	130.7 Å²	130.7	74%	0.736	80%	0.796	S	S	*	*			trans	91.8	104.5	141.5	0	0	0	0	0	122.3
164	S	35.3	Very low	33.6	Very low	134 Å²	134	126 Å²	126	94%	0.937	79%	0.79	S	S	*	*			trans	3.2	140.6	140.7	-48.1	0	0	0	0	122.5
165	G	27.5	Very low	33.5	Very low	78 Å²	78	125.1 Å²	125.1	80%	0.804	79%	0.791	S	S	*	*			trans	-149.8	153.4	159.2	0	0	0	0	0	110.8
166	S	32.7	Very low	33.5	Very low	117 Å²	117	123.1 Å²	123.1	82%	0.818	79%	0.786	S	S	*	*			trans	-142.2	178.4	-167.6	69.3	0	0	0	0	114.7
167	S	32.7	Very low	33.6	Very low	118 Å²	118	126.9 Å²	126.9	83%	0.825	79%	0.789	S	S	*	*			trans	91.8	147.8	163	78.8	0	0	0	0	119.6
168	S	36.2	Very low	33.6	Very low	112 Å²	112	126.7 Å²	126.7	78%	0.783	79%	0.788	S	S	*	*			trans	-123.3	167.7	179.1	-44	0	0	0	0	110
169	P	49.8	Very low	33.7	Very low	134 Å²	134	126.2 Å²	126.2	87%	0.87	79%	0.792	S	S	*	*			trans	-138.4	167.9	144.8	35.4	-20.5	0	0	0	115
170	A	30.1	Very low	33.8	Very low	100 Å²	100	130.8 Å²	130.8	83%	0.826	80%	0.804	S	S	*	*			trans	-102.6	-166.4	179.7	0	0	0	0	0	111.2
171	A	35.5	Very low	33.7	Very low	98 Å²	98	134.4 Å²	134.4	81%	0.81	81%	0.811	S	S	*	*			cis	-163.6	168.8	5.8	0	0	0	0	0	111
172	S	28.4	Very low	33.3	Very low	119 Å²	119	133.2 Å²	133.2	83%	0.832	81%	0.806	S	S	*	*			trans	-160.3	144.6	146.1	59.5	0	0	0	0	112.6
173	H	31.7	Very low	32.5	Very low	195 Å²	195	135.9 Å²	135.9	90%	0.903	81%	0.808	S	S	*	*			trans	-56.4	165.6	-179.1	-71.6	-14.7	0	0	0	116.3
174	G	31.8	Very low	32.2	Very low	59 Å²	59	138.3 Å²	138.3	61%	0.608	81%	0.808	S	S	*	*			cis	168.6	-165.4	-0.7	0	0	0	0	0	113.4
175	D	30.4	Very low	32	Very low	156 Å²	156	138 Å²	138	83%	0.834	80%	0.796	S	S	*	*			trans	68.3	143	172.3	-44.4	-8.4	0	0	0	116.7
176	D	32.4	Very low	32.1	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	79%	0.788	S	S	*	*			cis	-166.4	179.7	-35.8	-130.8	-37.9	0	0	0	110.2
177	E	33.4	Very low	31.9	Very low	164 Å²	164	142.9 Å²	142.9	77%	0.766	79%	0.785	S	S	*	*			trans	70	118.3	169.8	-64.4	164.8	-159.3	0	0	116.5
178	E	32	Very low	31.9	Very low	180 Å²	180	145.1 Å²	145.1	84%	0.841	78%	0.783	S	S	*	*				74	134.2	72.5	-68.3	178	-171.7	0	0	113
179	E	32.4	Very low	31.5	Very low	179 Å²	179	148.6 Å²	148.6	84%	0.836	79%	0.786	S	S	*	*			cis	-133.2	154.1	9.4	-58	168.9	128.8	0	0	108.9
180	E	29	Very low	30.5	Very low	184 Å²	184	145.4 Å²	145.4	86%	0.86	78%	0.778	S	S	*	*				44.7	141.3	81.4	-49.9	-164.9	157.8	0	0	114.8
181	E	30	Very low	30.5	Very low	167 Å²	167	149.3 Å²	149.3	78%	0.78	78%	0.779	S	S	*	*			cis	-154.8	164.2	32.2	-92.9	-169.4	151.1	0	0	113.3
182	E	29	Very low	30.1	Very low	156 Å²	156	153.8 Å²	153.8	73%	0.729	78%	0.783	S	S	*	*			trans	39.9	141	152.8	-47.4	-59.8	78.1	0	0	121.7
183	E	30.3	Very low	30.1	Very low	172 Å²	172	151.5 Å²	151.5	80%	0.804	78%	0.778	S	S	*	*				56.6	137.8	56.4	-59	-161.9	177.4	0	0	113.1
184	D	26.5	Very low	30.1	Very low	140 Å²	140	150.6 Å²	150.6	75%	0.749	78%	0.777	S	S	*	*			cis	-156.9	-168.7	48.4	-167.3	5.6	0	0	0	112.8
185	N	30.6	Very low	29.9	Very low	127 Å²	127	156.3 Å²	156.3	68%	0.679	79%	0.788	S	S	*	*			trans	-110.1	-167.1	-166.6	-174.2	30.9	0	0	0	113.8
186	Q	28.7	Very low	30	Very low	134 Å²	134	157.5 Å²	157.5	63%	0.626	79%	0.788	S	S	*	*			trans	94	123.3	175.4	-64.3	145.2	106.8	0	0	114.4
187	E	28.8	Very low	29.8	Very low	165 Å²	165	158.9 Å²	158.9	77%	0.771	79%	0.79	S	S	*	*				74	144	69.3	-63.7	167.8	-178.3	0	0	111.7
188	E	33	Very low	29.7	Very low	164 Å²	164	159 Å²	159	77%	0.766	79%	0.791	S	S	*	*			cis	-141.2	175.6	24	-72.6	179.9	132.8	0	0	113.7
189	E	28.3	Very low	29.5	Very low	185 Å²	185	158.5 Å²	158.5	86%	0.864	79%	0.789	S	S	*	*			trans	23.7	158.8	137.4	-59	-172	177.3	0	0	123
190	G	27.7	Very low	29.7	Very low	67 Å²	67	159 Å²	159	69%	0.691	79%	0.791	S	S	*	*			cis	173.2	-160.1	6.4	0	0	0	0	0	112.5
191	E	29.6	Very low	29.8	Very low	182 Å²	182	159.4 Å²	159.4	85%	0.85	79%	0.793	S	S	*	*			trans	62.8	118.1	-174.1	-63.6	-172.6	153	0	0	115.1
192	E	27.9	Very low	29.8	Very low	192 Å²	192	154.5 Å²	154.5	90%	0.897	79%	0.787	S	S	*	*				66.9	135.8	60.9	-63.8	-178	-147.4	0	0	113.8
193	G	28.5	Very low	29.9	Very low	71 Å²	71	154.9 Å²	154.9	73%	0.732	79%	0.789	S	S	*	*			cis	162.8	151.9	-5.2	0	0	0	0	0	110.3
194	M	30.8	Very low	29.9	Very low	176 Å²	176	154 Å²	154	87%	0.867	78%	0.783	S	S	*	*			trans	-167.1	119.3	150.8	-141.9	166.9	180	0	0	111.6
195	E	29.3	Very low	30.5	Very low	179 Å²	179	156.1 Å²	156.1	84%	0.836	79%	0.788	S	S	*	*			trans	-101.5	149.1	168.3	-63.7	165.5	142	0	0	108.5
196	E	30.7	Very low	30.5	Very low	182 Å²	182	157.3 Å²	157.3	85%	0.85	79%	0.794	S	S	*	*			trans	-135	109.9	156.7	-74.7	-168.8	159.2	0	0	107.6
197	E	29.9	Very low	30.9	Very low	171 Å²	171	159.9 Å²	159.9	80%	0.799	81%	0.806	S	S	*	*			trans	-67.6	153.5	165.4	-58.7	166.3	119.6	0	0	108.3
198	E	29.8	Very low	31	Very low	166 Å²	166	159.9 Å²	159.9	78%	0.776	81%	0.811	S	S	*	*				169.7	168.5	81.3	-81.8	-176.8	148.6	0	0	104.6
199	E	29.4	Very low	31	Very low	170 Å²	170	161.2 Å²	161.2	79%	0.794	82%	0.818	S	S	*	*			cis	-153.4	163	6.6	-138	172.8	179.6	0	0	107.8
200	E	36	Very low	31.3	Very low	188 Å²	188	161.4 Å²	161.4	88%	0.879	82%	0.819	S	S	*	*			trans	-116.5	124.2	173.8	-179.5	177.1	-138.6	0	0	110.5
201	E	30.3	Very low	31.6	Very low	193 Å²	193	167.5 Å²	167.5	90%	0.902	83%	0.829	S	S	*	*			trans	-127.2	139.3	160.5	-76.3	-158.5	145.1	0	0	109.8
202	G	31.1	Very low	31.7	Very low	65 Å²	65	166.1 Å²	166.1	67%	0.67	83%	0.827	S	S	*	*			trans	-116.1	-146.2	-176.7	0	0	0	0	0	113.3
203	E	31.2	Very low	32	Very low	164 Å²	164	165.5 Å²	165.5	77%	0.766	83%	0.825	S	S	*	*			trans	67.9	148.2	-174.4	-52.8	-162.2	136.2	0	0	114.4
204	K	30	Very low	32.4	Very low	154 Å²	154	173 Å²	173	67%	0.67	83%	0.832	S	S	*	*			cis	-146.7	169.1	-0.4	-130.5	153.9	-163.5	146.7	0	111.1
205	E	38.3	Very low	32.6	Very low	183 Å²	183	172.5 Å²	172.5	86%	0.855	83%	0.834	S	S	*	*			trans	-87.2	144.7	164.2	-62	174.3	128.8	0	0	109.1
206	D	32.1	Very low	32.9	Very low	152 Å²	152	170.3 Å²	170.3	81%	0.813	82%	0.823	S	S	*	*			trans	-127.6	119.6	167.9	-72.4	-54.2	0	0	0	108.7
207	E	35.9	Very low	33.1	Very low	188 Å²	188	170.6 Å²	170.6	88%	0.879	82%	0.817	S	S	*	*			trans	-102.9	116.9	169.2	-66.1	-175.1	126.7	0	0	108.7
208	D	32.1	Very low	33.3	Very low	165 Å²	165	172.1 Å²	172.1	88%	0.882	82%	0.823	S	S	*	*			trans	-97.9	80.9	173.3	-74.8	-39.1	0	0	0	110.6
209	E	33	Very low	33.4	Very low	193 Å²	193	167.3 Å²	167.3	90%	0.902	82%	0.818	S	S	*	*			trans	-95.4	114.1	152.8	-71	-165.2	154.1	0	0	108.7
210	E	34.8	Very low	33.6	Very low	189 Å²	189	167 Å²	167	88%	0.883	82%	0.822	S	S	*	*			trans	-123	128.9	159.9	-77.8	-160.5	147.1	0	0	110.6
211	E	33.3	Very low	33.6	Very low	195 Å²	195	161.6 Å²	161.6	91%	0.911	82%	0.816	S	S	*	*			trans	-118.8	112.3	-179.3	-179.3	179	-131	0	0	108.5
212	D	32.4	Very low	33.8	Very low	152 Å²	152	159.1 Å²	159.1	81%	0.813	81%	0.809	S	S	*	*			trans	-145	145.7	176.5	-100.2	-13.9	0	0	0	107.8
213	E	33.2	Very low	34.1	Very low	180 Å²	180	162.9 Å²	162.9	84%	0.841	81%	0.814	S	S	*	*			cis	-153.7	155.2	-36.8	177.5	173.2	-147	0	0	104.2
214	Y	36.8	Very low	34.2	Very low	227 Å²	227	164.4 Å²	164.4	89%	0.89	81%	0.814	S	S	*	*			trans	-91.8	134.1	175.4	-74.6	-109.5	0	0	0	111.5
215	D	35.7	Very low	34.6	Very low	167 Å²	167	163.4 Å²	163.4	89%	0.893	82%	0.816	S	S	*	*			trans	-147.8	172.7	142.6	-146.1	-13.9	0	0	0	112.7
216	E	34.9	Very low	34.4	Very low	133 Å²	133	160.4 Å²	160.4	62%	0.621	81%	0.811	S	S	*	*			trans	-120.3	172.7	-146.3	-164.2	-168.1	88.1	0	0	112.9
217	R	34.1	Very low	34.6	Very low	188 Å²	188	164.1 Å²	164.1	71%	0.709	81%	0.813	S	S	*	*			trans	95.3	125.5	152.8	-59.4	-168.8	173	-103	-25.1	121.2
218	H	35.4	Very low	35.4	Very low	202 Å²	202	160 Å²	160	94%	0.935	81%	0.805	S	S	*	*			trans	53.8	135.7	139.5	-70.1	-112.2	0	0	0	120.2
219	G	31.8	Very low	36.1	Very low	65 Å²	65	160.7 Å²	160.7	67%	0.67	80%	0.803	S	S	*	*			cis	158.6	176	-3.8	0	0	0	0	0	113.6
220	D	34.3	Very low	36.3	Very low	165 Å²	165	156.2 Å²	156.2	88%	0.882	80%	0.799	S	S	*	*			trans	68.4	154.2	172	-154.8	12.4	0	0	0	118.2
221	G	34.2	Very low	36.4	Very low	73 Å²	73	151 Å²	151	75%	0.753	80%	0.796	S	S	*	*			trans	144.2	44.6	-178.3	0	0	0	0	0	116.7
222	N	35.9	Very low	36.4	Very low	142 Å²	142	148.5 Å²	148.5	76%	0.759	79%	0.789	S	S	*	*			trans	-71.6	151.1	171.6	-82.2	-15.7	0	0	0	112.9
223	D	36	Very low	36.7	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	78%	0.78	S	S	*	*				-170.7	152.6	118	-105.1	-5.8	0	0	0	115.7
224	Y	34.1	Very low	36.9	Very low	196 Å²	196	148 Å²	148	77%	0.769	78%	0.781	S	S	*	*			trans	-26.2	131.2	177.4	-62.4	-85	0	0	0	118.7
225	D	37.5	Very low	36.8	Very low	133 Å²	133	142.4 Å²	142.4	71%	0.711	78%	0.775	S	S	*	*				76.6	119.1	64.9	179.5	30.9	0	0	0	115.3
226	T	35.8	Very low	36.7	Very low	120 Å²	120	138.6 Å²	138.6	74%	0.736	77%	0.767	S	S	*	*			trans	-164.3	120.6	139.4	-74.7	0	0	0	0	111.4
227	R	35	Very low	36.5	Very low	230 Å²	230	137.8 Å²	137.8	87%	0.868	78%	0.777	S	S	*	*			trans	81	119.7	156.8	-85.4	179.3	160.6	126.8	-1.4	122.3
228	S	52.5	Low	36.3	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	78%	0.778	S	S	*	*			trans	-49.2	-176.8	151.6	-31.5	0	0	0	0	115
229	E	48.2	Very low	36.2	Very low	181 Å²	181	130.5 Å²	130.5	85%	0.846	77%	0.771	S	S	*	*			cis	-167.2	161.8	22.4	28	-159.8	70.3	0	0	111.2
230	A	36.7	Very low	36.4	Very low	99 Å²	99	132 Å²	132	82%	0.818	77%	0.772	S	S	*	*			cis	-173	160.2	-23.9	0	0	0	0	0	110.4
231	G	36.5	Very low	36.1	Very low	79 Å²	79	133.9 Å²	133.9	81%	0.814	77%	0.772	S	S	*	*			trans	96	148.3	157.7	0	0	0	0	0	117.7
232	D	33.5	Very low	36.1	Very low	142 Å²	142	134.8 Å²	134.8	76%	0.759	77%	0.767	S	S	*	*			cis	-149.5	162.4	-12.9	-171.9	26.5	0	0	0	111.1
233	S	37.8	Very low	35.9	Very low	90 Å²	90	136.1 Å²	136.1	63%	0.629	77%	0.774	S	S	*	*			trans	-34	162.2	168.2	-42.3	0	0	0	0	115.7
234	R	37.7	Very low	35.6	Very low	231 Å²	231	132.6 Å²	132.6	87%	0.872	77%	0.772	S	S	*	*			cis	-154.2	156.3	46.2	-71.2	-178.3	171.7	-154.1	-8.6	116
235	S	36.1	Very low	35.6	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	78%	0.777	S	S	*	*			trans	-31.8	144	164.4	-44.3	0	0	0	0	115.8
236	A	33	Very low	35.3	Very low	87 Å²	87	131.2 Å²	131.2	72%	0.719	78%	0.781	S	S	*	*			cis	80.1	161.6	39	0	0	0	0	0	115.1
237	S	29.6	Very low	35.1	Very low	117 Å²	117	128.8 Å²	128.8	82%	0.818	78%	0.78	S	S	*	*			trans	69.8	153.3	-164.9	79.3	0	0	0	0	114.4
238	S	31.7	Very low	35.1	Very low	105 Å²	105	129.9 Å²	129.9	73%	0.734	78%	0.784	S	S	*	*			cis	178.4	173.7	-20.2	57.7	0	0	0	0	106.4
239	V	32.6	Very low	34.4	Very low	131 Å²	131	131.2 Å²	131.2	79%	0.794	79%	0.793	S	S	*	*			cis	-138.8	171.3	3.1	-81.6	0	0	0	0	108.3
240	S	36.6	Very low	33.6	Very low	98 Å²	98	126.4 Å²	126.4	69%	0.685	79%	0.792	S	S	*	*			trans	-82.5	154.5	158.3	-173.3	0	0	0	0	110.8
241	F	27.2	Very low	33.6	Very low	204 Å²	204	127.9 Å²	127.9	90%	0.895	80%	0.797	S	S	*	*			trans	-166.5	174.9	131.9	-106.7	-64.8	0	0	0	111.1
242	S	33.5	Very low	33.3	Very low	92 Å²	92	128.7 Å²	128.7	64%	0.643	80%	0.796	S	S	*	*			trans	-129	161.9	-150.1	53.1	0	0	0	0	115.1
243	D	32.7	Very low	33.6	Very low	169 Å²	169	127.1 Å²	127.1	90%	0.904	80%	0.796	S	S	*	*			trans	68.4	163.8	156.9	-115	-53.1	0	0	0	119.1
244	G	30	Very low	33.3	Very low	71 Å²	71	131.3 Å²	131.3	73%	0.732	81%	0.806	S	S	*	*			trans	144.9	75.8	177.7	0	0	0	0	0	115.8
245	E	32.8	Very low	33.4	Very low	185 Å²	185	124.6 Å²	124.6	86%	0.864	80%	0.799	S	S	*	*			trans	-47.3	137.9	168.3	-179.9	-169.9	126.5	0	0	114.8
246	S	32.3	Very low	33.4	Very low	115 Å²	115	124.7 Å²	124.7	80%	0.804	80%	0.8	S	S	*	*				171.6	148.1	128.2	46.7	0	0	0	0	111.8
247	G	31.9	Very low	33.8	Very low	69 Å²	69	124.5 Å²	124.5	71%	0.711	81%	0.807	S	S	*	*			trans	-119.6	164.8	-179	0	0	0	0	0	113.6
248	R	35.2	Very low	34.1	Very low	253 Å²	253	122.9 Å²	122.9	96%	0.955	80%	0.795	S	S	*	*			trans	-161.1	152.7	152.4	-107.7	152.6	-162.7	-93.2	-1	111.3
249	S	37.6	Very low	34.5	Very low	128 Å²	128	127 Å²	127	90%	0.895	80%	0.803	S	S	*	*			trans	-75.1	146.7	178	43.9	0	0	0	0	112
250	G	30.9	Very low	34.8	Very low	80 Å²	80	129.5 Å²	129.5	83%	0.825	80%	0.803	S	S	*	*			trans	-153.1	110.3	173.9	0	0	0	0	0	110.2
251	S	37	Very low	35	Very low	130 Å²	130	134 Å²	134	91%	0.909	81%	0.81	S	S	*	*			trans	-94.3	127.2	178.4	-177.4	0	0	0	0	110.6
252	A	29.5	Very low	35.7	Very low	96 Å²	96	134.8 Å²	134.8	79%	0.793	81%	0.807	S	S	*	*			trans	-168.5	140	149.2	0	0	0	0	0	110.4
253	S	40.5	Very low	36.3	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	81%	0.811	S	S	*	*			trans	-80.7	142	161	52	0	0	0	0	110.6
254	E	32	Very low	37.2	Very low	178 Å²	178	139 Å²	139	83%	0.832	81%	0.808	S	S	*	*			trans	-153.8	155.4	139.6	-108	-44.1	134.2	0	0	111
255	A	39.4	Very low	38.1	Very low	89 Å²	89	138.8 Å²	138.8	74%	0.736	79%	0.79	S	S	*	*			trans	-91.5	127.9	-173.8	0	0	0	0	0	112.1
256	S	34.8	Very low	39.3	Very low	113 Å²	113	133.1 Å²	133.1	79%	0.79	77%	0.771	S	S	*	*			trans	-132.7	97.4	169.4	-162.7	0	0	0	0	111.9	S258	S256-S258 PolarHBondContact O-N 2.78Å
257	G	42.1	Very low	40.4	Very low	83 Å²	83	132.4 Å²	132.4	86%	0.856	77%	0.766	S	S	*	*			trans	-72.1	89.9	175.4	0	0	0	0	0	111.6	E259	G257-E259 PolarHBondContact O-N 2.8Å
258	S	35.5	Very low	41.6	Very low	82 Å²	82	132.6 Å²	132.6	57%	0.573	76%	0.756	S	S	*	*			trans	-86.5	97.2	170.4	59.2	0	0	0	0	111.1	S256 K260	S256-S258 PolarHBondContact O-N 2.78Å; S258-K260 PolarHBondContact O-N 2.85Å
259	E	40.9	Very low	42.5	Very low	192 Å²	192	123.4 Å²	123.4	90%	0.897	73%	0.728	S	S	*	*			trans	-63.6	81.8	165	-77.4	-158.2	100.2	0	0	110.1	G257 K261	G257-E259 PolarHBondContact O-N 2.8Å; E259-K261 PolarHBondContact O-N 3.44Å
260	K	38.7	Very low	43.3	Very low	183 Å²	183	123.4 Å²	123.4	80%	0.796	71%	0.708	S	S	*	*			trans	-72	77.5	172.2	-73.4	-173.4	178.6	178.6	0	109.7	S258 R262	S258-K260 PolarHBondContact O-N 2.85Å; K260-R262 VanDerWaalsContact C-N 3.34Å; K260-R262 PolarHBondContact O-N 2.86Å
261	K	40.4	Very low	44.3	Very low	194 Å²	194	122.5 Å²	122.5	84%	0.843	69%	0.693	S	S	*	*			trans	-22.8	85.9	167.4	-175.4	-179	180	-177.8	0	111.4	E259 E263	E259-K261 PolarHBondContact O-N 3.44Å; K261-E263 PolarHBondContact O-N 2.96Å
262	R	42.8	Very low	45	Very low	220 Å²	220	121.4 Å²	121.4	83%	0.83	68%	0.681	S	S	*	*			trans	-67.6	98.7	-172.9	-176	-175.6	-178.2	-157.8	5.6	109	K260 K264	K260-R262 VanDerWaalsContact C-N 3.34Å; K260-R262 PolarHBondContact O-N 2.86Å; R262-K264 PolarHBondContact O-N 2.97Å
263	E	45.9	Very low	45.8	Very low	155 Å²	155	125.3 Å²	125.3	72%	0.724	68%	0.675	S	S	*	*			trans	-51.7	128.7	-179.1	-65.6	-154.1	130.1	0	0	110.5	K261 L265	K261-E263 PolarHBondContact O-N 2.96Å; E263-L265 PolarHBondContact O-N 3.29Å
264	K	51.1	Low	46.1	Very low	193 Å²	193	126.4 Å²	126.4	84%	0.839	67%	0.666	S	S	*	*			trans	-77.8	66	-178.6	-71.5	177.2	179.4	170.8	0	109.3	R262 S266	R262-K264 PolarHBondContact O-N 2.97Å; K264-S266 PolarHBondContact O-N 3.04Å
265	L	49.9	Very low	46.5	Very low	68 Å²	68	121.3 Å²	121.3	36%	0.356	66%	0.661	S	S	.	*			trans	-40.9	133.8	169.6	-68.4	178.9	0	0	0	109.4	E263 V269 R270	E263-L265 PolarHBondContact O-N 3.29Å; L265-V269 HydrophobicContact CB-CG1 4.35Å; L265-V269 HydrophobicContact CD1-CG1 4.39Å; L265-R270 VanDerWaalsContact O-CZ 3.25Å; L265-R270 PolarHBondContact O-NE 3.03Å; L265-R270 PolarHBondContact O-NH2 3.23Å
266	S	57.3	Low	46.7	Very low	65 Å²	65	124.1 Å²	124.1	46%	0.455	66%	0.661	S	S	.	*			trans	-49.1	147.6	-174.5	172.1	0	0	0	0	112	K264 S268 V269 R270	K264-S266 PolarHBondContact O-N 3.04Å; S266-S268 PolarHBondContact O-N 2.93Å; S266-S268 PolarHBondContact OG-N 2.9Å; S266-V269 PolarHBondContact O-N 3.01Å; S266-R270 PolarHBondContact O-N 2.9Å
267	S	56.1	Low	47.6	Very low	101 Å²	101	122.9 Å²	122.9	71%	0.706	64%	0.642	S	S	*	*	H	α-helix	trans	-53.2	-33.4	172	47.9	0	0	0	0	111.8	R270 A271	S267-R270 PolarHBondContact O-N 3Å; S267-A271 WeakPolarHBondContact O-CB 3.49Å; S267-A271 PolarHBondContact O-N 3.47Å
268	S	56.3	Low	48.4	Very low	73 Å²	73	122.6 Å²	122.6	51%	0.51	62%	0.621	S	S	.	*	H	α-helix	trans	-65.8	-48.4	173.1	-172.8	0	0	0	0	112.3	S266 R270 A271 V272	S266-S268 PolarHBondContact O-N 2.93Å; S266-S268 PolarHBondContact OG-N 2.9Å; S268-R270 VanDerWaalsContact C-N 3.26Å; S268-R270 PolarHBondContact O-N 3.17Å; S268-A271 CarbonylContact O-C 3.58Å; S268-A271 WeakPolarHBondContact O-CA 3.47Å; S268-A271 WeakPolarHBondContact O-CB 3.4Å; S268-A271 PolarHBondContact O-N 2.88Å; S268-V272 WeakPolarHBondContact O-CG2 3.44Å; S268-V272 PolarHBondContact O-N 3.19Å
269	V	54.6	Low	49.8	Very low	59 Å²	59	121.5 Å²	121.5	36%	0.358	61%	0.612	S	S	.	*	H	α-helix	trans	-62	-34.7	176.4	176.9	0	0	0	0	111.5	L265 S266 R273	L265-V269 HydrophobicContact CB-CG1 4.35Å; L265-V269 HydrophobicContact CD1-CG1 4.39Å; S266-V269 PolarHBondContact O-N 3.01Å; V269-R273 WeakPolarHBondContact O-CG 3.17Å; V269-R273 PolarHBondContact O-N 3.38Å
270	R	53.6	Low	51.5	Low	129 Å²	129	114.8 Å²	114.8	49%	0.487	58%	0.584	S	S	.	*	H	α-helix	trans	-69	-37.8	171.2	-65.1	-176.9	-139	-174.8	6.5	112.3	L265 S266 S267 S268 K274	L265-R270 VanDerWaalsContact O-CZ 3.25Å; L265-R270 PolarHBondContact O-NE 3.03Å; L265-R270 PolarHBondContact O-NH2 3.23Å; S266-R270 PolarHBondContact O-N 2.9Å; S267-R270 PolarHBondContact O-N 3Å; S268-R270 VanDerWaalsContact C-N 3.26Å; S268-R270 PolarHBondContact O-N 3.17Å; R270-K274 WeakPolarHBondContact O-CB 3.45Å; R270-K274 PolarHBondContact O-N 3.21Å
271	A	52.5	Low	53.8	Low	60 Å²	60	109 Å²	109	50%	0.496	57%	0.567	S	S	.	*	H	α-helix	trans	-65.4	-42.1	175.5	0	0	0	0	0	111.8	S267 S268 K274 G275	S267-A271 WeakPolarHBondContact O-CB 3.49Å; S267-A271 PolarHBondContact O-N 3.47Å; S268-A271 CarbonylContact O-C 3.58Å; S268-A271 WeakPolarHBondContact O-CA 3.47Å; S268-A271 WeakPolarHBondContact O-CB 3.4Å; S268-A271 PolarHBondContact O-N 2.88Å; A271-K274 CarbonylContact O-C 3.53Å; A271-K274 WeakPolarHBondContact O-CA 3.41Å; A271-K274 WeakPolarHBondContact O-CB 3.42Å; A271-K274 PolarHBondContact O-N 2.95Å; A271-K274 VanDerWaalsContact O-N 3.1Å; A271-G275 PolarHBondContact O-N 3.43Å
272	V	50.8	Low	56.1	Low	108 Å²	108	101 Å²	101	66%	0.655	53%	0.533	S	S	*	.	H	α-helix	trans	-61.7	-49	173.9	174.8	0	0	0	0	110.9	S268 K274 G275	S268-V272 WeakPolarHBondContact O-CG2 3.44Å; S268-V272 PolarHBondContact O-N 3.19Å; V272-K274 PolarHBondContact O-N 3.35Å; V272-G275 PolarHBondContact O-N 3.38Å
273	R	46.7	Very low	58.3	Low	178 Å²	178	91.9 Å²	91.9	67%	0.672	50%	0.5	S	S	*	.	H	α-helix	trans	-64.2	-21.1	173.9	-69.2	-174.4	-174.8	-167.8	2.4	113.5	V269	V269-R273 WeakPolarHBondContact O-CG 3.17Å; V269-R273 PolarHBondContact O-N 3.38Å
274	K	47.5	Very low	60.5	Low	132 Å²	132	93.2 Å²	93.2	57%	0.574	50%	0.498	S	S	*	.	H	α-helix	trans	-83.3	-14.5	173.5	-163	-176.7	179	-169.6	0	113.2	R270 A271 V272 M276 E277	R270-K274 WeakPolarHBondContact O-CB 3.45Å; R270-K274 PolarHBondContact O-N 3.21Å; A271-K274 CarbonylContact O-C 3.53Å; A271-K274 WeakPolarHBondContact O-CA 3.41Å; A271-K274 WeakPolarHBondContact O-CB 3.42Å; A271-K274 PolarHBondContact O-N 2.95Å; A271-K274 VanDerWaalsContact O-N 3.1Å; V272-K274 PolarHBondContact O-N 3.35Å; K274-M276 PolarHBondContact O-N 3.01Å; K274-E277 WeakPolarHBondContact CE-OE1 3.37Å; K274-E277 HydrophobicContact CG-CG 3.85Å; K274-E277 WeakPolarHBondContact CG-OE1 3.38Å; K274-E277 WeakPolarHBondContact O-CG 3.44Å; K274-E277 PolarHBondContact O-N 3.32Å
275	G	39.4	Very low	62.4	Low	71 Å²	71	87.6 Å²	87.6	73%	0.732	47%	0.472	S	S	*	.	H	α-helix	trans	-61.5	-31.7	165.6	0	0	0	0	0	112	A271 V272 E277	A271-G275 PolarHBondContact O-N 3.43Å; V272-G275 PolarHBondContact O-N 3.38Å; G275-E277 VanDerWaalsContact C-N 3.34Å; G275-E277 PolarHBondContact O-N 2.89Å
276	M	43.8	Very low	64.5	Low	148 Å²	148	84.4 Å²	84.4	73%	0.729	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	40	175.9	-154.5	72.3	81.8	0	0	112.7	K274 N278	K274-M276 PolarHBondContact O-N 3.01Å; M276-N278 PolarHBondContact O-N 3.1Å; M276-N278 PolarHBondContact O-OD1 3.24Å
277	E	53.2	Low	66.2	Low	86 Å²	86	82 Å²	82	40%	0.402	44%	0.438	S	S	.	.			trans	-74.2	81	166.3	-78	-178.3	172.4	0	0	109.5	K274 G275 K282	K274-E277 WeakPolarHBondContact CE-OE1 3.37Å; K274-E277 HydrophobicContact CG-CG 3.85Å; K274-E277 WeakPolarHBondContact CG-OE1 3.38Å; K274-E277 WeakPolarHBondContact O-CG 3.44Å; K274-E277 PolarHBondContact O-N 3.32Å; G275-E277 VanDerWaalsContact C-N 3.34Å; G275-E277 PolarHBondContact O-N 2.89Å; E277-K282 WeakPolarHBondContact O-CE 3.49Å; E277-K282 WeakPolarHBondContact OE2-CE 3.46Å; E277-K282 IonicContact OE2-NZ 2.69Å; E277-K282 PolarHBondContact OE2-NZ 2.83Å
278	N	60.2	Low	68	Low	78 Å²	78	84.3 Å²	84.3	42%	0.417	43%	0.431	S	S	.	.			trans	-34.1	129.5	-175.2	-66.9	-1.6	0	0	0	113.2	M276 T280 S281	M276-N278 PolarHBondContact O-N 3.1Å; M276-N278 PolarHBondContact O-OD1 3.24Å; N278-T280 PolarHBondContact O-N 3.16Å; N278-T280 VanDerWaalsContact O-N 3.16Å; N278-S281 WeakPolarHBondContact O-CB 2.92Å; N278-S281 PolarHBondContact O-N 3.04Å
279	P	63.4	Low	69.6	Low	58 Å²	58	86.7 Å²	86.7	38%	0.377	43%	0.434	S	S	.	.	H	α-helix	trans	-58.9	-34	-178.1	23.1	-33	0	0	0	111.8	S281 K282 L283 L429	P279-S281 VanDerWaalsContact C-N 3.29Å; P279-S281 PolarHBondContact O-N 3.24Å; P279-K282 PolarHBondContact O-N 3.08Å; P279-K282 VanDerWaalsContact O-N 3.12Å; P279-L283 WeakPolarHBondContact O-CB 3.19Å; P279-L283 PolarHBondContact O-N 3.43Å; P279-L429 HydrophobicContact CG-CD1 4.29Å; P279-L429 HydrophobicContact CG-CD2 4.17Å
280	T	78.3	Confident	71.6	Confident	51 Å²	51	84 Å²	84	31%	0.313	42%	0.418	S	S	.	.	H	α-helix	trans	-56.8	-35.9	172.7	55.9	0	0	0	0	113.4	N278 R284 L429	N278-T280 PolarHBondContact O-N 3.16Å; N278-T280 VanDerWaalsContact O-N 3.16Å; T280-R284 VanDerWaalsContact O-CB 3.3Å; T280-R284 WeakPolarHBondContact O-CB 3.02Å; T280-R284 WeakPolarHBondContact O-CG 3.41Å; T280-R284 PolarHBondContact O-N 3.25Å; T280-L429 HydrophobicContact CG2-CD2 3.94Å
281	S	86.3	Confident	73.7	Confident	63 Å²	63	81.6 Å²	81.6	44%	0.441	41%	0.409	S	S	.	.	H	α-helix	trans	-70	-34.1	176.9	-64	0	0	0	0	112.5	N278 P279 Y285	N278-S281 WeakPolarHBondContact O-CB 2.92Å; N278-S281 PolarHBondContact O-N 3.04Å; P279-S281 VanDerWaalsContact C-N 3.29Å; P279-S281 PolarHBondContact O-N 3.24Å; S281-Y285 PolarHBondContact O-N 2.89Å; S281-Y285 VanDerWaalsContact O-N 3.08Å
282	K	87.7	Confident	75.8	Confident	26 Å²	26	78.7 Å²	78.7	11%	0.113	39%	0.385	C	S	.	.	H	α-helix	trans	-76.9	-38.4	176.4	-62.9	177.4	-170.1	-177.6	0	111.2	E277 P279 Y285 I286 V435 H436	E277-K282 WeakPolarHBondContact O-CE 3.49Å; E277-K282 WeakPolarHBondContact OE2-CE 3.46Å; E277-K282 IonicContact OE2-NZ 2.69Å; E277-K282 PolarHBondContact OE2-NZ 2.83Å; P279-K282 PolarHBondContact O-N 3.08Å; P279-K282 VanDerWaalsContact O-N 3.12Å; K282-Y285 WeakPolarHBondContact O-CB 3.17Å; K282-Y285 PolarHBondContact O-N 3.12Å; K282-I286 WeakPolarHBondContact O-CG1 3.3Å; K282-I286 PolarHBondContact O-N 3.27Å; K282-V435 HydrophobicContact CB-CG1 4.01Å; K282-H436 WeakPolarHBondContact CD-ND1 3.44Å; K282-H436 PolarHBondContact NZ-CD2 2.69Å; K282-H436 PolarHBondContact NZ-CE1 2.69Å; K282-H436 VanDerWaalsContact NZ-CE1 3.27Å; K282-H436 PolarHBondContact NZ-NE2 3.26Å
283	L	90.3	Very high	78.1	Confident	27 Å²	27	73.8 Å²	73.8	14%	0.141	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-52.2	170.1	-177.7	60.7	0	0	0	110.7	P279 Y285 I286 L287 F347 L383	P279-L283 WeakPolarHBondContact O-CB 3.19Å; P279-L283 PolarHBondContact O-N 3.43Å; L283-Y285 PolarHBondContact O-N 3.09Å; L283-I286 PolarHBondContact O-N 3.22Å; L283-L287 HydrophobicContact CD1-CD1 3.87Å; L283-L287 HydrophobicContact CD1-CD2 4.35Å; L283-L287 HydrophobicContact CD1-CG 3.95Å; L283-L287 HydrophobicContact CD2-CD1 4.47Å; L283-L287 HydrophobicContact CG-CD1 3.79Å; L283-L287 HydrophobicContact CG-CG 4.22Å; L283-L287 WeakPolarHBondContact O-CG 3.39Å; L283-L287 PolarHBondContact O-N 3.47Å; L283-F347 HydrophobicContact CD1-CE2 3.85Å; L283-F347 HydrophobicContact CD1-CZ 3.89Å; L283-F347 HydrophobicContact CD2-CZ 4.2Å; L283-L383 HydrophobicContact CD1-CB 4.49Å; L283-L383 HydrophobicContact CD1-CD1 4.22Å
284	R	90.9	Very high	80.6	Confident	183 Å²	183	65.3 Å²	65.3	69%	0.691	32%	0.323	S	S	*	.	H	α-helix	trans	-54.5	-34.1	172.9	-74.8	168.9	-177.1	-174.5	0.8	113.1	T280 R288	T280-R284 VanDerWaalsContact O-CB 3.3Å; T280-R284 WeakPolarHBondContact O-CB 3.02Å; T280-R284 WeakPolarHBondContact O-CG 3.41Å; T280-R284 PolarHBondContact O-N 3.25Å; R284-R288 PolarHBondContact O-N 2.9Å
285	Y	92.3	Very high	83	Confident	76 Å²	76	59 Å²	59	30%	0.298	30%	0.296	S	S	.	.	H	α-helix	trans	-69.3	-41.5	173.3	176.8	-99	0	0	0	112.6	S281 K282 L283 R330 V442 R443	S281-Y285 PolarHBondContact O-N 2.89Å; S281-Y285 VanDerWaalsContact O-N 3.08Å; K282-Y285 WeakPolarHBondContact O-CB 3.17Å; K282-Y285 PolarHBondContact O-N 3.12Å; L283-Y285 PolarHBondContact O-N 3.09Å; Y285-R330 PolarHBondContact O-NH2 3.21Å; Y285-V442 HydrophobicContact CE1-CG1 4.05Å; Y285-R443 HydrophobicContact CE1-CG 3.64Å; Y285-R443 WeakPolarHBondContact OH-CG 3.4Å
286	I	92.6	Very high	85.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.7	-41.2	177.4	-65.6	165.4	0	0	0	111.5	K282 L283 R288 L383 V435 V438 A439 V442	K282-I286 WeakPolarHBondContact O-CG1 3.3Å; K282-I286 PolarHBondContact O-N 3.27Å; L283-I286 PolarHBondContact O-N 3.22Å; I286-R288 VanDerWaalsContact C-N 3.33Å; I286-R288 PolarHBondContact O-N 3.19Å; I286-L383 HydrophobicContact CD1-CD2 3.89Å; I286-L383 HydrophobicContact CG2-CD1 3.98Å; I286-V435 HydrophobicContact CD1-CG1 3.71Å; I286-V438 HydrophobicContact CD1-CB 4.14Å; I286-V438 HydrophobicContact CD1-CG1 4.15Å; I286-A439 HydrophobicContact CD1-CB 4.06Å; I286-A439 HydrophobicContact CG1-CB 4.17Å; I286-V442 HydrophobicContact CG1-CG2 4.25Å; I286-V442 HydrophobicContact CG2-CG2 4.25Å
287	L	93.9	Very high	88.2	Confident	15 Å²	15	51 Å²	51	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-77.5	-13	-177.7	-61.7	-178	0	0	0	114	L283 E289 A290 F292 I333 F347 C424	L283-L287 HydrophobicContact CD1-CD1 3.87Å; L283-L287 HydrophobicContact CD1-CD2 4.35Å; L283-L287 HydrophobicContact CD1-CG 3.95Å; L283-L287 HydrophobicContact CD2-CD1 4.47Å; L283-L287 HydrophobicContact CG-CD1 3.79Å; L283-L287 HydrophobicContact CG-CG 4.22Å; L283-L287 WeakPolarHBondContact O-CG 3.39Å; L283-L287 PolarHBondContact O-N 3.47Å; L287-E289 PolarHBondContact O-N 3.24Å; L287-A290 VanDerWaalsContact O-CB 3.29Å; L287-A290 WeakPolarHBondContact O-CB 3.43Å; L287-A290 PolarHBondContact O-N 2.94Å; L287-F292 HydrophobicContact CB-CZ 4.26Å; L287-F292 HydrophobicContact CD2-CE1 3.88Å; L287-F292 HydrophobicContact CD2-CZ 4.04Å; L287-I333 HydrophobicContact CD2-CD1 3.76Å; L287-I333 HydrophobicContact CD2-CG1 3.73Å; L287-F347 HydrophobicContact CD2-CE2 4.49Å; L287-C424 HydrophobicContact CD1-CB 3.52Å; L287-C424 HydrophobicContact CD2-CB 4.42Å
288	R	92.8	Very high	90.2	Very high	149 Å²	149	51.8 Å²	51.8	56%	0.562	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	132.3	174.4	-173.3	-164.9	-64.4	-164.7	-7.4	110.1	R284 I286 A290 R330	R284-R288 PolarHBondContact O-N 2.9Å; I286-R288 VanDerWaalsContact C-N 3.33Å; I286-R288 PolarHBondContact O-N 3.19Å; R288-A290 PolarHBondContact O-N 3.22Å; R288-R330 PolarHBondContact O-NH1 3.19Å
289	E	90.6	Very high	91.8	Very high	124 Å²	124	50.2 Å²	50.2	58%	0.579	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	33.3	-174.4	-51.8	113.5	-153.2	0	0	113.2	L287 R330	L287-E289 PolarHBondContact O-N 3.24Å; E289-R330 WeakPolarHBondContact OE2-CD 3.5Å; E289-R330 IonicContact OE2-CZ 3.67Å; E289-R330 IonicContact OE2-NE 3.86Å; E289-R330 IonicContact OE2-NH1 2.73Å; E289-R330 PolarHBondContact OE2-NH1 3.26Å
290	A	95.9	Very high	93.4	Very high	2 Å²	2	51.2 Å²	51.2	2%	0.017	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	146.4	175.5	0	0	0	0	0	112.3	L287 R288 F292 S331 I333	L287-A290 VanDerWaalsContact O-CB 3.29Å; L287-A290 WeakPolarHBondContact O-CB 3.43Å; L287-A290 PolarHBondContact O-N 2.94Å; R288-A290 PolarHBondContact O-N 3.22Å; A290-F292 HydrophobicContact CB-CE2 3.91Å; A290-F292 HydrophobicContact CB-CZ 4.11Å; A290-F292 WeakPolarHBondContact O-CD2 3.33Å; A290-F292 WeakPolarHBondContact O-CE2 3.4Å; A290-S331 WeakPolarHBondContact CA-O 3.22Å; A290-I333 HydrophobicContact CB-CG1 3.96Å
291	R	97.6	Very high	94.3	Very high	78 Å²	78	53.8 Å²	53.8	29%	0.294	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.2	165.4	-66.8	177.7	71.3	170.4	3	109.2	F293 S328 A329 S331 V332 I333 E414	R291-F293 HydrophobicContact CB-CE2 3.91Å; R291-S328 PolarHBondContact NH1-OG 2.85Å; R291-A329 HydrophobicContact CB-CB 4.35Å; R291-A329 HydrophobicContact CG-CB 3.86Å; R291-S331 PolarHBondContact N-O 3.37Å; R291-V332 WeakPolarHBondContact O-CA 3.4Å; R291-I333 PolarHBondContact O-N 3Å; R291-E414 IonicContact CZ-OE1 2.71Å; R291-E414 IonicContact CZ-OE2 3.84Å; R291-E414 IonicContact NE-OE1 3.15Å; R291-E414 PolarHBondContact NE-OE1 2.72Å; R291-E414 IonicContact NE-OE2 4Å; R291-E414 IonicContact NH2-OE1 2.75Å; R291-E414 PolarHBondContact NH2-OE1 2.8Å; R291-E414 IonicContact NH2-OE2 3.2Å; R291-E414 PolarHBondContact NH2-OE2 2.95Å
292	F	98.3	Very high	94.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.1	-171.5	-65.3	-101.7	0	0	0	110.4	L287 A290 I333 E414 I415 P417 G420 A421	L287-F292 HydrophobicContact CB-CZ 4.26Å; L287-F292 HydrophobicContact CD2-CE1 3.88Å; L287-F292 HydrophobicContact CD2-CZ 4.04Å; A290-F292 HydrophobicContact CB-CE2 3.91Å; A290-F292 HydrophobicContact CB-CZ 4.11Å; A290-F292 WeakPolarHBondContact O-CD2 3.33Å; A290-F292 WeakPolarHBondContact O-CE2 3.4Å; F292-I333 CarbonylContact C-O 3.59Å; F292-I333 WeakPolarHBondContact CA-O 3.45Å; F292-I333 HydrophobicContact CD1-CB 3.71Å; F292-I333 HydrophobicContact CD1-CG1 4.14Å; F292-I333 HydrophobicContact CD1-CG2 3.9Å; F292-I333 HydrophobicContact CE1-CB 4.03Å; F292-I333 HydrophobicContact CE1-CG1 3.97Å; F292-I333 HydrophobicContact CE1-CG2 4.13Å; F292-I333 HydrophobicContact CG-CB 4.32Å; F292-I333 HydrophobicContact CZ-CG1 4.45Å; F292-E414 WeakPolarHBondContact O-CA 3.45Å; F292-E414 VanDerWaalsContact O-CG 3.31Å; F292-E414 WeakPolarHBondContact O-CG 3.25Å; F292-I415 HydrophobicContact CB-CB 3.99Å; F292-I415 PolarHBondContact O-N 2.7Å; F292-P417 HydrophobicContact CD2-CB 4.39Å; F292-P417 HydrophobicContact CE2-CB 4.25Å; F292-G420 VanDerWaalsContact CE1-O 3.28Å; F292-G420 WeakPolarHBondContact CE1-O 3.48Å; F292-A421 HydrophobicContact CZ-CB 4.14Å
293	F	98.4	Very high	95.3	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.6	179.3	-63.3	-91.1	0	0	0	110.6	R291 L322 A325 V332 I333 L334 V335 Q413 E414	R291-F293 HydrophobicContact CB-CE2 3.91Å; F293-L322 HydrophobicContact CB-CD2 4.11Å; F293-L322 HydrophobicContact CD1-CD2 4.17Å; F293-L322 HydrophobicContact CD2-CD2 3.58Å; F293-L322 HydrophobicContact CE2-CD2 4.01Å; F293-L322 HydrophobicContact CG-CD2 3.67Å; F293-L322 HydrophobicContact CZ-CD2 4.48Å; F293-A325 HydrophobicContact CE2-CB 3.62Å; F293-A325 HydrophobicContact CZ-CB 3.68Å; F293-V332 HydrophobicContact CD2-CG1 3.73Å; F293-V332 HydrophobicContact CE2-CG1 3.84Å; F293-I333 PolarHBondContact N-O 2.87Å; F293-L334 HydrophobicContact CB-CD2 4.1Å; F293-V335 PolarHBondContact O-N 2.93Å; F293-Q413 CarbonylContact C-O 3.52Å; F293-Q413 WeakPolarHBondContact CA-O 3.29Å; F293-E414 HydrophobicContact CD1-CB 4Å; F293-E414 HydrophobicContact CD1-CG 4Å; F293-E414 HydrophobicContact CE1-CB 3.77Å; F293-E414 HydrophobicContact CE1-CG 3.59Å; F293-E414 HydrophobicContact CE2-CG 4.42Å; F293-E414 HydrophobicContact CZ-CB 4.49Å; F293-E414 VanDerWaalsContact CZ-CD 3.48Å; F293-E414 HydrophobicContact CZ-CG 3.82Å
294	L	98.3	Very high	95.6	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.3	169.6	-176.2	59	0	0	0	109	K296 F344 G412 Q413 I415	L294-K296 HydrophobicContact CD1-CD 4.17Å; L294-K296 HydrophobicContact CD2-CD 3.93Å; L294-K296 HydrophobicContact CD2-CG 4.49Å; L294-K296 HydrophobicContact CG-CD 3.84Å; L294-K296 HydrophobicContact CG-CG 4.3Å; L294-F344 HydrophobicContact CD1-CD1 4.4Å; L294-F344 HydrophobicContact CD1-CE1 3.84Å; L294-G412 WeakPolarHBondContact O-CA 3.39Å; L294-G412 PolarHBondContact O-N 3.41Å; L294-Q413 HydrophobicContact CB-CB 4.26Å; L294-Q413 PolarHBondContact N-O 3.36Å; L294-I415 HydrophobicContact CB-CD1 4.19Å
295	I	98.2	Very high	95.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121	173.8	-63.7	-58	0	0	0	108.8	W312 L334 V335 F336 S337 D411	I295-W312 HydrophobicContact CG2-CH2 4.27Å; I295-W312 HydrophobicContact CG2-CZ2 3.36Å; I295-L334 HydrophobicContact CD1-CD2 4.17Å; I295-L334 HydrophobicContact CG1-CB 3.88Å; I295-L334 HydrophobicContact CG1-CD1 4.22Å; I295-L334 HydrophobicContact CG1-CD2 4.05Å; I295-L334 HydrophobicContact CG1-CG 4.27Å; I295-V335 PolarHBondContact N-O 3.05Å; I295-F336 HydrophobicContact CB-CD1 4.06Å; I295-F336 HydrophobicContact CB-CE1 4.2Å; I295-F336 HydrophobicContact CG2-CD1 3.69Å; I295-F336 HydrophobicContact CG2-CE1 3.69Å; I295-S337 PolarHBondContact O-N 3.46Å; I295-D411 VanDerWaalsContact CA-OD1 3.29Å; I295-D411 WeakPolarHBondContact CA-OD1 3.44Å
296	K	96.7	Very high	96.2	Very high	43 Å²	43	42.1 Å²	42.1	19%	0.187	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	114.3	179.1	-59.1	-60	-63.3	-169.5	0	109.2	L294 S337 D411	L294-K296 HydrophobicContact CD1-CD 4.17Å; L294-K296 HydrophobicContact CD2-CD 3.93Å; L294-K296 HydrophobicContact CD2-CG 4.49Å; L294-K296 HydrophobicContact CG-CD 3.84Å; L294-K296 HydrophobicContact CG-CG 4.3Å; K296-S337 VanDerWaalsContact CA-O 3.3Å; K296-S337 WeakPolarHBondContact CA-O 3.49Å; K296-S337 PolarHBondContact NZ-OG 3.1Å; K296-D411 HydrophobicContact CB-CB 4.16Å; K296-D411 PolarHBondContact N-OD1 3.18Å
297	S	96.4	Very high	96.4	Very high	7 Å²	7	44.1 Å²	44.1	5%	0.049	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	142.7	175.2	-163.6	0	0	0	0	111.4	N299 S337 V338 R339	S297-N299 VanDerWaalsContact C-N 3.31Å; S297-N299 PolarHBondContact OG-O 2.96Å; S297-S337 PolarHBondContact N-O 3.19Å; S297-V338 CarbonylContact O-C 3.53Å; S297-V338 VanDerWaalsContact O-CA 3.25Å; S297-V338 WeakPolarHBondContact O-CA 3.47Å; S297-R339 PolarHBondContact O-N 3.48Å
298	N	94.2	Very high	96.5	Very high	103 Å²	103	47.4 Å²	47.4	55%	0.551	24%	0.24	S	C	*	.	S	Bend	trans	-81.1	-9.4	177.6	-61.8	-6.6	0	0	0	113	R339	N298-R339 WeakPolarHBondContact OD1-CD 3.33Å
299	N	95.6	Very high	96.6	Very high	44 Å²	44	45.1 Å²	45.1	24%	0.235	23%	0.234	C	C	.	.			trans	-150.6	136.9	-176	-172.4	-14.6	0	0	0	112.4	S297 E301 N302	S297-N299 VanDerWaalsContact C-N 3.31Å; S297-N299 PolarHBondContact OG-O 2.96Å; N299-E301 PolarHBondContact ND2-OE1 3.24Å; N299-E301 PolarHBondContact O-N 2.8Å; N299-E301 WeakPolarHBondContact OD1-CG 3.28Å; N299-E301 PolarHBondContact OD1-N 3.37Å; N299-N302 PolarHBondContact O-N 3Å
300	H	96.8	Very high	96.9	Very high	80 Å²	80	40.2 Å²	40.2	37%	0.37	22%	0.216	S	C	.	.	H	α-helix	trans	-56.9	-29	171.3	-77.1	-85.9	0	0	0	113.9	V303 S304	H300-V303 PolarHBondContact O-N 3.2Å; H300-S304 WeakPolarHBondContact O-CB 3.47Å; H300-S304 PolarHBondContact O-N 3.21Å; H300-S304 PolarHBondContact O-OG 2.89Å
301	E	97.1	Very high	96.9	Very high	105 Å²	105	41 Å²	41	49%	0.491	22%	0.221	S	C	.	.	H	α-helix	trans	-60.9	-44.3	177.3	-68.8	177.8	-99.3	0	0	112	N299 V303 S304 L305 V364	N299-E301 PolarHBondContact ND2-OE1 3.24Å; N299-E301 PolarHBondContact O-N 2.8Å; N299-E301 WeakPolarHBondContact OD1-CG 3.28Å; N299-E301 PolarHBondContact OD1-N 3.37Å; E301-V303 PolarHBondContact O-N 3Å; E301-S304 WeakPolarHBondContact O-CB 3.33Å; E301-S304 PolarHBondContact O-N 3.49Å; E301-S304 VanDerWaalsContact O-N 3.17Å; E301-L305 WeakPolarHBondContact O-CG 3.48Å; E301-L305 PolarHBondContact O-N 2.83Å; E301-V364 HydrophobicContact CB-CG2 4.02Å
302	N	96.9	Very high	96.9	Very high	13 Å²	13	37.9 Å²	37.9	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-41	178.4	-70.6	-38.7	0	0	0	111.7	N299 S304 L305 A306 W312 W363 V364	N299-N302 PolarHBondContact O-N 3Å; N302-S304 VanDerWaalsContact C-N 3.29Å; N302-S304 PolarHBondContact O-N 2.75Å; N302-L305 PolarHBondContact O-N 2.98Å; N302-A306 WeakPolarHBondContact O-CB 3.36Å; N302-A306 PolarHBondContact O-N 3.01Å; N302-W312 HydrophobicContact CB-CZ3 4.33Å; N302-W363 HydrophobicContact CB-CE3 4.22Å; N302-V364 PolarHBondContact ND2-O 3.43Å; N302-V364 PolarHBondContact OD1-N 3.3Å
303	V	97.9	Very high	96.8	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-34.6	174.4	179.7	0	0	0	0	111.2	H300 E301 A306 K307 V338 Q345 W382	H300-V303 PolarHBondContact O-N 3.2Å; E301-V303 PolarHBondContact O-N 3Å; V303-A306 PolarHBondContact O-N 3.08Å; V303-K307 WeakPolarHBondContact O-CB 3.25Å; V303-K307 WeakPolarHBondContact O-CG 3.35Å; V303-K307 PolarHBondContact O-N 3.28Å; V303-V338 HydrophobicContact CB-CG2 4.36Å; V303-V338 HydrophobicContact CG2-CG2 3.64Å; V303-Q345 HydrophobicContact CG1-CB 3.81Å; V303-Q345 HydrophobicContact CG1-CG 4.29Å; V303-W382 HydrophobicContact CG1-CH2 4.34Å
304	S	97.3	Very high	96.6	Very high	69 Å²	69	38.4 Å²	38.4	48%	0.483	21%	0.213	S	C	.	.	H	α-helix	trans	-69.3	-42.6	176.1	-57.8	0	0	0	0	112	H300 E301 N302 A306 K307 A308	H300-S304 WeakPolarHBondContact O-CB 3.47Å; H300-S304 PolarHBondContact O-N 3.21Å; H300-S304 PolarHBondContact O-OG 2.89Å; E301-S304 WeakPolarHBondContact O-CB 3.33Å; E301-S304 PolarHBondContact O-N 3.49Å; E301-S304 VanDerWaalsContact O-N 3.17Å; N302-S304 VanDerWaalsContact C-N 3.29Å; N302-S304 PolarHBondContact O-N 2.75Å; S304-A306 VanDerWaalsContact C-N 3.33Å; S304-A306 PolarHBondContact O-N 2.96Å; S304-K307 PolarHBondContact O-N 3.31Å; S304-A308 WeakPolarHBondContact O-CB 3.44Å; S304-A308 PolarHBondContact O-N 3.31Å
305	L	96.6	Very high	96.4	Very high	45 Å²	45	42.3 Å²	42.3	24%	0.236	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-42.4	170.7	-73.2	169.2	0	0	0	111.4	E301 N302 A308 K309 H362 W363	E301-L305 WeakPolarHBondContact O-CG 3.48Å; E301-L305 PolarHBondContact O-N 2.83Å; N302-L305 PolarHBondContact O-N 2.98Å; L305-A308 PolarHBondContact O-N 3.5Å; L305-K309 WeakPolarHBondContact O-CB 3.3Å; L305-K309 PolarHBondContact O-N 2.77Å; L305-H362 WeakPolarHBondContact CD1-O 3.4Å; L305-W363 HydrophobicContact CB-CE3 4.33Å; L305-W363 HydrophobicContact CB-CZ3 3.89Å; L305-W363 HydrophobicContact CD1-CE3 4.27Å
306	A	97.7	Very high	96.3	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-40.1	176.6	0	0	0	0	0	112.6	N302 V303 S304 G310 V311 W312 W363 I380 W382	N302-A306 WeakPolarHBondContact O-CB 3.36Å; N302-A306 PolarHBondContact O-N 3.01Å; V303-A306 PolarHBondContact O-N 3.08Å; S304-A306 VanDerWaalsContact C-N 3.33Å; S304-A306 PolarHBondContact O-N 2.96Å; A306-G310 WeakPolarHBondContact O-CA 3.32Å; A306-G310 PolarHBondContact O-N 3.03Å; A306-V311 WeakPolarHBondContact CA-O 3.29Å; A306-V311 VanDerWaalsContact CB-O 3.27Å; A306-V311 WeakPolarHBondContact CB-O 3.45Å; A306-W312 HydrophobicContact CB-CE3 3.78Å; A306-W312 HydrophobicContact CB-CZ3 4.11Å; A306-W363 HydrophobicContact CB-CH2 4.35Å; A306-W363 HydrophobicContact CB-CZ3 4.45Å; A306-I380 HydrophobicContact CB-CD1 4.45Å; A306-W382 HydrophobicContact CB-CZ2 4.06Å; A306-W382 PolarHBondContact O-NE1 3.18Å
307	K	96.7	Very high	96.2	Very high	42 Å²	42	47.6 Å²	47.6	18%	0.183	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-42.1	172.6	-77.2	-179.9	-177.5	-173.1	0	112.4	V303 S304 Q345 W382 R385	V303-K307 WeakPolarHBondContact O-CB 3.25Å; V303-K307 WeakPolarHBondContact O-CG 3.35Å; V303-K307 PolarHBondContact O-N 3.28Å; S304-K307 PolarHBondContact O-N 3.31Å; K307-Q345 WeakPolarHBondContact CE-O 3.5Å; K307-Q345 PolarHBondContact NZ-O 3.01Å; K307-W382 HydrophobicContact CB-CZ2 4.33Å; K307-W382 HydrophobicContact CD-CH2 4.47Å; K307-W382 HydrophobicContact CG-CD2 4.09Å; K307-W382 HydrophobicContact CG-CE3 4.2Å; K307-W382 HydrophobicContact CG-CH2 3.65Å; K307-W382 HydrophobicContact CG-CZ2 3.5Å; K307-W382 HydrophobicContact CG-CZ3 3.99Å; K307-R385 HydrophobicContact CD-CB 4.4Å; K307-R385 HydrophobicContact CG-CG 4.47Å; K307-R385 PolarHBondContact NZ-O 2.85Å; K307-R385 PolarHBondContact O-NH2 2.79Å
308	A	95.9	Very high	96.2	Very high	84 Å²	84	47.9 Å²	47.9	69%	0.694	27%	0.271	S	S	*	.	H	α-helix	trans	-74.6	-45.6	-178.1	0	0	0	0	0	113.2	S304 L305	S304-A308 WeakPolarHBondContact O-CB 3.44Å; S304-A308 PolarHBondContact O-N 3.31Å; L305-A308 PolarHBondContact O-N 3.5Å
309	K	95.7	Very high	96.3	Very high	102 Å²	102	43.6 Å²	43.6	44%	0.443	25%	0.248	S	C	.	.	H	α-helix	trans	-91.6	-16.9	-173.8	-64.5	-177.4	-178.9	178.1	0	114.4	L305 V311 I361	L305-K309 WeakPolarHBondContact O-CB 3.3Å; L305-K309 PolarHBondContact O-N 2.77Å; K309-V311 HydrophobicContact CB-CG2 3.81Å; K309-I361 HydrophobicContact CD-CD1 4.12Å; K309-I361 HydrophobicContact CD-CG2 4.41Å
310	G	96.3	Very high	96.3	Very high	20 Å²	20	49.1 Å²	49.1	21%	0.206	27%	0.27	C	S	.	.	S	Bend	trans	68.5	34.3	-176.8	0	0	0	0	0	113.5	A306 I380	A306-G310 WeakPolarHBondContact O-CA 3.32Å; A306-G310 PolarHBondContact O-N 3.03Å; G310-I380 VanDerWaalsContact C-CG1 3.49Å; G310-I380 PolarHBondContact O-N 2.73Å
311	V	96.7	Very high	96.3	Very high	19 Å²	19	50.3 Å²	50.3	12%	0.115	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	160.4	-179.4	-62	0	0	0	0	112.3	A306 K309 I361 W363 V377 F378	A306-V311 WeakPolarHBondContact CA-O 3.29Å; A306-V311 VanDerWaalsContact CB-O 3.27Å; A306-V311 WeakPolarHBondContact CB-O 3.45Å; K309-V311 HydrophobicContact CB-CG2 3.81Å; V311-I361 HydrophobicContact CG2-CD1 4.02Å; V311-I361 HydrophobicContact CG2-CG1 4.11Å; V311-W363 HydrophobicContact CG2-CH2 4.17Å; V311-W363 HydrophobicContact CG2-CZ2 4.23Å; V311-V377 HydrophobicContact CB-CG1 3.65Å; V311-V377 HydrophobicContact CG1-CG1 3.91Å; V311-V377 HydrophobicContact CG2-CG1 4.22Å; V311-F378 CarbonylContact C-O 3.5Å; V311-F378 WeakPolarHBondContact CA-O 3.47Å; V311-F378 WeakPolarHBondContact CB-O 3.23Å
312	W	97.3	Very high	96.3	Very high	13 Å²	13	45.4 Å²	45.4	5%	0.049	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	153.3	172.2	-170.3	-117.9	0	0	0	111.8	I295 N302 A306 F336 W363 F378 I380	I295-W312 HydrophobicContact CG2-CH2 4.27Å; I295-W312 HydrophobicContact CG2-CZ2 3.36Å; N302-W312 HydrophobicContact CB-CZ3 4.33Å; A306-W312 HydrophobicContact CB-CE3 3.78Å; A306-W312 HydrophobicContact CB-CZ3 4.11Å; W312-F336 AromaticContact CD2-CE1 3.67Å; W312-F336 HydrophobicContact CD2-CE1 3.67Å; W312-F336 HydrophobicContact CD2-CZ 4.23Å; W312-F336 AromaticContact CE2-CE1 3.88Å; W312-F336 AromaticContact CE3-CE1 3.75Å; W312-F336 HydrophobicContact CE3-CE1 3.75Å; W312-F336 HydrophobicContact CE3-CZ 4.47Å; W312-F336 HydrophobicContact CG-CE1 4.17Å; W312-F336 HydrophobicContact CG-CZ 4.28Å; W312-F336 HydrophobicContact CH2-CE1 4.24Å; W312-F336 HydrophobicContact CZ2-CE1 4.18Å; W312-F336 HydrophobicContact CZ3-CE1 4.03Å; W312-W363 AromaticContact CE3-CH2 3.99Å; W312-W363 HydrophobicContact CE3-CH2 3.99Å; W312-W363 HydrophobicContact CE3-CZ3 4.32Å; W312-W363 HydrophobicContact CZ3-CH2 4.45Å; W312-W363 HydrophobicContact CZ3-CZ3 4.33Å; W312-F378 PolarHBondContact N-O 3.09Å; W312-F378 PolarHBondContact O-N 3.13Å; W312-I380 HydrophobicContact CB-CD1 4.28Å; W312-I380 HydrophobicContact CB-CG2 4.28Å
313	S	95.6	Very high	96.3	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.063	26%	0.255	C	S	.	.			trans	-134.2	145.1	167.6	-63.1	0	0	0	0	108.6	W363	S313-W363 PolarHBondContact OG-NE1 3.48Å; S313-W363 VanDerWaalsContact OG-NE1 3.11Å
314	T	95.2	Very high	96.3	Very high	6 Å²	6	48.6 Å²	48.6	4%	0.037	28%	0.276	C	S	.	.			trans	-138.2	-179.9	175.1	179.3	0	0	0	0	108.8	N318 L322 G375 F378 D411	T314-N318 HydrophobicContact CG2-CB 3.73Å; T314-N318 WeakPolarHBondContact OG1-CB 3.46Å; T314-L322 HydrophobicContact CG2-CD1 4.08Å; T314-G375 PolarHBondContact O-N 3.1Å; T314-F378 HydrophobicContact CG2-CE2 4.25Å; T314-D411 PolarHBondContact OG1-OD2 3.33Å
315	L	94.4	Very high	96.2	Very high	83 Å²	83	45.3 Å²	45.3	44%	0.435	25%	0.253	S	S	.	.			trans	-64.8	149.6	177	-68.9	167.1	0	0	0	111.5	V317 N318 E319 M369	L315-V317 PolarHBondContact O-N 2.94Å; L315-N318 PolarHBondContact O-N 2.63Å; L315-E319 PolarHBondContact O-N 3Å; L315-M369 HydrophobicContact CD2-CE 3.61Å
316	P	94.7	Very high	96.2	Very high	56 Å²	56	44.2 Å²	44.2	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-54.1	-27.6	-179	-30.7	36.8	0	0	0	115.7	K320 M373	P316-K320 WeakPolarHBondContact O-CG 3.45Å; P316-K320 PolarHBondContact O-N 2.78Å; P316-K320 VanDerWaalsContact O-N 3.14Å; P316-M373 WeakPolarHBondContact CD-O 3.47Å
317	V	94.7	Very high	96	Very high	97 Å²	97	50.6 Å²	50.6	59%	0.588	28%	0.276	S	S	*	.	H	α-helix	trans	-64.2	-44.7	173.9	178.7	0	0	0	0	111.3	L315 K321	L315-V317 PolarHBondContact O-N 2.94Å; V317-K321 WeakPolarHBondContact O-CG 3.21Å; V317-K321 PolarHBondContact O-N 3.17Å
318	N	96.4	Very high	95.8	Very high	13 Å²	13	52.5 Å²	52.5	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-79.5	-30.9	179.4	-72.8	-13	0	0	0	111.6	T314 L315 K321 L322 D411	T314-N318 HydrophobicContact CG2-CB 3.73Å; T314-N318 WeakPolarHBondContact OG1-CB 3.46Å; L315-N318 PolarHBondContact O-N 2.63Å; N318-K321 PolarHBondContact O-N 3.12Å; N318-L322 WeakPolarHBondContact O-CB 3.1Å; N318-L322 VanDerWaalsContact O-CG 3.31Å; N318-L322 WeakPolarHBondContact O-CG 3.43Å; N318-L322 PolarHBondContact O-N 2.9Å; N318-D411 PolarHBondContact ND2-O 3.11Å; N318-D411 PolarHBondContact ND2-OD2 2.71Å
319	E	96.2	Very high	95.7	Very high	14 Å²	14	49 Å²	49	7%	0.065	27%	0.265	C	S	.	.	H	α-helix	trans	-55.3	-51.3	170.1	174.6	177.5	-147.4	0	0	112.1	L315 K321 L322 N323 S354 H356 G375 G376 F378	L315-E319 PolarHBondContact O-N 3Å; E319-K321 VanDerWaalsContact C-N 3.33Å; E319-K321 PolarHBondContact O-N 2.84Å; E319-L322 PolarHBondContact O-N 3.32Å; E319-N323 PolarHBondContact O-N 3.42Å; E319-S354 WeakPolarHBondContact CG-OG 3.3Å; E319-S354 WeakPolarHBondContact OE1-CB 3.29Å; E319-S354 PolarHBondContact OE1-OG 3.36Å; E319-H356 IonicContact OE1-CE1 2.73Å; E319-H356 PolarHBondContact OE1-CE1 3.33Å; E319-H356 IonicContact OE1-NE2 3.72Å; E319-H356 IonicContact OE2-CE1 3.32Å; E319-G375 WeakPolarHBondContact OE2-CA 3.13Å; E319-G376 VanDerWaalsContact CD-N 3.35Å; E319-G376 WeakPolarHBondContact OE1-CA 2.99Å; E319-G376 PolarHBondContact OE1-N 3.17Å; E319-G376 PolarHBondContact OE2-N 3.38Å; E319-F378 HydrophobicContact CB-CE2 4.24Å; E319-F378 HydrophobicContact CB-CZ 4.28Å; E319-F378 HydrophobicContact CG-CE2 4.15Å; E319-F378 HydrophobicContact CG-CZ 3.97Å
320	K	96.3	Very high	95.6	Very high	159 Å²	159	46.5 Å²	46.5	69%	0.691	25%	0.253	S	S	*	.	H	α-helix	trans	-56.8	-45.7	177.4	-72.6	173.9	-177.9	-178	0	111.8	P316 A324	P316-K320 WeakPolarHBondContact O-CG 3.45Å; P316-K320 PolarHBondContact O-N 2.78Å; P316-K320 VanDerWaalsContact O-N 3.14Å; K320-A324 WeakPolarHBondContact O-CB 3.33Å; K320-A324 PolarHBondContact O-N 3.41Å
321	K	96.7	Very high	95.6	Very high	105 Å²	105	45.6 Å²	45.6	46%	0.457	24%	0.243	S	C	.	.	H	α-helix	trans	-60.3	-46.6	176.3	-67.8	173.4	-177.4	176.2	0	111.9	V317 N318 E319 A324 A325	V317-K321 WeakPolarHBondContact O-CG 3.21Å; V317-K321 PolarHBondContact O-N 3.17Å; N318-K321 PolarHBondContact O-N 3.12Å; E319-K321 VanDerWaalsContact C-N 3.33Å; E319-K321 PolarHBondContact O-N 2.84Å; K321-A324 PolarHBondContact O-N 2.96Å; K321-A325 VanDerWaalsContact O-CB 3.28Å; K321-A325 WeakPolarHBondContact O-CB 3.43Å; K321-A325 PolarHBondContact O-N 2.89Å
322	L	97.4	Very high	95.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-69.3	-37.1	-178.3	-70.5	-180	0	0	0	113	F293 T314 N318 E319 A325 F326 V332 L334 F378	F293-L322 HydrophobicContact CB-CD2 4.11Å; F293-L322 HydrophobicContact CD1-CD2 4.17Å; F293-L322 HydrophobicContact CD2-CD2 3.58Å; F293-L322 HydrophobicContact CE2-CD2 4.01Å; F293-L322 HydrophobicContact CG-CD2 3.67Å; F293-L322 HydrophobicContact CZ-CD2 4.48Å; T314-L322 HydrophobicContact CG2-CD1 4.08Å; N318-L322 WeakPolarHBondContact O-CB 3.1Å; N318-L322 VanDerWaalsContact O-CG 3.31Å; N318-L322 WeakPolarHBondContact O-CG 3.43Å; N318-L322 PolarHBondContact O-N 2.9Å; E319-L322 PolarHBondContact O-N 3.32Å; L322-A325 PolarHBondContact O-N 2.77Å; L322-F326 WeakPolarHBondContact O-CB 3.43Å; L322-F326 PolarHBondContact O-N 3.2Å; L322-V332 HydrophobicContact CD2-CG1 4.08Å; L322-L334 HydrophobicContact CD1-CD2 4.06Å; L322-L334 HydrophobicContact CD2-CD2 3.62Å; L322-F378 HydrophobicContact CB-CE1 3.94Å; L322-F378 HydrophobicContact CB-CZ 3.72Å; L322-F378 HydrophobicContact CD1-CE2 4.23Å; L322-F378 HydrophobicContact CD1-CZ 4.22Å
323	N	97	Very high	95.7	Very high	30 Å²	30	44 Å²	44	16%	0.16	24%	0.235	C	C	.	.	H	α-helix	trans	-65.9	-47.6	173.4	-78.1	-26.9	0	0	0	111.4	E319 A325 F326 Q327 E353 S354 F378	E319-N323 PolarHBondContact O-N 3.42Å; N323-A325 VanDerWaalsContact C-N 3.29Å; N323-A325 PolarHBondContact O-N 3.14Å; N323-F326 PolarHBondContact O-N 3.29Å; N323-Q327 WeakPolarHBondContact O-CG 3.43Å; N323-Q327 PolarHBondContact O-N 3.12Å; N323-E353 WeakPolarHBondContact OD1-CA 3.45Å; N323-E353 WeakPolarHBondContact OD1-CB 3.07Å; N323-S354 PolarHBondContact ND2-OG 3.4Å; N323-S354 PolarHBondContact OD1-N 2.57Å; N323-F378 VanDerWaalsContact OD1-CE1 3.23Å; N323-F378 WeakPolarHBondContact OD1-CE1 3.28Å
324	A	96.9	Very high	95.9	Very high	53 Å²	53	43.6 Å²	43.6	44%	0.438	23%	0.232	S	C	.	.	H	α-helix	trans	-60.6	-38.7	175.2	0	0	0	0	0	112.1	K320 K321 S328	K320-A324 WeakPolarHBondContact O-CB 3.33Å; K320-A324 PolarHBondContact O-N 3.41Å; K321-A324 PolarHBondContact O-N 2.96Å; A324-S328 WeakPolarHBondContact O-CB 3.26Å; A324-S328 PolarHBondContact O-N 2.76Å; A324-S328 PolarHBondContact O-OG 2.9Å
325	A	96.5	Very high	96	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-37.2	172	0	0	0	0	0	112.4	F293 K321 L322 N323 S328 A329 V332	F293-A325 HydrophobicContact CE2-CB 3.62Å; F293-A325 HydrophobicContact CZ-CB 3.68Å; K321-A325 VanDerWaalsContact O-CB 3.28Å; K321-A325 WeakPolarHBondContact O-CB 3.43Å; K321-A325 PolarHBondContact O-N 2.89Å; L322-A325 PolarHBondContact O-N 2.77Å; N323-A325 VanDerWaalsContact C-N 3.29Å; N323-A325 PolarHBondContact O-N 3.14Å; A325-S328 WeakPolarHBondContact CA-OG 3.22Å; A325-S328 PolarHBondContact O-OG 3.02Å; A325-A329 WeakPolarHBondContact O-CA 3.31Å; A325-A329 WeakPolarHBondContact O-CB 3.47Å; A325-A329 PolarHBondContact O-N 3.04Å; A325-V332 HydrophobicContact CB-CG2 3.74Å; A325-V332 VanDerWaalsContact O-CG2 3.3Å; A325-V332 WeakPolarHBondContact O-CG2 3.32Å
326	F	95.8	Very high	96.2	Very high	22 Å²	22	39.4 Å²	39.4	10%	0.096	21%	0.21	C	C	.	.	H	α-helix	trans	-70	-35	178.1	-175.5	-98.9	0	0	0	112.5	L322 N323 V332 L350 E353 K445	L322-F326 WeakPolarHBondContact O-CB 3.43Å; L322-F326 PolarHBondContact O-N 3.2Å; N323-F326 PolarHBondContact O-N 3.29Å; F326-V332 HydrophobicContact CB-CG2 4.37Å; F326-L350 HydrophobicContact CB-CD2 3.77Å; F326-L350 HydrophobicContact CD2-CB 4.05Å; F326-L350 HydrophobicContact CD2-CD2 3.78Å; F326-L350 HydrophobicContact CD2-CG 4.39Å; F326-L350 HydrophobicContact CE2-CB 4.5Å; F326-L350 WeakPolarHBondContact CE2-O 3.32Å; F326-L350 HydrophobicContact CG-CD2 4.02Å; F326-E353 HydrophobicContact CD1-CG 3.41Å; F326-E353 VanDerWaalsContact CD1-CG 3.41Å; F326-E353 HydrophobicContact CE1-CG 3.83Å; F326-E353 HydrophobicContact CG-CG 4.29Å; F326-K445 HydrophobicContact CZ-CD 4.3Å; F326-K445 PolarHBondContact O-NZ 2.85Å
327	Q	94.3	Very high	96.4	Very high	133 Å²	133	36.8 Å²	36.8	62%	0.621	19%	0.193	S	C	*	.	H	α-helix	trans	-72.2	-42.7	176.4	-69.4	173.3	-2.4	0	0	111.4	N323 E353	N323-Q327 WeakPolarHBondContact O-CG 3.43Å; N323-Q327 PolarHBondContact O-N 3.12Å; Q327-E353 WeakPolarHBondContact CG-OE1 3.18Å; Q327-E353 PolarHBondContact NE2-OE1 3.16Å
328	S	93.1	Very high	96.5	Very high	82 Å²	82	32.3 Å²	32.3	57%	0.573	17%	0.166	S	C	*	.	H	α-helix	trans	-77.5	-32.5	-179.5	54.6	0	0	0	0	114.9	R291 A324 A325	R291-S328 PolarHBondContact NH1-OG 2.85Å; A324-S328 WeakPolarHBondContact O-CB 3.26Å; A324-S328 PolarHBondContact O-N 2.76Å; A324-S328 PolarHBondContact O-OG 2.9Å; A325-S328 WeakPolarHBondContact CA-OG 3.22Å; A325-S328 PolarHBondContact O-OG 3.02Å
329	A	93.7	Very high	96.5	Very high	10 Å²	10	38.4 Å²	38.4	8%	0.083	19%	0.188	C	C	.	.	S	Bend	trans	-104.9	145.9	-172.2	0	0	0	0	0	114.6	R291 A325 S331 V332	R291-A329 HydrophobicContact CB-CB 4.35Å; R291-A329 HydrophobicContact CG-CB 3.86Å; A325-A329 WeakPolarHBondContact O-CA 3.31Å; A325-A329 WeakPolarHBondContact O-CB 3.47Å; A325-A329 PolarHBondContact O-N 3.04Å; A329-S331 PolarHBondContact O-N 3.33Å; A329-V332 HydrophobicContact CB-CG2 4.24Å
330	R	93.4	Very high	96.4	Very high	51 Å²	51	46.1 Å²	46.1	19%	0.192	22%	0.224	C	C	.	.	S	Bend	trans	-64.2	-27.9	175.5	-179.6	168.1	149.5	-91.7	-28.6	112.4	Y285 R288 E289 V442	Y285-R330 PolarHBondContact O-NH2 3.21Å; R288-R330 PolarHBondContact O-NH1 3.19Å; E289-R330 WeakPolarHBondContact OE2-CD 3.5Å; E289-R330 IonicContact OE2-CZ 3.67Å; E289-R330 IonicContact OE2-NE 3.86Å; E289-R330 IonicContact OE2-NH1 2.73Å; E289-R330 PolarHBondContact OE2-NH1 3.26Å; R330-V442 HydrophobicContact CG-CG1 4.47Å
331	S	95.9	Very high	96.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	150.5	162.7	-77.6	0	0	0	0	111.3	A290 R291 A329 R349	A290-S331 WeakPolarHBondContact CA-O 3.22Å; R291-S331 PolarHBondContact N-O 3.37Å; A329-S331 PolarHBondContact O-N 3.33Å; S331-R349 PolarHBondContact OG-NE 2.73Å
332	V	97.8	Very high	96.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.7	172.6	173.2	0	0	0	0	107.4	R291 F293 L322 A325 F326 A329 L334 R349 L350	R291-V332 WeakPolarHBondContact O-CA 3.4Å; F293-V332 HydrophobicContact CD2-CG1 3.73Å; F293-V332 HydrophobicContact CE2-CG1 3.84Å; L322-V332 HydrophobicContact CD2-CG1 4.08Å; A325-V332 HydrophobicContact CB-CG2 3.74Å; A325-V332 VanDerWaalsContact O-CG2 3.3Å; A325-V332 WeakPolarHBondContact O-CG2 3.32Å; F326-V332 HydrophobicContact CB-CG2 4.37Å; A329-V332 HydrophobicContact CB-CG2 4.24Å; V332-L334 HydrophobicContact CG1-CD2 4.34Å; V332-R349 CarbonylContact O-C 3.59Å; V332-R349 VanDerWaalsContact O-CA 3.31Å; V332-R349 WeakPolarHBondContact O-CA 3.43Å; V332-L350 HydrophobicContact CB-CB 3.93Å; V332-L350 HydrophobicContact CG1-CB 4.26Å; V332-L350 PolarHBondContact O-N 3.18Å
333	I	98.2	Very high	96.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.1	-176.5	-53	-61.7	0	0	0	108.9	L287 A290 R291 F292 F293 V335 F347 A348 R349 L383	L287-I333 HydrophobicContact CD2-CD1 3.76Å; L287-I333 HydrophobicContact CD2-CG1 3.73Å; A290-I333 HydrophobicContact CB-CG1 3.96Å; R291-I333 PolarHBondContact O-N 3Å; F292-I333 CarbonylContact C-O 3.59Å; F292-I333 WeakPolarHBondContact CA-O 3.45Å; F292-I333 HydrophobicContact CD1-CB 3.71Å; F292-I333 HydrophobicContact CD1-CG1 4.14Å; F292-I333 HydrophobicContact CD1-CG2 3.9Å; F292-I333 HydrophobicContact CE1-CB 4.03Å; F292-I333 HydrophobicContact CE1-CG1 3.97Å; F292-I333 HydrophobicContact CE1-CG2 4.13Å; F292-I333 HydrophobicContact CG-CB 4.32Å; F292-I333 HydrophobicContact CZ-CG1 4.45Å; F293-I333 PolarHBondContact N-O 2.87Å; I333-V335 HydrophobicContact CG2-CG2 4.4Å; I333-F347 HydrophobicContact CG2-CB 4.31Å; I333-F347 HydrophobicContact CG2-CD2 3.86Å; I333-A348 CarbonylContact C-O 3.5Å; I333-A348 WeakPolarHBondContact CA-O 3.29Å; I333-R349 HydrophobicContact CD1-CB 3.88Å; I333-R349 HydrophobicContact CD1-CG 4.24Å; I333-L383 HydrophobicContact CD1-CD1 3.87Å
334	L	98.4	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.4	173.5	-56.2	-170.7	0	0	0	108.5	F293 I295 L322 V332 F336 F347 A348 L350 I380	F293-L334 HydrophobicContact CB-CD2 4.1Å; I295-L334 HydrophobicContact CD1-CD2 4.17Å; I295-L334 HydrophobicContact CG1-CB 3.88Å; I295-L334 HydrophobicContact CG1-CD1 4.22Å; I295-L334 HydrophobicContact CG1-CD2 4.05Å; I295-L334 HydrophobicContact CG1-CG 4.27Å; L322-L334 HydrophobicContact CD1-CD2 4.06Å; L322-L334 HydrophobicContact CD2-CD2 3.62Å; V332-L334 HydrophobicContact CG1-CD2 4.34Å; L334-F336 HydrophobicContact CB-CD2 4.41Å; L334-F336 HydrophobicContact CB-CE2 3.68Å; L334-F336 HydrophobicContact CB-CZ 4.02Å; L334-F336 HydrophobicContact CD1-CZ 4.11Å; L334-F347 CarbonylContact O-C 3.54Å; L334-F347 WeakPolarHBondContact O-CA 3.44Å; L334-F347 WeakPolarHBondContact O-CB 3.48Å; L334-A348 PolarHBondContact N-O 3.03Å; L334-A348 PolarHBondContact O-N 3.34Å; L334-L350 HydrophobicContact CD1-CD1 3.76Å; L334-L350 HydrophobicContact CD2-CD1 4.32Å; L334-L350 HydrophobicContact CG-CD1 4.1Å; L334-I380 HydrophobicContact CD1-CG2 4.18Å
335	V	98.4	Very high	96.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.2	174.6	-172.3	0	0	0	0	108.1	F293 I295 I333 F344 F347 L423 F427	F293-V335 PolarHBondContact O-N 2.93Å; I295-V335 PolarHBondContact N-O 3.05Å; I333-V335 HydrophobicContact CG2-CG2 4.4Å; V335-F344 HydrophobicContact CG1-CB 4.49Å; V335-F344 HydrophobicContact CG1-CD1 3.66Å; V335-F344 HydrophobicContact CG1-CE1 4.16Å; V335-F344 HydrophobicContact CG1-CG 4.23Å; V335-F347 HydrophobicContact CB-CB 4.46Å; V335-F347 HydrophobicContact CG2-CB 4.16Å; V335-L423 HydrophobicContact CG1-CD2 4.12Å; V335-L423 HydrophobicContact CG2-CD2 4.45Å; V335-F427 HydrophobicContact CG1-CE2 4.43Å; V335-F427 HydrophobicContact CG1-CZ 4.21Å
336	F	98.5	Very high	96.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.6	-171.7	-71.1	-93.8	0	0	0	111.6	I295 W312 L334 F344 Q345 G346 A348 I380 W382	I295-F336 HydrophobicContact CB-CD1 4.06Å; I295-F336 HydrophobicContact CB-CE1 4.2Å; I295-F336 HydrophobicContact CG2-CD1 3.69Å; I295-F336 HydrophobicContact CG2-CE1 3.69Å; W312-F336 AromaticContact CD2-CE1 3.67Å; W312-F336 HydrophobicContact CD2-CE1 3.67Å; W312-F336 HydrophobicContact CD2-CZ 4.23Å; W312-F336 AromaticContact CE2-CE1 3.88Å; W312-F336 AromaticContact CE3-CE1 3.75Å; W312-F336 HydrophobicContact CE3-CE1 3.75Å; W312-F336 HydrophobicContact CE3-CZ 4.47Å; W312-F336 HydrophobicContact CG-CE1 4.17Å; W312-F336 HydrophobicContact CG-CZ 4.28Å; W312-F336 HydrophobicContact CH2-CE1 4.24Å; W312-F336 HydrophobicContact CZ2-CE1 4.18Å; W312-F336 HydrophobicContact CZ3-CE1 4.03Å; L334-F336 HydrophobicContact CB-CD2 4.41Å; L334-F336 HydrophobicContact CB-CE2 3.68Å; L334-F336 HydrophobicContact CB-CZ 4.02Å; L334-F336 HydrophobicContact CD1-CZ 4.11Å; F336-F344 CarbonylContact O-C 3.58Å; F336-F344 VanDerWaalsContact O-CA 3.23Å; F336-F344 WeakPolarHBondContact O-CA 3.45Å; F336-F344 WeakPolarHBondContact O-CB 3.14Å; F336-Q345 PolarHBondContact O-N 3.41Å; F336-Q345 PolarHBondContact O-OE1 3.27Å; F336-G346 PolarHBondContact N-O 2.84Å; F336-A348 HydrophobicContact CE2-CB 4.01Å; F336-I380 HydrophobicContact CE2-CD1 4.24Å; F336-I380 HydrophobicContact CZ-CD1 3.89Å; F336-W382 HydrophobicContact CB-CH2 4.48Å; F336-W382 AromaticContact CD2-CH2 3.56Å; F336-W382 HydrophobicContact CD2-CH2 3.56Å; F336-W382 HydrophobicContact CD2-CZ2 4.29Å; F336-W382 AromaticContact CD2-CZ3 3.97Å; F336-W382 HydrophobicContact CD2-CZ3 3.97Å; F336-W382 AromaticContact CE2-CH2 3.85Å; F336-W382 HydrophobicContact CE2-CH2 3.85Å; F336-W382 HydrophobicContact CE2-CZ2 4.13Å; F336-W382 HydrophobicContact CE2-CZ3 4.41Å; F336-W382 AromaticContact CG-CH2 3.93Å; F336-W382 HydrophobicContact CG-CH2 3.93Å; F336-W382 HydrophobicContact CZ-CH2 4.44Å; F336-W382 HydrophobicContact CZ-CZ2 4.43Å
337	S	98.1	Very high	96.7	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	123.2	171.1	174.2	0	0	0	0	110.2	I295 K296 S297 K343 F390	I295-S337 PolarHBondContact O-N 3.46Å; K296-S337 VanDerWaalsContact CA-O 3.3Å; K296-S337 WeakPolarHBondContact CA-O 3.49Å; K296-S337 PolarHBondContact NZ-OG 3.1Å; S297-S337 PolarHBondContact N-O 3.19Å; S337-K343 PolarHBondContact OG-O 3.3Å; S337-F390 WeakPolarHBondContact OG-CZ 3.41Å
338	V	98	Very high	96.9	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.024	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	140.5	168.8	-176.3	0	0	0	0	108.6	S297 V303 S341 Q345	S297-V338 CarbonylContact O-C 3.53Å; S297-V338 VanDerWaalsContact O-CA 3.25Å; S297-V338 WeakPolarHBondContact O-CA 3.47Å; V303-V338 HydrophobicContact CB-CG2 4.36Å; V303-V338 HydrophobicContact CG2-CG2 3.64Å; V338-S341 WeakPolarHBondContact O-CB 3.43Å; V338-S341 PolarHBondContact O-N 2.92Å; V338-S341 PolarHBondContact O-OG 3.07Å; V338-Q345 HydrophobicContact CG2-CG 4.19Å
339	R	95.9	Very high	97.1	Very high	140 Å²	140	24.6 Å²	24.6	53%	0.528	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	151.4	172.8	-64.6	-171.3	69.8	149.1	1.7	111	S297 N298 S341	S297-R339 PolarHBondContact O-N 3.48Å; N298-R339 WeakPolarHBondContact OD1-CD 3.33Å; R339-S341 PolarHBondContact O-N 2.82Å
340	E	95.1	Very high	97.3	Very high	177 Å²	177	24.1 Å²	24.1	83%	0.827	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	-12	-168.7	-63	78.9	-101.5	0	0	118.2	G342	E340-G342 PolarHBondContact O-N 3.47Å
341	S	96.5	Very high	97.4	Very high	24 Å²	24	23.2 Å²	23.2	17%	0.168	12%	0.118	C	C	.	.	S	Bend	trans	-70.2	-1.3	-165.6	71.1	0	0	0	0	117.6	V338 R339 K343 Q345	V338-S341 WeakPolarHBondContact O-CB 3.43Å; V338-S341 PolarHBondContact O-N 2.92Å; V338-S341 PolarHBondContact O-OG 3.07Å; R339-S341 PolarHBondContact O-N 2.82Å; S341-K343 WeakPolarHBondContact O-CD 3.39Å; S341-K343 WeakPolarHBondContact O-CE 3.43Å; S341-K343 VanDerWaalsContact O-CG 3.29Å; S341-K343 WeakPolarHBondContact O-CG 3.33Å; S341-K343 PolarHBondContact O-N 2.84Å; S341-K343 PolarHBondContact OG-O 3.09Å; S341-Q345 PolarHBondContact OG-NE2 3.02Å
342	G	96.7	Very high	97.3	Very high	40 Å²	40	23.9 Å²	23.9	41%	0.412	12%	0.123	S	C	.	.	S	Bend	trans	63.6	4.8	-179.4	0	0	0	0	0	116.4	E340 F390	E340-G342 PolarHBondContact O-N 3.47Å; G342-F390 WeakPolarHBondContact O-CB 3.42Å; G342-F390 VanDerWaalsContact O-CD2 3.32Å; G342-F390 WeakPolarHBondContact O-CD2 3.21Å; G342-F390 WeakPolarHBondContact O-CG 3.44Å; G342-F390 PolarHBondContact O-N 2.84Å
343	K	97.8	Very high	97.2	Very high	60 Å²	60	27.1 Å²	27.1	26%	0.261	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	163.7	-170.6	66.1	-150.6	168	164.9	0	113.9	S337 S341 Q345 E387 L388	S337-K343 PolarHBondContact OG-O 3.3Å; S341-K343 WeakPolarHBondContact O-CD 3.39Å; S341-K343 WeakPolarHBondContact O-CE 3.43Å; S341-K343 VanDerWaalsContact O-CG 3.29Å; S341-K343 WeakPolarHBondContact O-CG 3.33Å; S341-K343 PolarHBondContact O-N 2.84Å; S341-K343 PolarHBondContact OG-O 3.09Å; K343-Q345 VanDerWaalsContact CG-NE2 3.29Å; K343-Q345 PolarHBondContact O-NE2 2.68Å; K343-E387 HydrophobicContact CD-CB 4.36Å; K343-E387 WeakPolarHBondContact CD-OE2 3.46Å; K343-E387 VanDerWaalsContact CE-CD 3.47Å; K343-E387 WeakPolarHBondContact CE-OE1 3.43Å; K343-E387 VanDerWaalsContact CE-OE2 3.25Å; K343-E387 WeakPolarHBondContact CE-OE2 3.3Å; K343-E387 IonicContact NZ-OE1 2.73Å; K343-E387 PolarHBondContact NZ-OE1 3.42Å; K343-E387 IonicContact NZ-OE2 3.38Å; K343-E387 PolarHBondContact NZ-OE2 3.45Å; K343-L388 WeakPolarHBondContact CA-O 3.28Å; K343-L388 WeakPolarHBondContact CB-O 3.47Å
344	F	98.3	Very high	97	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	140.7	161	-55.2	-83	0	0	0	109.5	L294 V335 F336 E387 L388 F390 T393 V406 K407 L423 F427	L294-F344 HydrophobicContact CD1-CD1 4.4Å; L294-F344 HydrophobicContact CD1-CE1 3.84Å; V335-F344 HydrophobicContact CG1-CB 4.49Å; V335-F344 HydrophobicContact CG1-CD1 3.66Å; V335-F344 HydrophobicContact CG1-CE1 4.16Å; V335-F344 HydrophobicContact CG1-CG 4.23Å; F336-F344 CarbonylContact O-C 3.58Å; F336-F344 VanDerWaalsContact O-CA 3.23Å; F336-F344 WeakPolarHBondContact O-CA 3.45Å; F336-F344 WeakPolarHBondContact O-CB 3.14Å; F344-E387 CarbonylContact O-C 3.49Å; F344-E387 WeakPolarHBondContact O-CA 3.38Å; F344-E387 WeakPolarHBondContact O-CB 3.31Å; F344-L388 HydrophobicContact CB-CB 4.41Å; F344-L388 HydrophobicContact CD2-CB 4.45Å; F344-L388 HydrophobicContact CD2-CD2 4.44Å; F344-L388 HydrophobicContact CD2-CG 4.46Å; F344-L388 PolarHBondContact N-O 3.13Å; F344-L388 PolarHBondContact O-N 2.95Å; F344-F390 HydrophobicContact CD1-CE1 4.15Å; F344-F390 AromaticContact CD2-CD1 3.8Å; F344-F390 HydrophobicContact CD2-CD1 3.8Å; F344-F390 AromaticContact CD2-CE1 3.83Å; F344-F390 HydrophobicContact CD2-CE1 3.83Å; F344-F390 HydrophobicContact CE1-CE1 4.04Å; F344-F390 AromaticContact CE2-CD1 3.54Å; F344-F390 HydrophobicContact CE2-CD1 3.54Å; F344-F390 AromaticContact CE2-CE1 3.7Å; F344-F390 HydrophobicContact CE2-CE1 3.7Å; F344-F390 HydrophobicContact CG-CD1 4.47Å; F344-F390 HydrophobicContact CG-CE1 4.05Å; F344-F390 HydrophobicContact CZ-CD1 4.04Å; F344-F390 AromaticContact CZ-CE1 3.82Å; F344-F390 HydrophobicContact CZ-CE1 3.82Å; F344-T393 HydrophobicContact CD2-CG2 4.45Å; F344-T393 HydrophobicContact CE2-CG2 3.97Å; F344-V406 HydrophobicContact CZ-CG1 4.41Å; F344-K407 HydrophobicContact CZ-CB 4.36Å; F344-L423 HydrophobicContact CD2-CD1 4.26Å; F344-L423 HydrophobicContact CE1-CD2 4.48Å; F344-L423 HydrophobicContact CE2-CD1 3.85Å; F344-L423 HydrophobicContact CZ-CD1 4.23Å; F344-L423 HydrophobicContact CZ-CD2 4.26Å; F344-F427 HydrophobicContact CB-CE1 4.03Å; F344-F427 HydrophobicContact CB-CZ 3.63Å; F344-F427 HydrophobicContact CG-CZ 4.26Å
345	Q	98.1	Very high	96.7	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.009	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-0.1	-179	-75.5	68.8	36.7	0	0	113.5	V303 K307 F336 V338 S341 K343 R386	V303-Q345 HydrophobicContact CG1-CB 3.81Å; V303-Q345 HydrophobicContact CG1-CG 4.29Å; K307-Q345 WeakPolarHBondContact CE-O 3.5Å; K307-Q345 PolarHBondContact NZ-O 3.01Å; F336-Q345 PolarHBondContact O-N 3.41Å; F336-Q345 PolarHBondContact O-OE1 3.27Å; V338-Q345 HydrophobicContact CG2-CG 4.19Å; S341-Q345 PolarHBondContact OG-NE2 3.02Å; K343-Q345 VanDerWaalsContact CG-NE2 3.29Å; K343-Q345 PolarHBondContact O-NE2 2.68Å; Q345-R386 CarbonylContact C-O 3.6Å
346	G	97.5	Very high	96.2	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.8	-174.9	-177.1	0	0	0	0	0	111.9	F336 C384 R386	F336-G346 PolarHBondContact N-O 2.84Å; G346-C384 CarbonylContact C-O 3.42Å; G346-C384 WeakPolarHBondContact CA-O 3.31Å; G346-R386 WeakPolarHBondContact CA-O 3.15Å; G346-R386 PolarHBondContact N-O 2.94Å
347	F	97.9	Very high	95.2	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.009	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.3	175.8	66.5	-84.6	0	0	0	112.3	L283 L287 I333 L334 V335 L383 C384 C424 F427	L283-F347 HydrophobicContact CD1-CE2 3.85Å; L283-F347 HydrophobicContact CD1-CZ 3.89Å; L283-F347 HydrophobicContact CD2-CZ 4.2Å; L287-F347 HydrophobicContact CD2-CE2 4.49Å; I333-F347 HydrophobicContact CG2-CB 4.31Å; I333-F347 HydrophobicContact CG2-CD2 3.86Å; L334-F347 CarbonylContact O-C 3.54Å; L334-F347 WeakPolarHBondContact O-CA 3.44Å; L334-F347 WeakPolarHBondContact O-CB 3.48Å; V335-F347 HydrophobicContact CB-CB 4.46Å; V335-F347 HydrophobicContact CG2-CB 4.16Å; F347-L383 HydrophobicContact CD2-CB 3.76Å; F347-L383 HydrophobicContact CD2-CD1 4.05Å; F347-L383 HydrophobicContact CE2-CB 3.41Å; F347-L383 VanDerWaalsContact CE2-CB 3.41Å; F347-L383 HydrophobicContact CE2-CD1 3.74Å; F347-L383 HydrophobicContact CE2-CG 4.24Å; F347-L383 HydrophobicContact CZ-CB 4.09Å; F347-L383 PolarHBondContact O-N 2.88Å; F347-C384 HydrophobicContact CD1-CB 3.95Å; F347-C384 HydrophobicContact CE1-CB 3.54Å; F347-C384 HydrophobicContact CZ-CB 4.12Å; F347-C384 PolarHBondContact N-O 2.9Å; F347-C384 PolarHBondContact O-N 2.85Å; F347-C384 VanDerWaalsContact O-N 3.17Å; F347-C424 HydrophobicContact CD2-CB 4.45Å; F347-C424 HydrophobicContact CE1-CB 4.1Å; F347-C424 HydrophobicContact CE2-CB 3.98Å; F347-C424 HydrophobicContact CZ-CB 3.8Å; F347-F427 HydrophobicContact CD1-CB 4.49Å; F347-F427 HydrophobicContact CD1-CD1 4.14Å; F347-F427 AromaticContact CD1-CD2 3.58Å; F347-F427 HydrophobicContact CD1-CD2 3.58Å; F347-F427 HydrophobicContact CD1-CE1 4.26Å; F347-F427 AromaticContact CD1-CE2 3.7Å; F347-F427 HydrophobicContact CD1-CE2 3.7Å; F347-F427 AromaticContact CD1-CG 3.81Å; F347-F427 HydrophobicContact CD1-CG 3.81Å; F347-F427 HydrophobicContact CD1-CZ 4.03Å; F347-F427 HydrophobicContact CE1-CB 3.89Å; F347-F427 HydrophobicContact CE1-CD1 4.36Å; F347-F427 AromaticContact CE1-CD2 3.6Å; F347-F427 HydrophobicContact CE1-CD2 3.6Å; F347-F427 HydrophobicContact CE1-CE2 4.19Å; F347-F427 AromaticContact CE1-CG 3.68Å; F347-F427 HydrophobicContact CE1-CG 3.68Å
348	A	98.1	Very high	94.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	155.2	-177.9	0	0	0	0	0	111	I333 L334 F336 I380 D381 W382	I333-A348 CarbonylContact C-O 3.5Å; I333-A348 WeakPolarHBondContact CA-O 3.29Å; L334-A348 PolarHBondContact N-O 3.03Å; L334-A348 PolarHBondContact O-N 3.34Å; F336-A348 HydrophobicContact CE2-CB 4.01Å; A348-I380 HydrophobicContact CB-CB 4.04Å; A348-I380 HydrophobicContact CB-CD1 3.98Å; A348-I380 HydrophobicContact CB-CG1 4.38Å; A348-D381 CarbonylContact C-O 3.2Å; A348-D381 VanDerWaalsContact CA-O 3.28Å; A348-D381 WeakPolarHBondContact CA-O 3.45Å; A348-D381 WeakPolarHBondContact CB-O 3.48Å; A348-W382 HydrophobicContact CB-CD2 3.97Å; A348-W382 HydrophobicContact CB-CE3 4.2Å; A348-W382 HydrophobicContact CB-CG 4.18Å
349	R	97.2	Very high	93.7	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.019	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	134.9	173.9	171.9	-168.3	170.3	-87.2	-10.1	110	S331 V332 I333 S351 I380 D381 L383	S331-R349 PolarHBondContact OG-NE 2.73Å; V332-R349 CarbonylContact O-C 3.59Å; V332-R349 VanDerWaalsContact O-CA 3.31Å; V332-R349 WeakPolarHBondContact O-CA 3.43Å; I333-R349 HydrophobicContact CD1-CB 3.88Å; I333-R349 HydrophobicContact CD1-CG 4.24Å; R349-S351 PolarHBondContact O-N 2.74Å; R349-I380 CarbonylContact O-C 3.56Å; R349-I380 WeakPolarHBondContact O-CA 3.22Å; R349-D381 HydrophobicContact CB-CB 4.33Å; R349-D381 IonicContact CZ-OD2 3.99Å; R349-D381 PolarHBondContact N-O 2.77Å; R349-D381 IonicContact NH1-OD2 3.13Å; R349-D381 PolarHBondContact NH1-OD2 3.47Å; R349-D381 PolarHBondContact O-N 3.37Å; R349-L383 HydrophobicContact CB-CD1 4.02Å; R349-L383 HydrophobicContact CB-CG 4.32Å
350	L	97.4	Very high	93.2	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	127.1	170.1	-139.4	84.6	0	0	0	110.3	F326 V332 L334 S352 F378 I380	F326-L350 HydrophobicContact CB-CD2 3.77Å; F326-L350 HydrophobicContact CD2-CB 4.05Å; F326-L350 HydrophobicContact CD2-CD2 3.78Å; F326-L350 HydrophobicContact CD2-CG 4.39Å; F326-L350 HydrophobicContact CE2-CB 4.5Å; F326-L350 WeakPolarHBondContact CE2-O 3.32Å; F326-L350 HydrophobicContact CG-CD2 4.02Å; V332-L350 HydrophobicContact CB-CB 3.93Å; V332-L350 HydrophobicContact CG1-CB 4.26Å; V332-L350 PolarHBondContact O-N 3.18Å; L334-L350 HydrophobicContact CD1-CD1 3.76Å; L334-L350 HydrophobicContact CD2-CD1 4.32Å; L334-L350 HydrophobicContact CG-CD1 4.1Å; L350-S352 WeakPolarHBondContact CD2-O 3.46Å; L350-F378 HydrophobicContact CD1-CB 4.17Å; L350-F378 HydrophobicContact CD1-CD1 3.75Å; L350-F378 HydrophobicContact CD1-CE1 4.36Å; L350-F378 HydrophobicContact CD1-CG 4.08Å; L350-F378 HydrophobicContact CD2-CD1 3.69Å; L350-F378 HydrophobicContact CD2-CE1 3.85Å; L350-F378 HydrophobicContact CG-CD1 3.9Å; L350-I380 HydrophobicContact CD1-CG2 4.27Å
351	S	95.1	Very high	93.1	Very high	32 Å²	32	44 Å²	44	22%	0.224	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-21.1	-173.2	80.3	0	0	0	0	114.5	R349 K379 D381	R349-S351 PolarHBondContact O-N 2.74Å; S351-K379 PolarHBondContact N-O 2.95Å; S351-K379 VanDerWaalsContact OG-C 3.25Å; S351-K379 VanDerWaalsContact OG-CB 3.29Å; S351-K379 WeakPolarHBondContact OG-CB 3.21Å; S351-K379 PolarHBondContact OG-O 2.94Å; S351-K379 VanDerWaalsContact OG-O 3.14Å; S351-D381 VanDerWaalsContact CB-OD1 3.29Å; S351-D381 WeakPolarHBondContact CB-OD1 3.43Å; S351-D381 WeakPolarHBondContact CB-OD2 3.47Å; S351-D381 PolarHBondContact OG-OD1 3.14Å
352	S	94.5	Very high	92.9	Very high	15 Å²	15	50.3 Å²	50.3	11%	0.105	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	170.5	161.8	68.8	0	0	0	0	110.6	L350 K379	L350-S352 WeakPolarHBondContact CD2-O 3.46Å; S352-K379 PolarHBondContact N-O 2.94Å; S352-K379 WeakPolarHBondContact OG-CB 3.35Å; S352-K379 PolarHBondContact OG-N 3.46Å; S352-K379 VanDerWaalsContact OG-N 3.16Å
353	E	94.9	Very high	92.8	Very high	67 Å²	67	49.9 Å²	49.9	31%	0.313	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	174.5	155.6	-64.1	178.2	173.9	0	0	109.9	N323 F326 Q327	N323-E353 WeakPolarHBondContact OD1-CA 3.45Å; N323-E353 WeakPolarHBondContact OD1-CB 3.07Å; F326-E353 HydrophobicContact CD1-CG 3.41Å; F326-E353 VanDerWaalsContact CD1-CG 3.41Å; F326-E353 HydrophobicContact CE1-CG 3.83Å; F326-E353 HydrophobicContact CG-CG 4.29Å; Q327-E353 WeakPolarHBondContact CG-OE1 3.18Å; Q327-E353 PolarHBondContact NE2-OE1 3.16Å
354	S	94.6	Very high	92.7	Very high	16 Å²	16	49.6 Å²	49.6	11%	0.112	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	147.8	172	64.8	0	0	0	0	111.8	E319 N323	E319-S354 WeakPolarHBondContact CG-OG 3.3Å; E319-S354 WeakPolarHBondContact OE1-CB 3.29Å; E319-S354 PolarHBondContact OE1-OG 3.36Å; N323-S354 PolarHBondContact ND2-OG 3.4Å; N323-S354 PolarHBondContact OD1-N 2.57Å
355	H	92	Very high	92.4	Very high	82 Å²	82	51.9 Å²	51.9	38%	0.38	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.6	173.6	-60.5	-60.9	0	0	0	110.2	V377	H355-V377 PolarHBondContact N-O 3.42Å; H355-V377 VanDerWaalsContact N-O 3.08Å; H355-V377 PolarHBondContact O-N 2.83Å
356	H	88.1	Confident	92	Very high	131 Å²	131	54.9 Å²	54.9	61%	0.606	31%	0.31	S	S	*	.	S	Bend	trans	-83.3	-31.5	176	-56.7	-78.2	0	0	0	111.9	E319 G358 G376	E319-H356 IonicContact OE1-CE1 2.73Å; E319-H356 PolarHBondContact OE1-CE1 3.33Å; E319-H356 IonicContact OE1-NE2 3.72Å; E319-H356 IonicContact OE2-CE1 3.32Å; H356-G358 PolarHBondContact O-N 2.98Å; H356-G376 PolarHBondContact CE1-N 3.36Å; H356-G376 VanDerWaalsContact CE1-N 3.3Å; H356-G376 WeakPolarHBondContact ND1-CA 3.45Å; H356-G376 PolarHBondContact ND1-N 3.31Å
357	D	77.6	Confident	91.6	Very high	162 Å²	162	60.1 Å²	60.1	87%	0.866	35%	0.352	S	S	*	.	S	Bend	trans	-79.6	32.4	-173.7	-42.6	-73.6	0	0	0	114
358	G	80.3	Confident	91	Very high	40 Å²	40	64 Å²	64	41%	0.412	39%	0.393	S	S	.	.	S	Bend	trans	-93.2	164.2	-179.6	0	0	0	0	0	113.5	H356 P360	H356-G358 PolarHBondContact O-N 2.98Å; G358-P360 WeakPolarHBondContact O-CD 3.41Å
359	S	84.4	Confident	90.7	Very high	107 Å²	107	66.5 Å²	66.5	75%	0.748	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-59.5	126.6	165.1	-52.1	0	0	0	0	109.7	I361	S359-I361 PolarHBondContact O-N 2.61Å
360	P	85.9	Confident	90.2	Very high	110 Å²	110	70 Å²	70	71%	0.714	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-55.4	134.3	-175.4	-29.7	36.2	0	0	0	113.4	G358	G358-P360 WeakPolarHBondContact O-CD 3.41Å
361	I	91.8	Very high	89.7	Confident	28 Å²	28	73.3 Å²	73.3	14%	0.144	45%	0.452	C	S	.	.			trans	-96.6	114.1	172.8	-50	-59	0	0	0	108.4	K309 V311 S359 W363 V377	K309-I361 HydrophobicContact CD-CD1 4.12Å; K309-I361 HydrophobicContact CD-CG2 4.41Å; V311-I361 HydrophobicContact CG2-CD1 4.02Å; V311-I361 HydrophobicContact CG2-CG1 4.11Å; S359-I361 PolarHBondContact O-N 2.61Å; I361-W363 VanDerWaalsContact C-N 3.25Å; I361-W363 HydrophobicContact CB-CD2 4.33Å; I361-W363 HydrophobicContact CB-CZ2 4.21Å; I361-W363 HydrophobicContact CG1-CZ2 4.5Å; I361-W363 HydrophobicContact CG2-CD2 3.61Å; I361-W363 VanDerWaalsContact CG2-CE2 3.43Å; I361-W363 HydrophobicContact CG2-CE3 3.98Å; I361-W363 HydrophobicContact CG2-CG 4.13Å; I361-W363 HydrophobicContact CG2-CH2 4.05Å; I361-W363 HydrophobicContact CG2-CZ2 3.68Å; I361-W363 HydrophobicContact CG2-CZ3 4.18Å; I361-W363 PolarHBondContact O-N 2.96Å; I361-V377 HydrophobicContact CG1-CG1 4.25Å; I361-V377 HydrophobicContact CG1-CG2 4.22Å
362	H	92.4	Very high	89.3	Confident	157 Å²	157	81.1 Å²	81.1	73%	0.727	48%	0.482	S	S	*	.			trans	-68.9	85.1	168.4	-59	-76.8	0	0	0	109.6	L305	L305-H362 WeakPolarHBondContact CD1-O 3.4Å
363	W	94.9	Very high	89	Confident	32 Å²	32	85.2 Å²	85.2	12%	0.121	50%	0.5	C	S	.	.			trans	-76.9	148.7	168.1	-61.7	119.7	0	0	0	110.3	N302 L305 A306 V311 W312 S313 I361 L365 L374	N302-W363 HydrophobicContact CB-CE3 4.22Å; L305-W363 HydrophobicContact CB-CE3 4.33Å; L305-W363 HydrophobicContact CB-CZ3 3.89Å; L305-W363 HydrophobicContact CD1-CE3 4.27Å; A306-W363 HydrophobicContact CB-CH2 4.35Å; A306-W363 HydrophobicContact CB-CZ3 4.45Å; V311-W363 HydrophobicContact CG2-CH2 4.17Å; V311-W363 HydrophobicContact CG2-CZ2 4.23Å; W312-W363 AromaticContact CE3-CH2 3.99Å; W312-W363 HydrophobicContact CE3-CH2 3.99Å; W312-W363 HydrophobicContact CE3-CZ3 4.32Å; W312-W363 HydrophobicContact CZ3-CH2 4.45Å; W312-W363 HydrophobicContact CZ3-CZ3 4.33Å; S313-W363 PolarHBondContact OG-NE1 3.48Å; S313-W363 VanDerWaalsContact OG-NE1 3.11Å; I361-W363 VanDerWaalsContact C-N 3.25Å; I361-W363 HydrophobicContact CB-CD2 4.33Å; I361-W363 HydrophobicContact CB-CZ2 4.21Å; I361-W363 HydrophobicContact CG1-CZ2 4.5Å; I361-W363 HydrophobicContact CG2-CD2 3.61Å; I361-W363 VanDerWaalsContact CG2-CE2 3.43Å; I361-W363 HydrophobicContact CG2-CE3 3.98Å; I361-W363 HydrophobicContact CG2-CG 4.13Å; I361-W363 HydrophobicContact CG2-CH2 4.05Å; I361-W363 HydrophobicContact CG2-CZ2 3.68Å; I361-W363 HydrophobicContact CG2-CZ3 4.18Å; I361-W363 PolarHBondContact O-N 2.96Å; W363-L365 HydrophobicContact CB-CD2 3.75Å; W363-L365 HydrophobicContact CB-CG 4.22Å; W363-L365 PolarHBondContact O-N 3.27Å; W363-L374 VanDerWaalsContact CD1-CD1 3.5Å; W363-L374 HydrophobicContact CG-CD1 4.19Å
364	V	95.1	Very high	88.8	Confident	54 Å²	54	83.3 Å²	83.3	33%	0.327	49%	0.492	S	S	.	.			trans	-88	101.1	174.7	-176.1	0	0	0	0	107.7	E301 N302	E301-V364 HydrophobicContact CB-CG2 4.02Å; N302-V364 PolarHBondContact ND2-O 3.43Å; N302-V364 PolarHBondContact OD1-N 3.3Å
365	L	92.8	Very high	88.6	Confident	48 Å²	48	82.9 Å²	82.9	25%	0.251	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-102.6	149.8	-173.4	-55.5	-177.4	0	0	0	111.6	W363 M369 A371 L374	W363-L365 HydrophobicContact CB-CD2 3.75Å; W363-L365 HydrophobicContact CB-CG 4.22Å; W363-L365 PolarHBondContact O-N 3.27Å; L365-M369 HydrophobicContact CB-CB 4.27Å; L365-M369 HydrophobicContact CD1-CG 4.35Å; L365-M369 HydrophobicContact CD2-SD 4.38Å; L365-A371 HydrophobicContact CD1-CB 4.39Å; L365-L374 HydrophobicContact CD1-CD1 4.45Å; L365-L374 HydrophobicContact CD2-CD1 3.95Å
366	P	90.1	Very high	88.7	Confident	65 Å²	65	79.1 Å²	79.1	42%	0.422	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-59.5	158	170.3	-22.1	33.9	0	0	0	112.5	M369	P366-M369 WeakPolarHBondContact O-CB 3.49Å; P366-M369 PolarHBondContact O-N 3.13Å; P366-M369 VanDerWaalsContact O-N 3.08Å
367	A	87.9	Confident	89.1	Confident	109 Å²	109	74.3 Å²	74.3	90%	0.901	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	142.8	171.2	0	0	0	0	0	111.2	M369	A367-M369 PolarHBondContact O-N 2.87Å
368	G	86.8	Confident	90	Very high	83 Å²	83	66.6 Å²	66.6	86%	0.856	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	-23.6	-173.5	0	0	0	0	0	115.1
369	M	90.4	Very high	90.8	Very high	54 Å²	54	69.9 Å²	69.9	27%	0.266	42%	0.415	S	S	.	.			trans	-89.7	129.6	178.1	-165.4	-179.7	-167.7	0	0	111.7	L315 L365 P366 A367 M373 L374	L315-M369 HydrophobicContact CD2-CE 3.61Å; L365-M369 HydrophobicContact CB-CB 4.27Å; L365-M369 HydrophobicContact CD1-CG 4.35Å; L365-M369 HydrophobicContact CD2-SD 4.38Å; P366-M369 WeakPolarHBondContact O-CB 3.49Å; P366-M369 PolarHBondContact O-N 3.13Å; P366-M369 VanDerWaalsContact O-N 3.08Å; A367-M369 PolarHBondContact O-N 2.87Å; M369-M373 HydrophobicContact CE-CB 4.1Å; M369-M373 HydrophobicContact CG-CB 4.29Å; M369-L374 HydrophobicContact CE-CD2 3.6Å; M369-L374 HydrophobicContact CE-CG 4.07Å
370	N	87.4	Confident	91.4	Very high	78 Å²	78	65.1 Å²	65.1	42%	0.417	38%	0.381	S	S	.	.			trans	-114	160.2	177.4	75	70.3	0	0	0	112	K372 M373	N370-K372 PolarHBondContact O-N 3.48Å; N370-K372 VanDerWaalsContact O-N 3.13Å; N370-K372 WeakPolarHBondContact OD1-CA 3.21Å; N370-K372 VanDerWaalsContact OD1-CB 3.27Å; N370-K372 WeakPolarHBondContact OD1-CB 3.1Å; N370-K372 PolarHBondContact OD1-N 2.93Å; N370-M373 WeakPolarHBondContact ND2-CG 3.46Å; N370-M373 VanDerWaalsContact O-CB 3.28Å; N370-M373 WeakPolarHBondContact O-CB 3.35Å; N370-M373 PolarHBondContact O-N 2.74Å; N370-M373 PolarHBondContact OD1-N 2.74Å
371	A	87.7	Confident	91.9	Very high	69 Å²	69	60.5 Å²	60.5	57%	0.57	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-14.6	-175	0	0	0	0	0	115.1	L365	L365-A371 HydrophobicContact CD1-CB 4.39Å
372	K	86.1	Confident	92.2	Very high	197 Å²	197	59.9 Å²	59.9	86%	0.857	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.5	173.2	-53.1	179.2	178	-179.4	0	113	N370 L374	N370-K372 PolarHBondContact O-N 3.48Å; N370-K372 VanDerWaalsContact O-N 3.13Å; N370-K372 WeakPolarHBondContact OD1-CA 3.21Å; N370-K372 VanDerWaalsContact OD1-CB 3.27Å; N370-K372 WeakPolarHBondContact OD1-CB 3.1Å; N370-K372 PolarHBondContact OD1-N 2.93Å; K372-L374 VanDerWaalsContact C-N 3.26Å
373	M	88.9	Confident	92.3	Very high	100 Å²	100	52.7 Å²	52.7	49%	0.493	31%	0.313	S	S	.	.	S	Bend	trans	-78.4	-13.9	173	-59.8	-91.9	-74.8	0	0	112.1	P316 M369 N370	P316-M373 WeakPolarHBondContact CD-O 3.47Å; M369-M373 HydrophobicContact CE-CB 4.1Å; M369-M373 HydrophobicContact CG-CB 4.29Å; N370-M373 WeakPolarHBondContact ND2-CG 3.46Å; N370-M373 VanDerWaalsContact O-CB 3.28Å; N370-M373 WeakPolarHBondContact O-CB 3.35Å; N370-M373 PolarHBondContact O-N 2.74Å; N370-M373 PolarHBondContact OD1-N 2.74Å
374	L	90.4	Very high	92.4	Very high	27 Å²	27	51.4 Å²	51.4	14%	0.141	31%	0.309	C	S	.	.	S	Bend	trans	-86.4	148.5	171.4	-68	176.6	0	0	0	110.4	W363 L365 M369 K372	W363-L374 VanDerWaalsContact CD1-CD1 3.5Å; W363-L374 HydrophobicContact CG-CD1 4.19Å; L365-L374 HydrophobicContact CD1-CD1 4.45Å; L365-L374 HydrophobicContact CD2-CD1 3.95Å; M369-L374 HydrophobicContact CE-CD2 3.6Å; M369-L374 HydrophobicContact CE-CG 4.07Å; K372-L374 VanDerWaalsContact C-N 3.26Å
375	G	90.9	Very high	92.4	Very high	8 Å²	8	53.3 Å²	53.3	8%	0.082	31%	0.311	C	S	.	.			trans	-68.5	-177.3	167.9	0	0	0	0	0	113.2	T314 E319	T314-G375 PolarHBondContact O-N 3.1Å; E319-G375 WeakPolarHBondContact OE2-CA 3.13Å
376	G	93.2	Very high	92.6	Very high	2 Å²	2	57.2 Å²	57.2	2%	0.021	32%	0.322	C	S	.	.			trans	-59.9	163.9	177.7	0	0	0	0	0	113.7	E319 H356 F378	E319-G376 VanDerWaalsContact CD-N 3.35Å; E319-G376 WeakPolarHBondContact OE1-CA 2.99Å; E319-G376 PolarHBondContact OE1-N 3.17Å; E319-G376 PolarHBondContact OE2-N 3.38Å; H356-G376 PolarHBondContact CE1-N 3.36Å; H356-G376 VanDerWaalsContact CE1-N 3.3Å; H356-G376 WeakPolarHBondContact ND1-CA 3.45Å; H356-G376 PolarHBondContact ND1-N 3.31Å; G376-F378 PolarHBondContact O-N 3.22Å
377	V	95.9	Very high	92.9	Very high	30 Å²	30	57.8 Å²	57.8	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	115.2	-177.6	-173.8	0	0	0	0	109.8	V311 H355 I361	V311-V377 HydrophobicContact CB-CG1 3.65Å; V311-V377 HydrophobicContact CG1-CG1 3.91Å; V311-V377 HydrophobicContact CG2-CG1 4.22Å; H355-V377 PolarHBondContact N-O 3.42Å; H355-V377 VanDerWaalsContact N-O 3.08Å; H355-V377 PolarHBondContact O-N 2.83Å; I361-V377 HydrophobicContact CG1-CG1 4.25Å; I361-V377 HydrophobicContact CG1-CG2 4.22Å
378	F	96.9	Very high	93.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	138.9	168.8	-67.4	-86.2	0	0	0	110.5	V311 W312 T314 E319 L322 N323 L350 G376 I380	V311-F378 CarbonylContact C-O 3.5Å; V311-F378 WeakPolarHBondContact CA-O 3.47Å; V311-F378 WeakPolarHBondContact CB-O 3.23Å; W312-F378 PolarHBondContact N-O 3.09Å; W312-F378 PolarHBondContact O-N 3.13Å; T314-F378 HydrophobicContact CG2-CE2 4.25Å; E319-F378 HydrophobicContact CB-CE2 4.24Å; E319-F378 HydrophobicContact CB-CZ 4.28Å; E319-F378 HydrophobicContact CG-CE2 4.15Å; E319-F378 HydrophobicContact CG-CZ 3.97Å; L322-F378 HydrophobicContact CB-CE1 3.94Å; L322-F378 HydrophobicContact CB-CZ 3.72Å; L322-F378 HydrophobicContact CD1-CE2 4.23Å; L322-F378 HydrophobicContact CD1-CZ 4.22Å; N323-F378 VanDerWaalsContact OD1-CE1 3.23Å; N323-F378 WeakPolarHBondContact OD1-CE1 3.28Å; L350-F378 HydrophobicContact CD1-CB 4.17Å; L350-F378 HydrophobicContact CD1-CD1 3.75Å; L350-F378 HydrophobicContact CD1-CE1 4.36Å; L350-F378 HydrophobicContact CD1-CG 4.08Å; L350-F378 HydrophobicContact CD2-CD1 3.69Å; L350-F378 HydrophobicContact CD2-CE1 3.85Å; L350-F378 HydrophobicContact CG-CD1 3.9Å; G376-F378 PolarHBondContact O-N 3.22Å; F378-I380 HydrophobicContact CB-CG2 4.48Å
379	K	96.6	Very high	93.9	Very high	110 Å²	110	51.4 Å²	51.4	48%	0.478	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	136.9	164.2	-62.6	167.8	-174.8	160.8	0	109.1	S351 S352	S351-K379 PolarHBondContact N-O 2.95Å; S351-K379 VanDerWaalsContact OG-C 3.25Å; S351-K379 VanDerWaalsContact OG-CB 3.29Å; S351-K379 WeakPolarHBondContact OG-CB 3.21Å; S351-K379 PolarHBondContact OG-O 2.94Å; S351-K379 VanDerWaalsContact OG-O 3.14Å; S352-K379 PolarHBondContact N-O 2.94Å; S352-K379 WeakPolarHBondContact OG-CB 3.35Å; S352-K379 PolarHBondContact OG-N 3.46Å; S352-K379 VanDerWaalsContact OG-N 3.16Å
380	I	97.3	Very high	94.3	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.8	-176.6	61.8	167.2	0	0	0	112.5	A306 G310 W312 L334 F336 A348 R349 L350 F378 W382	A306-I380 HydrophobicContact CB-CD1 4.45Å; G310-I380 VanDerWaalsContact C-CG1 3.49Å; G310-I380 PolarHBondContact O-N 2.73Å; W312-I380 HydrophobicContact CB-CD1 4.28Å; W312-I380 HydrophobicContact CB-CG2 4.28Å; L334-I380 HydrophobicContact CD1-CG2 4.18Å; F336-I380 HydrophobicContact CE2-CD1 4.24Å; F336-I380 HydrophobicContact CZ-CD1 3.89Å; A348-I380 HydrophobicContact CB-CB 4.04Å; A348-I380 HydrophobicContact CB-CD1 3.98Å; A348-I380 HydrophobicContact CB-CG1 4.38Å; R349-I380 CarbonylContact O-C 3.56Å; R349-I380 WeakPolarHBondContact O-CA 3.22Å; L350-I380 HydrophobicContact CD1-CG2 4.27Å; F378-I380 HydrophobicContact CB-CG2 4.48Å; I380-W382 HydrophobicContact CD1-CZ2 3.95Å
381	D	96.8	Very high	94.8	Very high	14 Å²	14	53.5 Å²	53.5	8%	0.075	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	103.6	173.9	-56.6	-35.7	0	0	0	109	A348 R349 S351 L383 V438 R441	A348-D381 CarbonylContact C-O 3.2Å; A348-D381 VanDerWaalsContact CA-O 3.28Å; A348-D381 WeakPolarHBondContact CA-O 3.45Å; A348-D381 WeakPolarHBondContact CB-O 3.48Å; R349-D381 HydrophobicContact CB-CB 4.33Å; R349-D381 IonicContact CZ-OD2 3.99Å; R349-D381 PolarHBondContact N-O 2.77Å; R349-D381 IonicContact NH1-OD2 3.13Å; R349-D381 PolarHBondContact NH1-OD2 3.47Å; R349-D381 PolarHBondContact O-N 3.37Å; S351-D381 VanDerWaalsContact CB-OD1 3.29Å; S351-D381 WeakPolarHBondContact CB-OD1 3.43Å; S351-D381 WeakPolarHBondContact CB-OD2 3.47Å; S351-D381 PolarHBondContact OG-OD1 3.14Å; D381-L383 PolarHBondContact O-N 2.81Å; D381-V438 HydrophobicContact CB-CG1 3.88Å; D381-V438 HydrophobicContact CB-CG2 3.87Å; D381-R441 VanDerWaalsContact CG-NH2 3.33Å; D381-R441 IonicContact OD1-CZ 3.18Å; D381-R441 IonicContact OD1-NH1 3.64Å; D381-R441 PolarHBondContact OD1-NH1 2.97Å; D381-R441 IonicContact OD1-NH2 3.98Å; D381-R441 PolarHBondContact OD1-NH2 2.77Å; D381-R441 IonicContact OD2-CZ 3.31Å; D381-R441 IonicContact OD2-NH1 2.67Å; D381-R441 PolarHBondContact OD2-NH1 3.27Å; D381-R441 IonicContact OD2-NH2 2.79Å
382	W	97	Very high	95.2	Very high	14 Å²	14	56.2 Å²	56.2	5%	0.053	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	134.4	173.7	-73.1	85.3	0	0	0	110.7	V303 A306 K307 F336 A348 I380 R385 V433	V303-W382 HydrophobicContact CG1-CH2 4.34Å; A306-W382 HydrophobicContact CB-CZ2 4.06Å; A306-W382 PolarHBondContact O-NE1 3.18Å; K307-W382 HydrophobicContact CB-CZ2 4.33Å; K307-W382 HydrophobicContact CD-CH2 4.47Å; K307-W382 HydrophobicContact CG-CD2 4.09Å; K307-W382 HydrophobicContact CG-CE3 4.2Å; K307-W382 HydrophobicContact CG-CH2 3.65Å; K307-W382 HydrophobicContact CG-CZ2 3.5Å; K307-W382 HydrophobicContact CG-CZ3 3.99Å; F336-W382 HydrophobicContact CB-CH2 4.48Å; F336-W382 AromaticContact CD2-CH2 3.56Å; F336-W382 HydrophobicContact CD2-CH2 3.56Å; F336-W382 HydrophobicContact CD2-CZ2 4.29Å; F336-W382 AromaticContact CD2-CZ3 3.97Å; F336-W382 HydrophobicContact CD2-CZ3 3.97Å; F336-W382 AromaticContact CE2-CH2 3.85Å; F336-W382 HydrophobicContact CE2-CH2 3.85Å; F336-W382 HydrophobicContact CE2-CZ2 4.13Å; F336-W382 HydrophobicContact CE2-CZ3 4.41Å; F336-W382 AromaticContact CG-CH2 3.93Å; F336-W382 HydrophobicContact CG-CH2 3.93Å; F336-W382 HydrophobicContact CZ-CH2 4.44Å; F336-W382 HydrophobicContact CZ-CZ2 4.43Å; A348-W382 HydrophobicContact CB-CD2 3.97Å; A348-W382 HydrophobicContact CB-CE3 4.2Å; A348-W382 HydrophobicContact CB-CG 4.18Å; I380-W382 HydrophobicContact CD1-CZ2 3.95Å; W382-R385 HydrophobicContact CB-CG 3.86Å; W382-R385 HydrophobicContact CD2-CG 4.02Å; W382-R385 HydrophobicContact CE3-CG 3.89Å; W382-R385 HydrophobicContact CG-CG 4.01Å; W382-V433 WeakPolarHBondContact O-CG1 3.29Å
383	L	95.6	Very high	95.7	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	-33.1	177.9	-71.9	178.3	0	0	0	111.6	L283 I286 I333 F347 R349 D381 V438	L283-L383 HydrophobicContact CD1-CB 4.49Å; L283-L383 HydrophobicContact CD1-CD1 4.22Å; I286-L383 HydrophobicContact CD1-CD2 3.89Å; I286-L383 HydrophobicContact CG2-CD1 3.98Å; I333-L383 HydrophobicContact CD1-CD1 3.87Å; F347-L383 HydrophobicContact CD2-CB 3.76Å; F347-L383 HydrophobicContact CD2-CD1 4.05Å; F347-L383 HydrophobicContact CE2-CB 3.41Å; F347-L383 VanDerWaalsContact CE2-CB 3.41Å; F347-L383 HydrophobicContact CE2-CD1 3.74Å; F347-L383 HydrophobicContact CE2-CG 4.24Å; F347-L383 HydrophobicContact CZ-CB 4.09Å; F347-L383 PolarHBondContact O-N 2.88Å; R349-L383 HydrophobicContact CB-CD1 4.02Å; R349-L383 HydrophobicContact CB-CG 4.32Å; D381-L383 PolarHBondContact O-N 2.81Å; L383-V438 HydrophobicContact CD2-CB 4.1Å; L383-V438 HydrophobicContact CD2-CG1 3.9Å; L383-V438 HydrophobicContact CD2-CG2 4.22Å
384	C	96.1	Very high	96.1	Very high	5 Å²	5	45 Å²	45	3%	0.034	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	130.6	163.5	-179.3	0	0	0	0	109	G346 F347 R386 F427 P428 D430	G346-C384 CarbonylContact C-O 3.42Å; G346-C384 WeakPolarHBondContact CA-O 3.31Å; F347-C384 HydrophobicContact CD1-CB 3.95Å; F347-C384 HydrophobicContact CE1-CB 3.54Å; F347-C384 HydrophobicContact CZ-CB 4.12Å; F347-C384 PolarHBondContact N-O 2.9Å; F347-C384 PolarHBondContact O-N 2.85Å; F347-C384 VanDerWaalsContact O-N 3.17Å; C384-R386 PolarHBondContact SG-N 2.79Å; C384-R386 VanDerWaalsContact SG-N 3.42Å; C384-F427 HydrophobicContact CB-CB 4.46Å; C384-P428 PolarHBondContact SG-O 3.39Å; C384-D430 HydrophobicContact CB-CB 4.37Å
385	R	96.1	Very high	96.4	Very high	94 Å²	94	49.2 Å²	49.2	36%	0.355	24%	0.239	S	C	.	.			trans	-102.3	-2.9	176.3	-64.6	169.6	156.8	166.1	-10.6	112.6	K307 W382 D430 V433	K307-R385 HydrophobicContact CD-CB 4.4Å; K307-R385 HydrophobicContact CG-CG 4.47Å; K307-R385 PolarHBondContact NZ-O 2.85Å; K307-R385 PolarHBondContact O-NH2 2.79Å; W382-R385 HydrophobicContact CB-CG 3.86Å; W382-R385 HydrophobicContact CD2-CG 4.02Å; W382-R385 HydrophobicContact CE3-CG 3.89Å; W382-R385 HydrophobicContact CG-CG 4.01Å; R385-D430 WeakPolarHBondContact CA-OD2 3.49Å; R385-D430 WeakPolarHBondContact CB-OD2 3.3Å; R385-D430 PolarHBondContact N-OD2 2.89Å; R385-V433 HydrophobicContact CG-CG2 4.36Å
386	R	96.7	Very high	96.7	Very high	129 Å²	129	49.1 Å²	49.1	49%	0.487	24%	0.237	S	C	.	.	S	Bend	trans	-76.6	155.8	174.6	-57.2	-178.1	69	173.8	2.8	110.6	Q345 G346 C384 L429 D430	Q345-R386 CarbonylContact C-O 3.6Å; G346-R386 WeakPolarHBondContact CA-O 3.15Å; G346-R386 PolarHBondContact N-O 2.94Å; C384-R386 PolarHBondContact SG-N 2.79Å; C384-R386 VanDerWaalsContact SG-N 3.42Å; R386-L429 WeakPolarHBondContact CD-O 3.27Å; R386-L429 PolarHBondContact NH1-O 2.96Å; R386-D430 HydrophobicContact CG-CB 4.09Å
387	E	97.3	Very high	96.9	Very high	77 Å²	77	54.1 Å²	54.1	36%	0.36	26%	0.258	S	S	.	.			trans	-87.6	155.1	-179.5	-51.6	-166.6	120.4	0	0	112.2	K343 F344	K343-E387 HydrophobicContact CD-CB 4.36Å; K343-E387 WeakPolarHBondContact CD-OE2 3.46Å; K343-E387 VanDerWaalsContact CE-CD 3.47Å; K343-E387 WeakPolarHBondContact CE-OE1 3.43Å; K343-E387 VanDerWaalsContact CE-OE2 3.25Å; K343-E387 WeakPolarHBondContact CE-OE2 3.3Å; K343-E387 IonicContact NZ-OE1 2.73Å; K343-E387 PolarHBondContact NZ-OE1 3.42Å; K343-E387 IonicContact NZ-OE2 3.38Å; K343-E387 PolarHBondContact NZ-OE2 3.45Å; F344-E387 CarbonylContact O-C 3.49Å; F344-E387 WeakPolarHBondContact O-CA 3.38Å; F344-E387 WeakPolarHBondContact O-CB 3.31Å
388	L	97.8	Very high	97	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	107.3	174.6	177.9	60.8	0	0	0	109.5	K343 F344 K392 T393 L423 L426 F427	K343-L388 WeakPolarHBondContact CA-O 3.28Å; K343-L388 WeakPolarHBondContact CB-O 3.47Å; F344-L388 HydrophobicContact CB-CB 4.41Å; F344-L388 HydrophobicContact CD2-CB 4.45Å; F344-L388 HydrophobicContact CD2-CD2 4.44Å; F344-L388 HydrophobicContact CD2-CG 4.46Å; F344-L388 PolarHBondContact N-O 3.13Å; F344-L388 PolarHBondContact O-N 2.95Å; L388-K392 HydrophobicContact CD1-CB 3.82Å; L388-K392 HydrophobicContact CD1-CD 4.24Å; L388-T393 HydrophobicContact CD2-CG2 3.63Å; L388-T393 HydrophobicContact CG-CG2 3.99Å; L388-L423 HydrophobicContact CD2-CD1 3.93Å; L388-L426 HydrophobicContact CD1-CB 4.32Å; L388-L426 WeakPolarHBondContact CD1-O 3.49Å; L388-L426 HydrophobicContact CD2-CB 3.84Å; L388-F427 HydrophobicContact CB-CD1 3.7Å; L388-F427 HydrophobicContact CB-CD2 4.47Å; L388-F427 HydrophobicContact CB-CE1 3.52Å; L388-F427 HydrophobicContact CB-CE2 4.35Å; L388-F427 HydrophobicContact CB-CG 4.18Å; L388-F427 HydrophobicContact CB-CZ 3.9Å; L388-F427 HydrophobicContact CD2-CD1 4.38Å; L388-F427 HydrophobicContact CD2-CD2 3.67Å; L388-F427 HydrophobicContact CD2-CE1 4.34Å; L388-F427 HydrophobicContact CD2-CE2 3.65Å; L388-F427 HydrophobicContact CD2-CG 4.06Å; L388-F427 HydrophobicContact CD2-CZ 4Å
389	P	98.1	Very high	97.1	Very high	57 Å²	57	55.4 Å²	55.4	37%	0.37	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	141.2	177.3	-25.3	35.8	0	0	0	112.9	I391 K392	P389-I391 HydrophobicContact CB-CG1 4.17Å; P389-I391 PolarHBondContact O-N 2.86Å; P389-I391 VanDerWaalsContact O-N 3.17Å; P389-K392 PolarHBondContact O-N 2.71Å
390	F	97.9	Very high	97.1	Very high	37 Å²	37	56 Å²	56	16%	0.162	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-60.7	-28.5	-175	-68.1	-25.9	0	0	0	114.2	S337 G342 F344 K392 T393 A394 K407	S337-F390 WeakPolarHBondContact OG-CZ 3.41Å; G342-F390 WeakPolarHBondContact O-CB 3.42Å; G342-F390 VanDerWaalsContact O-CD2 3.32Å; G342-F390 WeakPolarHBondContact O-CD2 3.21Å; G342-F390 WeakPolarHBondContact O-CG 3.44Å; G342-F390 PolarHBondContact O-N 2.84Å; F344-F390 HydrophobicContact CD1-CE1 4.15Å; F344-F390 AromaticContact CD2-CD1 3.8Å; F344-F390 HydrophobicContact CD2-CD1 3.8Å; F344-F390 AromaticContact CD2-CE1 3.83Å; F344-F390 HydrophobicContact CD2-CE1 3.83Å; F344-F390 HydrophobicContact CE1-CE1 4.04Å; F344-F390 AromaticContact CE2-CD1 3.54Å; F344-F390 HydrophobicContact CE2-CD1 3.54Å; F344-F390 AromaticContact CE2-CE1 3.7Å; F344-F390 HydrophobicContact CE2-CE1 3.7Å; F344-F390 HydrophobicContact CG-CD1 4.47Å; F344-F390 HydrophobicContact CG-CE1 4.05Å; F344-F390 HydrophobicContact CZ-CD1 4.04Å; F344-F390 AromaticContact CZ-CE1 3.82Å; F344-F390 HydrophobicContact CZ-CE1 3.82Å; F390-K392 PolarHBondContact O-N 3.45Å; F390-T393 WeakPolarHBondContact CA-OG1 3.36Å; F390-T393 CarbonylContact O-C 3.45Å; F390-T393 WeakPolarHBondContact O-CA 3.43Å; F390-T393 PolarHBondContact O-N 2.86Å; F390-T393 PolarHBondContact O-OG1 3.03Å; F390-A394 PolarHBondContact O-N 2.84Å; F390-K407 HydrophobicContact CB-CB 4.45Å; F390-K407 HydrophobicContact CB-CD 4.01Å; F390-K407 HydrophobicContact CD1-CB 3.76Å; F390-K407 HydrophobicContact CD2-CB 4.09Å; F390-K407 HydrophobicContact CD2-CD 4.06Å; F390-K407 HydrophobicContact CE1-CB 3.91Å; F390-K407 HydrophobicContact CE2-CB 4.24Å; F390-K407 HydrophobicContact CG-CB 3.86Å; F390-K407 HydrophobicContact CG-CD 4.1Å; F390-K407 HydrophobicContact CZ-CB 4.16Å
391	I	97.3	Very high	97.1	Very high	138 Å²	138	56.8 Å²	56.8	71%	0.708	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-57	-34	175.7	64.6	94.5	0	0	0	111.8	P389 T393 A394	P389-I391 HydrophobicContact CB-CG1 4.17Å; P389-I391 PolarHBondContact O-N 2.86Å; P389-I391 VanDerWaalsContact O-N 3.17Å; I391-T393 PolarHBondContact O-N 2.95Å; I391-A394 PolarHBondContact O-N 3.39Å
392	K	97.1	Very high	97.1	Very high	126 Å²	126	61.4 Å²	61.4	55%	0.548	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-73.8	-7.5	176.9	-60.8	-162.5	174.9	-166.8	0	113.5	L388 P389 F390 H395	L388-K392 HydrophobicContact CD1-CB 3.82Å; L388-K392 HydrophobicContact CD1-CD 4.24Å; P389-K392 PolarHBondContact O-N 2.71Å; F390-K392 PolarHBondContact O-N 3.45Å; K392-H395 PolarHBondContact O-CE1 3.46Å; K392-H395 VanDerWaalsContact O-CE1 3.24Å
393	T	97.1	Very high	97.1	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.012	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-119.6	8.8	-177.5	60.3	0	0	0	0	113.1	F344 L388 F390 I391 H395 L396 L423 L426	F344-T393 HydrophobicContact CD2-CG2 4.45Å; F344-T393 HydrophobicContact CE2-CG2 3.97Å; L388-T393 HydrophobicContact CD2-CG2 3.63Å; L388-T393 HydrophobicContact CG-CG2 3.99Å; F390-T393 WeakPolarHBondContact CA-OG1 3.36Å; F390-T393 CarbonylContact O-C 3.45Å; F390-T393 WeakPolarHBondContact O-CA 3.43Å; F390-T393 PolarHBondContact O-N 2.86Å; F390-T393 PolarHBondContact O-OG1 3.03Å; I391-T393 PolarHBondContact O-N 2.95Å; T393-H395 PolarHBondContact O-N 3.36Å; T393-L396 PolarHBondContact O-N 2.89Å; T393-L423 HydrophobicContact CG2-CD1 3.53Å; T393-L426 HydrophobicContact CG2-CD1 4.03Å
394	A	96.1	Very high	97.2	Very high	59 Å²	59	69.8 Å²	69.8	49%	0.488	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.7	-178.3	0	0	0	0	0	113.3	F390 I391 L396	F390-A394 PolarHBondContact O-N 2.84Å; I391-A394 PolarHBondContact O-N 3.39Å; A394-L396 VanDerWaalsContact C-N 3.26Å; A394-L396 PolarHBondContact O-N 2.63Å
395	H	96.7	Very high	97.3	Very high	116 Å²	116	71.5 Å²	71.5	54%	0.537	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.6	176.9	66.1	-93.6	0	0	0	114.5	K392 T393	K392-H395 PolarHBondContact O-CE1 3.46Å; K392-H395 VanDerWaalsContact O-CE1 3.24Å; T393-H395 PolarHBondContact O-N 3.36Å
396	L	97.5	Very high	97.4	Very high	6 Å²	6	67.1 Å²	67.1	3%	0.031	33%	0.332	C	S	.	.			trans	-106.9	116.2	-179.9	-65.9	-174.7	0	0	0	111.2	T393 A394 P405 V406 V419 Q422 L423 L426	T393-L396 PolarHBondContact O-N 2.89Å; A394-L396 VanDerWaalsContact C-N 3.26Å; A394-L396 PolarHBondContact O-N 2.63Å; L396-P405 CarbonylContact O-C 3.48Å; L396-V406 HydrophobicContact CB-CB 4.21Å; L396-V406 HydrophobicContact CB-CG1 3.62Å; L396-V406 HydrophobicContact CD1-CG1 4.39Å; L396-V406 WeakPolarHBondContact O-CB 3.48Å; L396-V406 PolarHBondContact O-N 3.49Å; L396-V419 HydrophobicContact CB-CG1 4.34Å; L396-Q422 HydrophobicContact CD1-CB 4.35Å; L396-Q422 HydrophobicContact CD2-CB 3.99Å; L396-L423 HydrophobicContact CD1-CB 3.84Å; L396-L423 HydrophobicContact CD1-CD1 4.24Å; L396-L426 HydrophobicContact CD1-CD1 3.56Å; L396-L426 HydrophobicContact CG-CD1 4.26Å
397	F	98.1	Very high	97.3	Very high	107 Å²	107	65 Å²	65	47%	0.469	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-112.7	148.1	178.9	-59.5	-85.5	0	0	0	109.5	P399 N403 P405 V419	F397-P399 WeakPolarHBondContact O-CD 3.33Å; F397-N403 WeakPolarHBondContact CB-O 3.25Å; F397-N403 VanDerWaalsContact CD1-O 3.3Å; F397-N403 WeakPolarHBondContact CD1-O 3.44Å; F397-P405 HydrophobicContact CD1-CB 4.44Å; F397-P405 HydrophobicContact CD1-CG 4.09Å; F397-P405 HydrophobicContact CE1-CG 3.93Å; F397-V419 WeakPolarHBondContact O-CG1 3.49Å; F397-V419 VanDerWaalsContact O-CG2 3.32Å; F397-V419 WeakPolarHBondContact O-CG2 3.31Å
398	N	98	Very high	97.3	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.011	33%	0.33	C	S	.	.			trans	-110.4	106	-177	-176.7	26.4	0	0	0	112	W400 N401 N403 K404 E414 Q416	N398-W400 PolarHBondContact O-N 2.7Å; N398-W400 PolarHBondContact OD1-N 2.88Å; N398-N401 HydrophobicContact CB-CB 4.28Å; N398-N401 WeakPolarHBondContact ND2-CB 3.18Å; N398-N401 CarbonylContact O-C 3.49Å; N398-N401 PolarHBondContact O-N 3.06Å; N398-N403 WeakPolarHBondContact O-CA 3.49Å; N398-N403 PolarHBondContact O-N 3.46Å; N398-N403 VanDerWaalsContact O-N 3.13Å; N398-K404 PolarHBondContact N-O 3.24Å; N398-E414 PolarHBondContact ND2-O 3.03Å; N398-Q416 PolarHBondContact OD1-N 3.16Å
399	P	97.9	Very high	97.2	Very high	55 Å²	55	66.3 Å²	66.3	36%	0.357	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-6.3	177.2	-23.3	34.3	0	0	0	115.3	F397 N403	F397-P399 WeakPolarHBondContact O-CD 3.33Å; P399-N403 VanDerWaalsContact CA-OD1 3.3Å; P399-N403 WeakPolarHBondContact CA-OD1 3.5Å; P399-N403 WeakPolarHBondContact CB-OD1 3.14Å; P399-N403 WeakPolarHBondContact CG-OD1 3.49Å
400	W	97.3	Very high	97.1	Very high	122 Å²	122	73.9 Å²	73.9	46%	0.462	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	13.9	172.6	-64.3	-8.9	0	0	0	113.1	N398 Q413 E414 Q416 P417	N398-W400 PolarHBondContact O-N 2.7Å; N398-W400 PolarHBondContact OD1-N 2.88Å; W400-Q413 PolarHBondContact O-NE2 3.29Å; W400-E414 HydrophobicContact CE3-CB 4.25Å; W400-E414 HydrophobicContact CE3-CG 3.9Å; W400-E414 HydrophobicContact CZ3-CG 3.85Å; W400-Q416 HydrophobicContact CD2-CB 3.92Å; W400-Q416 HydrophobicContact CD2-CG 4.25Å; W400-Q416 HydrophobicContact CE3-CB 4.34Å; W400-Q416 HydrophobicContact CG-CB 4.13Å; W400-Q416 HydrophobicContact CZ2-CG 4.14Å; W400-P417 HydrophobicContact CH2-CG 4.1Å; W400-P417 HydrophobicContact CZ3-CG 4.47Å
401	N	97.3	Very high	97	Very high	23 Å²	23	74 Å²	74	12%	0.123	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.4	57.5	173.9	-172.4	54.7	0	0	0	108.2	N398 N403 K404 I408 Q413	N398-N401 HydrophobicContact CB-CB 4.28Å; N398-N401 WeakPolarHBondContact ND2-CB 3.18Å; N398-N401 CarbonylContact O-C 3.49Å; N398-N401 PolarHBondContact O-N 3.06Å; N401-N403 PolarHBondContact O-N 2.88Å; N401-N403 VanDerWaalsContact O-N 3.1Å; N401-K404 VanDerWaalsContact O-CB 3.22Å; N401-K404 WeakPolarHBondContact O-CB 3.17Å; N401-K404 WeakPolarHBondContact O-CG 3.35Å; N401-K404 PolarHBondContact O-N 2.87Å; N401-I408 PolarHBondContact ND2-O 3.01Å; N401-I408 VanDerWaalsContact ND2-O 3.13Å; N401-Q413 HydrophobicContact CB-CG 4.31Å
402	D	96.9	Very high	97	Very high	112 Å²	112	67.8 Å²	67.8	60%	0.599	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	30.6	174.3	-32.3	-40.9	0	0	0	114.9	K404	D402-K404 HydrophobicContact CB-CD 4.04Å; D402-K404 HydrophobicContact CB-CG 4.31Å; D402-K404 PolarHBondContact O-N 3.47Å; D402-K404 VanDerWaalsContact O-N 3.09Å; D402-K404 WeakPolarHBondContact OD2-CE 3.25Å; D402-K404 IonicContact OD2-NZ 3.56Å; D402-K404 PolarHBondContact OD2-NZ 3.33Å
403	N	96.6	Very high	97	Very high	100 Å²	100	63.9 Å²	63.9	54%	0.535	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	17	-169.5	-60.7	-62.9	0	0	0	114.7	F397 N398 P399 N401	F397-N403 WeakPolarHBondContact CB-O 3.25Å; F397-N403 VanDerWaalsContact CD1-O 3.3Å; F397-N403 WeakPolarHBondContact CD1-O 3.44Å; N398-N403 WeakPolarHBondContact O-CA 3.49Å; N398-N403 PolarHBondContact O-N 3.46Å; N398-N403 VanDerWaalsContact O-N 3.13Å; P399-N403 VanDerWaalsContact CA-OD1 3.3Å; P399-N403 WeakPolarHBondContact CA-OD1 3.5Å; P399-N403 WeakPolarHBondContact CB-OD1 3.14Å; P399-N403 WeakPolarHBondContact CG-OD1 3.49Å; N401-N403 PolarHBondContact O-N 2.88Å; N401-N403 VanDerWaalsContact O-N 3.1Å
404	K	97.7	Very high	97	Very high	96 Å²	96	65.5 Å²	65.5	42%	0.417	32%	0.324	S	S	.	.			trans	-63.4	150	175.3	-66.9	158.8	178.9	162.6	0	110.2	N398 N401 D402 I408	N398-K404 PolarHBondContact N-O 3.24Å; N401-K404 VanDerWaalsContact O-CB 3.22Å; N401-K404 WeakPolarHBondContact O-CB 3.17Å; N401-K404 WeakPolarHBondContact O-CG 3.35Å; N401-K404 PolarHBondContact O-N 2.87Å; D402-K404 HydrophobicContact CB-CD 4.04Å; D402-K404 HydrophobicContact CB-CG 4.31Å; D402-K404 PolarHBondContact O-N 3.47Å; D402-K404 VanDerWaalsContact O-N 3.09Å; D402-K404 WeakPolarHBondContact OD2-CE 3.25Å; D402-K404 IonicContact OD2-NZ 3.56Å; D402-K404 PolarHBondContact OD2-NZ 3.33Å; K404-I408 HydrophobicContact CB-CB 4.48Å
405	P	97.7	Very high	97.1	Very high	41 Å²	41	62.8 Å²	62.8	27%	0.266	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-55.1	140.9	-179.9	-25.6	33.4	0	0	0	112	L396 F397 K407 I408	L396-P405 CarbonylContact O-C 3.48Å; F397-P405 HydrophobicContact CD1-CB 4.44Å; F397-P405 HydrophobicContact CD1-CG 4.09Å; F397-P405 HydrophobicContact CE1-CG 3.93Å; P405-K407 HydrophobicContact CB-CG 4.19Å; P405-K407 PolarHBondContact O-N 3.15Å; P405-I408 HydrophobicContact CB-CG1 4.35Å; P405-I408 WeakPolarHBondContact O-CA 3.29Å; P405-I408 WeakPolarHBondContact O-CB 3.3Å; P405-I408 PolarHBondContact O-N 3.33Å
406	V	97.7	Very high	97.2	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.018	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-11.7	-169.1	78	0	0	0	0	114.7	F344 L396 I408 I415 V419 L423	F344-V406 HydrophobicContact CZ-CG1 4.41Å; L396-V406 HydrophobicContact CB-CB 4.21Å; L396-V406 HydrophobicContact CB-CG1 3.62Å; L396-V406 HydrophobicContact CD1-CG1 4.39Å; L396-V406 WeakPolarHBondContact O-CB 3.48Å; L396-V406 PolarHBondContact O-N 3.49Å; V406-I408 VanDerWaalsContact C-N 3.32Å; V406-I415 HydrophobicContact CG2-CD1 3.97Å; V406-I415 HydrophobicContact CG2-CG1 4.28Å; V406-I415 HydrophobicContact CG2-CG2 3.92Å; V406-V419 HydrophobicContact CB-CG1 4.41Å; V406-V419 HydrophobicContact CG2-CG1 4.05Å; V406-L423 HydrophobicContact CG1-CD1 4.3Å; V406-L423 HydrophobicContact CG1-CD2 4.18Å; V406-L423 HydrophobicContact CG2-CD2 3.89Å
407	K	96	Very high	97.1	Very high	85 Å²	85	61.5 Å²	61.5	37%	0.37	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-23.3	169.1	67	-178.9	-175.6	177.9	0	113.4	F344 F390 P405	F344-K407 HydrophobicContact CZ-CB 4.36Å; F390-K407 HydrophobicContact CB-CB 4.45Å; F390-K407 HydrophobicContact CB-CD 4.01Å; F390-K407 HydrophobicContact CD1-CB 3.76Å; F390-K407 HydrophobicContact CD2-CB 4.09Å; F390-K407 HydrophobicContact CD2-CD 4.06Å; F390-K407 HydrophobicContact CE1-CB 3.91Å; F390-K407 HydrophobicContact CE2-CB 4.24Å; F390-K407 HydrophobicContact CG-CB 3.86Å; F390-K407 HydrophobicContact CG-CD 4.1Å; F390-K407 HydrophobicContact CZ-CB 4.16Å; P405-K407 HydrophobicContact CB-CG 4.19Å; P405-K407 PolarHBondContact O-N 3.15Å
408	I	96.3	Very high	97	Very high	84 Å²	84	64 Å²	64	43%	0.431	31%	0.31	S	S	.	.			trans	-94.3	131.1	-176.9	-51.3	-58.3	0	0	0	109.7	N401 K404 P405 V406	N401-I408 PolarHBondContact ND2-O 3.01Å; N401-I408 VanDerWaalsContact ND2-O 3.13Å; K404-I408 HydrophobicContact CB-CB 4.48Å; P405-I408 HydrophobicContact CB-CG1 4.35Å; P405-I408 WeakPolarHBondContact O-CA 3.29Å; P405-I408 WeakPolarHBondContact O-CB 3.3Å; P405-I408 PolarHBondContact O-N 3.33Å; V406-I408 VanDerWaalsContact C-N 3.32Å
409	G	96	Very high	97	Very high	21 Å²	21	64.4 Å²	64.4	22%	0.216	31%	0.313	C	S	.	.			trans	159.1	154.7	178	0	0	0	0	0	112.2
410	R	95.9	Very high	96.9	Very high	216 Å²	216	61.8 Å²	61.8	82%	0.815	30%	0.296	S	S	*	.			trans	-75.4	166.7	175.1	-63	179.3	177.4	178.2	-1	110.6	G412 Q413	R410-G412 PolarHBondContact O-N 3.03Å; R410-Q413 VanDerWaalsContact O-CB 3.26Å; R410-Q413 WeakPolarHBondContact O-CB 3.29Å; R410-Q413 PolarHBondContact O-N 3.21Å; R410-Q413 VanDerWaalsContact O-N 3.16Å
411	D	96.8	Very high	96.9	Very high	41 Å²	41	57.6 Å²	57.6	22%	0.219	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	132.9	172.6	-173.2	58.4	0	0	0	110.2	I295 K296 T314 N318 Q413	I295-D411 VanDerWaalsContact CA-OD1 3.29Å; I295-D411 WeakPolarHBondContact CA-OD1 3.44Å; K296-D411 HydrophobicContact CB-CB 4.16Å; K296-D411 PolarHBondContact N-OD1 3.18Å; T314-D411 PolarHBondContact OG1-OD2 3.33Å; N318-D411 PolarHBondContact ND2-O 3.11Å; N318-D411 PolarHBondContact ND2-OD2 2.71Å; D411-Q413 VanDerWaalsContact C-N 3.32Å
412	G	96.2	Very high	96.8	Very high	7 Å²	7	61.5 Å²	61.5	7%	0.072	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	12.2	-176.6	0	0	0	0	0	114.8	L294 R410 E414	L294-G412 WeakPolarHBondContact O-CA 3.39Å; L294-G412 PolarHBondContact O-N 3.41Å; R410-G412 PolarHBondContact O-N 3.03Å; G412-E414 PolarHBondContact O-N 2.94Å
413	Q	97.8	Very high	96.8	Very high	44 Å²	44	56.2 Å²	56.2	21%	0.206	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	130	170.8	176.9	56.6	46.9	0	0	110.5	F293 L294 W400 N401 R410 D411	F293-Q413 CarbonylContact C-O 3.52Å; F293-Q413 WeakPolarHBondContact CA-O 3.29Å; L294-Q413 HydrophobicContact CB-CB 4.26Å; L294-Q413 PolarHBondContact N-O 3.36Å; W400-Q413 PolarHBondContact O-NE2 3.29Å; N401-Q413 HydrophobicContact CB-CG 4.31Å; R410-Q413 VanDerWaalsContact O-CB 3.26Å; R410-Q413 WeakPolarHBondContact O-CB 3.29Å; R410-Q413 PolarHBondContact O-N 3.21Å; R410-Q413 VanDerWaalsContact O-N 3.16Å; D411-Q413 VanDerWaalsContact C-N 3.32Å
414	E	97.6	Very high	96.8	Very high	35 Å²	35	51.5 Å²	51.5	16%	0.164	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	142.9	176.7	-156.9	168.6	175.2	0	0	111.2	R291 F292 F293 N398 W400 G412	R291-E414 IonicContact CZ-OE1 2.71Å; R291-E414 IonicContact CZ-OE2 3.84Å; R291-E414 IonicContact NE-OE1 3.15Å; R291-E414 PolarHBondContact NE-OE1 2.72Å; R291-E414 IonicContact NE-OE2 4Å; R291-E414 IonicContact NH2-OE1 2.75Å; R291-E414 PolarHBondContact NH2-OE1 2.8Å; R291-E414 IonicContact NH2-OE2 3.2Å; R291-E414 PolarHBondContact NH2-OE2 2.95Å; F292-E414 WeakPolarHBondContact O-CA 3.45Å; F292-E414 VanDerWaalsContact O-CG 3.31Å; F292-E414 WeakPolarHBondContact O-CG 3.25Å; F293-E414 HydrophobicContact CD1-CB 4Å; F293-E414 HydrophobicContact CD1-CG 4Å; F293-E414 HydrophobicContact CE1-CB 3.77Å; F293-E414 HydrophobicContact CE1-CG 3.59Å; F293-E414 HydrophobicContact CE2-CG 4.42Å; F293-E414 HydrophobicContact CZ-CB 4.49Å; F293-E414 VanDerWaalsContact CZ-CD 3.48Å; F293-E414 HydrophobicContact CZ-CG 3.82Å; N398-E414 PolarHBondContact ND2-O 3.03Å; W400-E414 HydrophobicContact CE3-CB 4.25Å; W400-E414 HydrophobicContact CE3-CG 3.9Å; W400-E414 HydrophobicContact CZ3-CG 3.85Å; G412-E414 PolarHBondContact O-N 2.94Å
415	I	98.2	Very high	96.6	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.7	-179	-56.9	168	0	0	0	108.6	F292 L294 V406 V419 L423	F292-I415 HydrophobicContact CB-CB 3.99Å; F292-I415 PolarHBondContact O-N 2.7Å; L294-I415 HydrophobicContact CB-CD1 4.19Å; V406-I415 HydrophobicContact CG2-CD1 3.97Å; V406-I415 HydrophobicContact CG2-CG1 4.28Å; V406-I415 HydrophobicContact CG2-CG2 3.92Å; I415-V419 HydrophobicContact CG2-CB 4.07Å; I415-V419 HydrophobicContact CG2-CG1 4.07Å; I415-L423 HydrophobicContact CD1-CD2 4.32Å
416	Q	97.6	Very high	96.5	Very high	46 Å²	46	51.4 Å²	51.4	22%	0.215	26%	0.263	C	S	.	.			trans	-55.2	131.6	179.1	-167.5	-164.4	89.7	0	0	111.2	N398 W400 K418 V419 G420	N398-Q416 PolarHBondContact OD1-N 3.16Å; W400-Q416 HydrophobicContact CD2-CB 3.92Å; W400-Q416 HydrophobicContact CD2-CG 4.25Å; W400-Q416 HydrophobicContact CE3-CB 4.34Å; W400-Q416 HydrophobicContact CG-CB 4.13Å; W400-Q416 HydrophobicContact CZ2-CG 4.14Å; Q416-K418 VanDerWaalsContact C-N 3.26Å; Q416-K418 PolarHBondContact O-N 3.43Å; Q416-V419 HydrophobicContact CB-CG2 4.24Å; Q416-V419 PolarHBondContact O-N 2.73Å; Q416-G420 PolarHBondContact O-N 2.88Å
417	P	96.1	Very high	96.4	Very high	49 Å²	49	51.9 Å²	51.9	32%	0.318	27%	0.265	S	S	.	.	H	α-helix	trans	-55.1	-28.9	-171.7	-32.6	35.8	0	0	0	117	F292 W400 A421	F292-P417 HydrophobicContact CD2-CB 4.39Å; F292-P417 HydrophobicContact CE2-CB 4.25Å; W400-P417 HydrophobicContact CH2-CG 4.1Å; W400-P417 HydrophobicContact CZ3-CG 4.47Å; P417-A421 VanDerWaalsContact O-CB 3.25Å; P417-A421 WeakPolarHBondContact O-CB 3.44Å; P417-A421 PolarHBondContact O-N 2.88Å; P417-A421 VanDerWaalsContact O-N 3.08Å
418	K	96	Very high	96.3	Very high	159 Å²	159	50.1 Å²	50.1	69%	0.691	26%	0.262	S	S	*	.	H	α-helix	trans	-65.4	-52.9	173.4	-66.3	-179.5	179.9	177	0	110.8	Q416 A421 Q422	Q416-K418 VanDerWaalsContact C-N 3.26Å; Q416-K418 PolarHBondContact O-N 3.43Å; K418-A421 PolarHBondContact O-N 2.91Å; K418-Q422 WeakPolarHBondContact O-CG 3.38Å; K418-Q422 PolarHBondContact O-N 2.73Å; K418-Q422 PolarHBondContact O-OE1 2.73Å
419	V	97.3	Very high	95.8	Very high	11 Å²	11	50.7 Å²	50.7	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-62.9	-43.9	178.7	-175.5	0	0	0	0	111	L396 F397 V406 I415 Q416 A421 Q422 L423	L396-V419 HydrophobicContact CB-CG1 4.34Å; F397-V419 WeakPolarHBondContact O-CG1 3.49Å; F397-V419 VanDerWaalsContact O-CG2 3.32Å; F397-V419 WeakPolarHBondContact O-CG2 3.31Å; V406-V419 HydrophobicContact CB-CG1 4.41Å; V406-V419 HydrophobicContact CG2-CG1 4.05Å; I415-V419 HydrophobicContact CG2-CB 4.07Å; I415-V419 HydrophobicContact CG2-CG1 4.07Å; Q416-V419 HydrophobicContact CB-CG2 4.24Å; Q416-V419 PolarHBondContact O-N 2.73Å; V419-A421 VanDerWaalsContact C-N 3.34Å; V419-A421 PolarHBondContact O-N 2.78Å; V419-Q422 PolarHBondContact O-N 3.08Å; V419-L423 WeakPolarHBondContact O-CB 3.26Å; V419-L423 PolarHBondContact O-N 3.47Å
420	G	97	Very high	95.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-39.2	176.7	0	0	0	0	0	113.1	F292 Q416 C424	F292-G420 VanDerWaalsContact CE1-O 3.28Å; F292-G420 WeakPolarHBondContact CE1-O 3.48Å; Q416-G420 PolarHBondContact O-N 2.88Å; G420-C424 WeakPolarHBondContact O-CB 3.07Å; G420-C424 PolarHBondContact O-N 2.88Å; G420-C424 PolarHBondContact O-SG 2.89Å
421	A	95.6	Very high	95	Very high	35 Å²	35	49.9 Å²	49.9	29%	0.289	27%	0.266	S	S	.	.	H	α-helix	trans	-70.5	-35.5	175.2	0	0	0	0	0	112.9	F292 P417 K418 V419 A425	F292-A421 HydrophobicContact CZ-CB 4.14Å; P417-A421 VanDerWaalsContact O-CB 3.25Å; P417-A421 WeakPolarHBondContact O-CB 3.44Å; P417-A421 PolarHBondContact O-N 2.88Å; P417-A421 VanDerWaalsContact O-N 3.08Å; K418-A421 PolarHBondContact O-N 2.91Å; V419-A421 VanDerWaalsContact C-N 3.34Å; V419-A421 PolarHBondContact O-N 2.78Å; A421-A425 WeakPolarHBondContact O-CB 3.42Å; A421-A425 PolarHBondContact O-N 2.82Å
422	Q	96.3	Very high	94.6	Very high	105 Å²	105	51.7 Å²	51.7	49%	0.491	28%	0.283	S	S	.	.	H	α-helix	trans	-65.2	-49.3	171.6	-72.6	167.1	-52.1	0	0	111	L396 K418 V419 C424 A425 L426	L396-Q422 HydrophobicContact CD1-CB 4.35Å; L396-Q422 HydrophobicContact CD2-CB 3.99Å; K418-Q422 WeakPolarHBondContact O-CG 3.38Å; K418-Q422 PolarHBondContact O-N 2.73Å; K418-Q422 PolarHBondContact O-OE1 2.73Å; V419-Q422 PolarHBondContact O-N 3.08Å; Q422-C424 VanDerWaalsContact C-N 3.34Å; Q422-C424 PolarHBondContact O-N 2.98Å; Q422-A425 WeakPolarHBondContact O-CA 3.46Å; Q422-A425 WeakPolarHBondContact O-CB 3.22Å; Q422-A425 PolarHBondContact O-N 2.84Å; Q422-L426 PolarHBondContact O-N 3.14Å
423	L	97.1	Very high	94.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-54.6	-48.4	176.5	177.8	57.3	0	0	0	111.6	V335 F344 L388 T393 L396 V406 I415 V419 A425 L426 F427	V335-L423 HydrophobicContact CG1-CD2 4.12Å; V335-L423 HydrophobicContact CG2-CD2 4.45Å; F344-L423 HydrophobicContact CD2-CD1 4.26Å; F344-L423 HydrophobicContact CE1-CD2 4.48Å; F344-L423 HydrophobicContact CE2-CD1 3.85Å; F344-L423 HydrophobicContact CZ-CD1 4.23Å; F344-L423 HydrophobicContact CZ-CD2 4.26Å; L388-L423 HydrophobicContact CD2-CD1 3.93Å; T393-L423 HydrophobicContact CG2-CD1 3.53Å; L396-L423 HydrophobicContact CD1-CB 3.84Å; L396-L423 HydrophobicContact CD1-CD1 4.24Å; V406-L423 HydrophobicContact CG1-CD1 4.3Å; V406-L423 HydrophobicContact CG1-CD2 4.18Å; V406-L423 HydrophobicContact CG2-CD2 3.89Å; I415-L423 HydrophobicContact CD1-CD2 4.32Å; V419-L423 WeakPolarHBondContact O-CB 3.26Å; V419-L423 PolarHBondContact O-N 3.47Å; L423-A425 PolarHBondContact O-N 3.49Å; L423-L426 PolarHBondContact O-N 3.39Å; L423-F427 HydrophobicContact CD1-CE2 4.39Å; L423-F427 HydrophobicContact CG-CE2 4.35Å; L423-F427 VanDerWaalsContact O-CD2 3.25Å; L423-F427 WeakPolarHBondContact O-CD2 3.49Å
424	C	95.9	Very high	93.8	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.007	30%	0.296	C	S	.	.	H	α-helix	trans	-66.9	-17.1	176.9	-69.1	0	0	0	0	114.2	L287 F347 G420 Q422	L287-C424 HydrophobicContact CD1-CB 3.52Å; L287-C424 HydrophobicContact CD2-CB 4.42Å; F347-C424 HydrophobicContact CD2-CB 4.45Å; F347-C424 HydrophobicContact CE1-CB 4.1Å; F347-C424 HydrophobicContact CE2-CB 3.98Å; F347-C424 HydrophobicContact CZ-CB 3.8Å; G420-C424 WeakPolarHBondContact O-CB 3.07Å; G420-C424 PolarHBondContact O-N 2.88Å; G420-C424 PolarHBondContact O-SG 2.89Å; Q422-C424 VanDerWaalsContact C-N 3.34Å; Q422-C424 PolarHBondContact O-N 2.98Å
425	A	94.3	Very high	93.4	Very high	73 Å²	73	53.2 Å²	53.2	60%	0.603	29%	0.293	S	S	*	.	H	α-helix	trans	-87.9	-17.4	175.3	0	0	0	0	0	113.6	A421 Q422 L423	A421-A425 WeakPolarHBondContact O-CB 3.42Å; A421-A425 PolarHBondContact O-N 2.82Å; Q422-A425 WeakPolarHBondContact O-CA 3.46Å; Q422-A425 WeakPolarHBondContact O-CB 3.22Å; Q422-A425 PolarHBondContact O-N 2.84Å; L423-A425 PolarHBondContact O-N 3.49Å
426	L	95.4	Very high	92.9	Very high	62 Å²	62	57.2 Å²	57.2	33%	0.325	31%	0.311	S	S	.	.	H	α-helix	trans	-80.4	-16.8	174.9	-67.1	170.9	0	0	0	113.3	L388 T393 L396 Q422 L423	L388-L426 HydrophobicContact CD1-CB 4.32Å; L388-L426 WeakPolarHBondContact CD1-O 3.49Å; L388-L426 HydrophobicContact CD2-CB 3.84Å; T393-L426 HydrophobicContact CG2-CD1 4.03Å; L396-L426 HydrophobicContact CD1-CD1 3.56Å; L396-L426 HydrophobicContact CG-CD1 4.26Å; Q422-L426 PolarHBondContact O-N 3.14Å; L423-L426 PolarHBondContact O-N 3.39Å
427	F	95.8	Very high	92.6	Very high	14 Å²	14	58.8 Å²	58.8	6%	0.061	32%	0.318	C	S	.	.	S	Bend	trans	-64.9	136.8	175.6	-79.6	-94.8	0	0	0	111.1	V335 F344 F347 C384 L388 L423	V335-F427 HydrophobicContact CG1-CE2 4.43Å; V335-F427 HydrophobicContact CG1-CZ 4.21Å; F344-F427 HydrophobicContact CB-CE1 4.03Å; F344-F427 HydrophobicContact CB-CZ 3.63Å; F344-F427 HydrophobicContact CG-CZ 4.26Å; F347-F427 HydrophobicContact CD1-CB 4.49Å; F347-F427 HydrophobicContact CD1-CD1 4.14Å; F347-F427 AromaticContact CD1-CD2 3.58Å; F347-F427 HydrophobicContact CD1-CD2 3.58Å; F347-F427 HydrophobicContact CD1-CE1 4.26Å; F347-F427 AromaticContact CD1-CE2 3.7Å; F347-F427 HydrophobicContact CD1-CE2 3.7Å; F347-F427 AromaticContact CD1-CG 3.81Å; F347-F427 HydrophobicContact CD1-CG 3.81Å; F347-F427 HydrophobicContact CD1-CZ 4.03Å; F347-F427 HydrophobicContact CE1-CB 3.89Å; F347-F427 HydrophobicContact CE1-CD1 4.36Å; F347-F427 AromaticContact CE1-CD2 3.6Å; F347-F427 HydrophobicContact CE1-CD2 3.6Å; F347-F427 HydrophobicContact CE1-CE2 4.19Å; F347-F427 AromaticContact CE1-CG 3.68Å; F347-F427 HydrophobicContact CE1-CG 3.68Å; C384-F427 HydrophobicContact CB-CB 4.46Å; L388-F427 HydrophobicContact CB-CD1 3.7Å; L388-F427 HydrophobicContact CB-CD2 4.47Å; L388-F427 HydrophobicContact CB-CE1 3.52Å; L388-F427 HydrophobicContact CB-CE2 4.35Å; L388-F427 HydrophobicContact CB-CG 4.18Å; L388-F427 HydrophobicContact CB-CZ 3.9Å; L388-F427 HydrophobicContact CD2-CD1 4.38Å; L388-F427 HydrophobicContact CD2-CD2 3.67Å; L388-F427 HydrophobicContact CD2-CE1 4.34Å; L388-F427 HydrophobicContact CD2-CE2 3.65Å; L388-F427 HydrophobicContact CD2-CG 4.06Å; L388-F427 HydrophobicContact CD2-CZ 4Å; L423-F427 HydrophobicContact CD1-CE2 4.39Å; L423-F427 HydrophobicContact CG-CE2 4.35Å; L423-F427 VanDerWaalsContact O-CD2 3.25Å; L423-F427 WeakPolarHBondContact O-CD2 3.49Å
428	P	92.6	Very high	92.3	Very high	48 Å²	48	56.7 Å²	56.7	31%	0.312	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-57	145.6	170.6	-23.9	34.2	0	0	0	111.8	C384	C384-P428 PolarHBondContact SG-O 3.39Å
429	L	86.4	Confident	92.1	Very high	95 Å²	95	49.7 Å²	49.7	50%	0.497	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-59.4	139	175.4	-65.3	178.6	0	0	0	111.1	P279 T280 R386	P279-L429 HydrophobicContact CG-CD1 4.29Å; P279-L429 HydrophobicContact CG-CD2 4.17Å; T280-L429 HydrophobicContact CG2-CD2 3.94Å; R386-L429 WeakPolarHBondContact CD-O 3.27Å; R386-L429 PolarHBondContact NH1-O 2.96Å
430	D	88.9	Confident	91.8	Very high	27 Å²	27	55.8 Å²	55.8	14%	0.144	30%	0.298	C	S	.	.			trans	-120.3	104.5	-177.9	-174.2	-5.5	0	0	0	110.2	C384 R385 R386 S432 V433	C384-D430 HydrophobicContact CB-CB 4.37Å; R385-D430 WeakPolarHBondContact CA-OD2 3.49Å; R385-D430 WeakPolarHBondContact CB-OD2 3.3Å; R385-D430 PolarHBondContact N-OD2 2.89Å; R386-D430 HydrophobicContact CG-CB 4.09Å; D430-S432 PolarHBondContact O-N 2.86Å; D430-S432 VanDerWaalsContact OD1-CB 3.29Å; D430-S432 WeakPolarHBondContact OD1-CB 3.47Å; D430-S432 PolarHBondContact OD1-N 3.16Å; D430-S432 PolarHBondContact OD1-OG 2.83Å; D430-S432 PolarHBondContact OD2-OG 3.22Å; D430-V433 HydrophobicContact CB-CG2 4.48Å; D430-V433 WeakPolarHBondContact OD2-CG2 3.45Å
431	E	86.8	Confident	91.4	Very high	193 Å²	193	59.7 Å²	59.7	90%	0.902	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-12.7	-179.9	-63.4	177.1	-170	0	0	112.7	V433	E431-V433 PolarHBondContact O-N 3.49Å
432	S	88.4	Confident	91.2	Very high	80 Å²	80	58 Å²	58	56%	0.559	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-0.8	177.9	78.3	0	0	0	0	114	D430	D430-S432 PolarHBondContact O-N 2.86Å; D430-S432 VanDerWaalsContact OD1-CB 3.29Å; D430-S432 WeakPolarHBondContact OD1-CB 3.47Å; D430-S432 PolarHBondContact OD1-N 3.16Å; D430-S432 PolarHBondContact OD1-OG 2.83Å; D430-S432 PolarHBondContact OD2-OG 3.22Å
433	V	89.3	Confident	90.8	Very high	21 Å²	21	60.4 Å²	60.4	13%	0.127	30%	0.304	C	S	.	.	S	Bend	trans	-122.5	116.6	-170.6	175.4	0	0	0	0	111.6	W382 R385 D430 E431 V435	W382-V433 WeakPolarHBondContact O-CG1 3.29Å; R385-V433 HydrophobicContact CG-CG2 4.36Å; D430-V433 HydrophobicContact CB-CG2 4.48Å; D430-V433 WeakPolarHBondContact OD2-CG2 3.45Å; E431-V433 PolarHBondContact O-N 3.49Å; V433-V435 VanDerWaalsContact C-N 3.3Å; V433-V435 HydrophobicContact CG1-CG2 4.04Å; V433-V435 PolarHBondContact O-N 3.31Å
434	D	87.3	Confident	90.1	Very high	82 Å²	82	66.3 Å²	66.3	44%	0.439	33%	0.331	S	S	.	.			trans	-74.5	81.8	170	-176.7	8.3	0	0	0	111.8	H436 H437 V438 R440	D434-H436 PolarHBondContact O-N 3.46Å; D434-H436 VanDerWaalsContact O-N 3.14Å; D434-H436 WeakPolarHBondContact OD1-CA 3.17Å; D434-H436 WeakPolarHBondContact OD1-CB 3.38Å; D434-H436 IonicContact OD1-CG 4Å; D434-H436 PolarHBondContact OD1-N 3.05Å; D434-H436 IonicContact OD1-ND1 3.84Å; D434-H437 HydrophobicContact CB-CB 4.16Å; D434-H437 VanDerWaalsContact CG-N 3.31Å; D434-H437 PolarHBondContact O-N 2.92Å; D434-H437 VanDerWaalsContact O-N 3.12Å; D434-H437 PolarHBondContact OD1-N 2.83Å; D434-H437 WeakPolarHBondContact OD2-CB 3.49Å; D434-H437 PolarHBondContact OD2-N 2.96Å; D434-V438 PolarHBondContact O-N 2.91Å; D434-R440 IonicContact OD2-NH2 2.68Å; D434-R440 PolarHBondContact OD2-NH2 3.15Å
435	V	88.9	Confident	89.2	Confident	14 Å²	14	69.7 Å²	69.7	9%	0.085	35%	0.346	C	S	.	.	H	α-helix	trans	-57.3	-23.6	170.6	-174.9	0	0	0	0	111.8	K282 I286 V433 A439	K282-V435 HydrophobicContact CB-CG1 4.01Å; I286-V435 HydrophobicContact CD1-CG1 3.71Å; V433-V435 VanDerWaalsContact C-N 3.3Å; V433-V435 HydrophobicContact CG1-CG2 4.04Å; V433-V435 PolarHBondContact O-N 3.31Å; V435-A439 VanDerWaalsContact O-CB 3.26Å; V435-A439 WeakPolarHBondContact O-CB 3.31Å; V435-A439 PolarHBondContact O-N 3.01Å
436	H	88.1	Confident	87.9	Confident	86 Å²	86	68.8 Å²	68.8	40%	0.398	34%	0.344	S	S	.	.	H	α-helix	trans	-74.2	-33.6	178.2	-48.8	18.9	0	0	0	111.7	K282 D434 R440	K282-H436 WeakPolarHBondContact CD-ND1 3.44Å; K282-H436 PolarHBondContact NZ-CD2 2.69Å; K282-H436 PolarHBondContact NZ-CE1 2.69Å; K282-H436 VanDerWaalsContact NZ-CE1 3.27Å; K282-H436 PolarHBondContact NZ-NE2 3.26Å; D434-H436 PolarHBondContact O-N 3.46Å; D434-H436 VanDerWaalsContact O-N 3.14Å; D434-H436 WeakPolarHBondContact OD1-CA 3.17Å; D434-H436 WeakPolarHBondContact OD1-CB 3.38Å; D434-H436 IonicContact OD1-CG 4Å; D434-H436 PolarHBondContact OD1-N 3.05Å; D434-H436 IonicContact OD1-ND1 3.84Å; H436-R440 VanDerWaalsContact O-CG 3.31Å; H436-R440 WeakPolarHBondContact O-CG 3.48Å; H436-R440 PolarHBondContact O-N 2.89Å; H436-R440 PolarHBondContact O-NE 3.1Å
437	H	90.3	Very high	86.3	Confident	79 Å²	79	72.8 Å²	72.8	37%	0.366	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-44.1	171.1	175.8	90.7	0	0	0	111.5	D434 R440 R441	D434-H437 HydrophobicContact CB-CB 4.16Å; D434-H437 VanDerWaalsContact CG-N 3.31Å; D434-H437 PolarHBondContact O-N 2.92Å; D434-H437 VanDerWaalsContact O-N 3.12Å; D434-H437 PolarHBondContact OD1-N 2.83Å; D434-H437 WeakPolarHBondContact OD2-CB 3.49Å; D434-H437 PolarHBondContact OD2-N 2.96Å; H437-R440 WeakPolarHBondContact O-CB 3.38Å; H437-R440 PolarHBondContact O-N 3.26Å; H437-R441 PolarHBondContact CD2-NE 3.38Å; H437-R441 PolarHBondContact CD2-NH2 3.46Å; H437-R441 VanDerWaalsContact CD2-NH2 3.27Å; H437-R441 PolarHBondContact NE2-NE 2.92Å; H437-R441 PolarHBondContact NE2-NH2 2.89Å; H437-R441 PolarHBondContact O-N 3.38Å
438	V	91.3	Very high	83.8	Confident	6 Å²	6	76.8 Å²	76.8	4%	0.036	39%	0.387	C	S	.	.	H	α-helix	trans	-64.8	-43.7	176.4	-169.8	0	0	0	0	111.1	I286 D381 L383 D434 R440 R441 V442	I286-V438 HydrophobicContact CD1-CB 4.14Å; I286-V438 HydrophobicContact CD1-CG1 4.15Å; D381-V438 HydrophobicContact CB-CG1 3.88Å; D381-V438 HydrophobicContact CB-CG2 3.87Å; L383-V438 HydrophobicContact CD2-CB 4.1Å; L383-V438 HydrophobicContact CD2-CG1 3.9Å; L383-V438 HydrophobicContact CD2-CG2 4.22Å; D434-V438 PolarHBondContact O-N 2.91Å; V438-R440 VanDerWaalsContact C-N 3.29Å; V438-R440 PolarHBondContact O-N 2.73Å; V438-R441 PolarHBondContact O-N 3.09Å; V438-R441 VanDerWaalsContact O-N 3.14Å; V438-V442 PolarHBondContact O-N 3.4Å
439	A	91.1	Very high	81.7	Confident	12 Å²	12	80.6 Å²	80.6	10%	0.099	41%	0.411	C	S	.	.	H	α-helix	trans	-59.4	-36.8	174.9	0	0	0	0	0	112.8	I286 V435 V442 R443	I286-A439 HydrophobicContact CD1-CB 4.06Å; I286-A439 HydrophobicContact CG1-CB 4.17Å; V435-A439 VanDerWaalsContact O-CB 3.26Å; V435-A439 WeakPolarHBondContact O-CB 3.31Å; V435-A439 PolarHBondContact O-N 3.01Å; A439-V442 PolarHBondContact O-N 3.17Å; A439-R443 WeakPolarHBondContact O-CG 3.34Å; A439-R443 PolarHBondContact O-N 2.89Å; A439-R443 VanDerWaalsContact O-N 3.1Å
440	R	90.4	Very high	79.6	Confident	139 Å²	139	81 Å²	81	53%	0.525	42%	0.422	S	S	.	.	H	α-helix	trans	-61.4	-46.7	173.3	-80.2	177.2	-75.5	170.9	-3.9	111.6	D434 H436 H437 V438 V442 R443 Q444	D434-R440 IonicContact OD2-NH2 2.68Å; D434-R440 PolarHBondContact OD2-NH2 3.15Å; H436-R440 VanDerWaalsContact O-CG 3.31Å; H436-R440 WeakPolarHBondContact O-CG 3.48Å; H436-R440 PolarHBondContact O-N 2.89Å; H436-R440 PolarHBondContact O-NE 3.1Å; H437-R440 WeakPolarHBondContact O-CB 3.38Å; H437-R440 PolarHBondContact O-N 3.26Å; V438-R440 VanDerWaalsContact C-N 3.29Å; V438-R440 PolarHBondContact O-N 2.73Å; R440-V442 PolarHBondContact O-N 3.45Å; R440-R443 PolarHBondContact O-N 3.37Å; R440-Q444 WeakPolarHBondContact O-CG 3.46Å; R440-Q444 PolarHBondContact O-N 2.94Å
441	R	89.9	Confident	77.5	Confident	82 Å²	82	88 Å²	88	31%	0.309	45%	0.454	S	S	.	.	H	α-helix	trans	-66.3	-34.7	178	-73.8	-165.9	-83.8	129.6	-4.5	113.3	D381 H437 V438 Q444 K445	D381-R441 VanDerWaalsContact CG-NH2 3.33Å; D381-R441 IonicContact OD1-CZ 3.18Å; D381-R441 IonicContact OD1-NH1 3.64Å; D381-R441 PolarHBondContact OD1-NH1 2.97Å; D381-R441 IonicContact OD1-NH2 3.98Å; D381-R441 PolarHBondContact OD1-NH2 2.77Å; D381-R441 IonicContact OD2-CZ 3.31Å; D381-R441 IonicContact OD2-NH1 2.67Å; D381-R441 PolarHBondContact OD2-NH1 3.27Å; D381-R441 IonicContact OD2-NH2 2.79Å; H437-R441 PolarHBondContact CD2-NE 3.38Å; H437-R441 PolarHBondContact CD2-NH2 3.46Å; H437-R441 VanDerWaalsContact CD2-NH2 3.27Å; H437-R441 PolarHBondContact NE2-NE 2.92Å; H437-R441 PolarHBondContact NE2-NH2 2.89Å; H437-R441 PolarHBondContact O-N 3.38Å; V438-R441 PolarHBondContact O-N 3.09Å; V438-R441 VanDerWaalsContact O-N 3.14Å; R441-Q444 PolarHBondContact O-N 3.34Å; R441-K445 PolarHBondContact O-N 3.29Å
442	V	89.9	Confident	75.4	Confident	0 Å²	0	87 Å²	87	0%	0	45%	0.454	C	S	.	.	H	α-helix	trans	-61.2	-42.7	170.9	172	0	0	0	0	111.8	Y285 I286 R330 V438 A439 R440 Q444 K445 G446	Y285-V442 HydrophobicContact CE1-CG1 4.05Å; I286-V442 HydrophobicContact CG1-CG2 4.25Å; I286-V442 HydrophobicContact CG2-CG2 4.25Å; R330-V442 HydrophobicContact CG-CG1 4.47Å; V438-V442 PolarHBondContact O-N 3.4Å; A439-V442 PolarHBondContact O-N 3.17Å; R440-V442 PolarHBondContact O-N 3.45Å; V442-Q444 VanDerWaalsContact C-N 3.3Å; V442-Q444 PolarHBondContact O-N 3.31Å; V442-K445 PolarHBondContact O-N 3.39Å; V442-G446 PolarHBondContact O-N 3.29Å; V442-G446 VanDerWaalsContact O-N 3.09Å
443	R	88	Confident	73.3	Confident	154 Å²	154	94 Å²	94	58%	0.581	47%	0.468	S	S	*	.	H	α-helix	trans	-65.1	-35.2	176.9	-67.7	177.4	84.7	179.4	7.2	112	Y285 A439 R440 Q447	Y285-R443 HydrophobicContact CE1-CG 3.64Å; Y285-R443 WeakPolarHBondContact OH-CG 3.4Å; A439-R443 WeakPolarHBondContact O-CG 3.34Å; A439-R443 PolarHBondContact O-N 2.89Å; A439-R443 VanDerWaalsContact O-N 3.1Å; R440-R443 PolarHBondContact O-N 3.37Å; R443-Q447 WeakPolarHBondContact O-CB 3.35Å; R443-Q447 WeakPolarHBondContact O-CG 3.41Å; R443-Q447 PolarHBondContact O-N 3.41Å
444	Q	82.9	Confident	71.2	Confident	124 Å²	124	98.3 Å²	98.3	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-70.6	-41.9	175.7	-71	170.5	-46.8	0	0	112.4	R440 R441 V442 G446 Q447	R440-Q444 WeakPolarHBondContact O-CG 3.46Å; R440-Q444 PolarHBondContact O-N 2.94Å; R441-Q444 PolarHBondContact O-N 3.34Å; V442-Q444 VanDerWaalsContact C-N 3.3Å; V442-Q444 PolarHBondContact O-N 3.31Å; Q444-G446 VanDerWaalsContact C-N 3.32Å; Q444-G446 PolarHBondContact O-N 3.37Å; Q444-Q447 CarbonylContact O-C 3.58Å; Q444-Q447 WeakPolarHBondContact O-CA 3.27Å; Q444-Q447 PolarHBondContact O-N 3.31Å; Q444-Q447 VanDerWaalsContact O-O 3.1Å
445	K	77.8	Confident	69.4	Low	73 Å²	73	106.7 Å²	106.7	32%	0.317	52%	0.521	S	S	.	.	H	α-helix	trans	-61.8	-39.3	173.8	-171.2	-178.3	178.5	-174	0	112	F326 R441 V442 Q447	F326-K445 HydrophobicContact CZ-CD 4.3Å; F326-K445 PolarHBondContact O-NZ 2.85Å; R441-K445 PolarHBondContact O-N 3.29Å; V442-K445 PolarHBondContact O-N 3.39Å; K445-Q447 PolarHBondContact O-N 3.48Å
446	G	66.3	Low	67.2	Low	54 Å²	54	109 Å²	109	56%	0.557	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-11	173.2	0	0	0	0	0	114.7	V442 Q444	V442-G446 PolarHBondContact O-N 3.29Å; V442-G446 VanDerWaalsContact O-N 3.09Å; Q444-G446 VanDerWaalsContact C-N 3.32Å; Q444-G446 PolarHBondContact O-N 3.37Å
447	Q	62.1	Low	65.2	Low	145 Å²	145	113.8 Å²	113.8	68%	0.678	56%	0.563	S	S	*	*			trans	-103.1	67.3	168.1	-73.8	-179.1	-27.2	0	0	108.8	R443 Q444 K445	R443-Q447 WeakPolarHBondContact O-CB 3.35Å; R443-Q447 WeakPolarHBondContact O-CG 3.41Å; R443-Q447 PolarHBondContact O-N 3.41Å; Q444-Q447 CarbonylContact O-C 3.58Å; Q444-Q447 WeakPolarHBondContact O-CA 3.27Å; Q444-Q447 PolarHBondContact O-N 3.31Å; Q444-Q447 VanDerWaalsContact O-O 3.1Å; K445-Q447 PolarHBondContact O-N 3.48Å
448	T	43.8	Very low	63	Low	99 Å²	99	115.3 Å²	115.3	61%	0.607	58%	0.58	S	S	*	*			trans	-51.1	151.4	152.6	51.6	0	0	0	0	108.7	S450	T448-S450 PolarHBondContact O-N 2.9Å
449	P	47.1	Very low	60.7	Low	128 Å²	128	121.1 Å²	121.1	83%	0.831	62%	0.618	S	S	*	*			trans	-68.4	66.3	164.8	-19.5	34	0	0	0	110.7	E451	P449-E451 PolarHBondContact O-N 2.98Å; P449-E451 VanDerWaalsContact O-N 3.16Å
450	S	43	Very low	58.4	Low	102 Å²	102	127 Å²	127	71%	0.713	64%	0.643	S	S	*	*			trans	-44.2	124.8	153.7	61.4	0	0	0	0	106.2	T448	T448-S450 PolarHBondContact O-N 2.9Å
451	E	44.9	Very low	56.1	Low	176 Å²	176	131.7 Å²	131.7	82%	0.822	66%	0.661	S	S	*	*			trans	-22.1	138.4	-160.5	-60	169.1	102.2	0	0	114.9	P449 R453	P449-E451 PolarHBondContact O-N 2.98Å; P449-E451 VanDerWaalsContact O-N 3.16Å; E451-R453 WeakPolarHBondContact O-CA 3.16Å; E451-R453 PolarHBondContact O-N 2.86Å
452	L	43.2	Very low	53.5	Low	171 Å²	171	136.2 Å²	136.2	90%	0.895	69%	0.686	S	S	*	*			trans	-52.3	86	167.4	-84.3	172.6	0	0	0	109.7	P454	L452-P454 WeakPolarHBondContact O-CD 3.17Å
453	R	44.3	Very low	51.4	Low	228 Å²	228	142.8 Å²	142.8	86%	0.86	73%	0.729	S	S	*	*			trans	-56.6	112.1	-169.7	-172	179.8	-168.2	173.5	5.8	104.6	E451 R455	E451-R453 WeakPolarHBondContact O-CA 3.16Å; E451-R453 PolarHBondContact O-N 2.86Å; R453-R455 PolarHBondContact O-N 2.9Å; R453-R455 VanDerWaalsContact O-N 3.12Å
454	P	44.2	Very low	49.5	Very low	111 Å²	111	138.7 Å²	138.7	72%	0.721	73%	0.734	S	S	*	*			trans	-50.6	130.7	-169.8	-30.4	35.5	0	0	0	107.2	L452 G456	L452-P454 WeakPolarHBondContact O-CD 3.17Å; P454-G456 PolarHBondContact O-N 2.82Å
455	R	50.9	Low	47.3	Very low	257 Å²	257	144.8 Å²	144.8	97%	0.97	75%	0.752	S	S	*	*			trans	-69.3	75.5	179.1	-88	-173.7	170.9	168.3	-0.5	107.9	R453 R457	R453-R455 PolarHBondContact O-N 2.9Å; R453-R455 VanDerWaalsContact O-N 3.12Å; R455-R457 VanDerWaalsContact C-N 3.31Å; R455-R457 PolarHBondContact O-N 2.91Å
456	G	41.2	Very low	45.4	Very low	64 Å²	64	153.2 Å²	153.2	66%	0.66	78%	0.781	S	S	*	*			trans	-60.7	97	179.9	0	0	0	0	0	107.3	P454	P454-G456 PolarHBondContact O-N 2.82Å
457	R	47.3	Very low	43.8	Very low	185 Å²	185	161.5 Å²	161.5	70%	0.698	80%	0.796	S	S	*	*				25.1	107.6	129.1	-162	177.2	-150.1	-123.6	-2.7	111.9	R455 Q460	R455-R457 VanDerWaalsContact C-N 3.31Å; R455-R457 PolarHBondContact O-N 2.91Å; R457-Q460 VanDerWaalsContact NH2-OE1 3.12Å
458	P	44.3	Very low	42.7	Very low	111 Å²	111	160.4 Å²	160.4	72%	0.721	80%	0.801	S	S	*	*			trans	-51.9	140	177	24.6	-34.3	0	0	0	109	Q460	P458-Q460 PolarHBondContact O-N 3.16Å
459	P	42.9	Very low	42.3	Very low	128 Å²	128	165 Å²	165	83%	0.831	82%	0.816	S	S	*	*			trans	-57.1	109.7	-167.1	21.4	-33.1	0	0	0	109.9	R461	P459-R461 PolarHBondContact O-N 2.73Å
460	Q	42.8	Very low	41.6	Very low	135 Å²	135	168 Å²	168	63%	0.631	82%	0.819	S	S	*	*			trans	-71.6	106	-177.6	-173.6	164.2	-1.8	0	0	107.5	R457 P458 E462	R457-Q460 VanDerWaalsContact NH2-OE1 3.12Å; P458-Q460 PolarHBondContact O-N 3.16Å; Q460-E462 PolarHBondContact O-N 2.71Å
461	R	42.1	Very low	41.3	Very low	238 Å²	238	172.6 Å²	172.6	90%	0.898	82%	0.822	S	S	*	*			trans	-63.1	98.7	-172.8	-169.8	177.5	-169	161.3	1.9	110.2	P459 P463	P459-R461 PolarHBondContact O-N 2.73Å; R461-P463 WeakPolarHBondContact O-CD 3.42Å
462	E	34.1	Very low	41	Very low	178 Å²	178	172 Å²	172	83%	0.832	82%	0.824	S	S	*	*			trans	-63.1	125.9	179.7	-67.7	-165.9	146.7	0	0	111.1	Q460 G464	Q460-E462 PolarHBondContact O-N 2.71Å; E462-G464 PolarHBondContact O-N 2.82Å; E462-G464 VanDerWaalsContact O-N 3.1Å
463	P	45.7	Very low	40.9	Very low	138 Å²	138	169.2 Å²	169.2	90%	0.896	81%	0.81	S	S	*	*	S	Bend	trans	-83	86.8	178.4	33.2	-33.5	0	0	0	110.6	R461	R461-P463 WeakPolarHBondContact O-CD 3.42Å
464	G	48.1	Very low	40.7	Very low	67 Å²	67	167.3 Å²	167.3	69%	0.691	81%	0.81	S	S	*	*			trans	135.1	91.1	157	0	0	0	0	0	117.4	E462	E462-G464 PolarHBondContact O-N 2.82Å; E462-G464 VanDerWaalsContact O-N 3.1Å
465	R	37.3	Very low	40	Very low	253 Å²	253	165.5 Å²	165.5	96%	0.955	81%	0.812	S	S	*	*			trans	-122.2	124.4	131.5	-84.2	-169.5	170.1	-99.6	-2.6	108.9
466	R	38.6	Very low	39.3	Very low	250 Å²	250	165.3 Å²	165.3	94%	0.943	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.6	131.8	174.3	-63.6	-179.5	-179.7	-177.4	-1.2	108.4
467	R	32	Very low	39.1	Very low	228 Å²	228	171.8 Å²	171.8	86%	0.86	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-79.7	133.8	158.6	-173.6	177.1	-177.7	163.9	0.6	106.5	E469	R467-E469 PolarHBondContact O-N 2.86Å
468	P	39.7	Very low	38.5	Very low	122 Å²	122	174.6 Å²	174.6	79%	0.792	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-59.1	134.4	168.9	-22.3	34.1	0	0	0	109.6
469	E	35.5	Very low	38.6	Very low	195 Å²	195	174.9 Å²	174.9	91%	0.911	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-86.9	139.1	165	-68.6	-179.9	149.2	0	0	108.1	R467	R467-E469 PolarHBondContact O-N 2.86Å
470	E	31.2	Very low	38.6	Very low	190 Å²	190	179.8 Å²	179.8	89%	0.888	84%	0.835	S	S	*	*			trans	-127.9	152.8	161.2	-161.6	155.9	-129.8	0	0	107.1
471	Y	36.5	Very low	38.3	Very low	199 Å²	199	178.2 Å²	178.2	78%	0.78	85%	0.845	S	S	*	*			trans	-56.5	137.1	-153.1	-72.4	-102.6	0	0	0	115.3	L473	Y471-L473 HydrophobicContact CD1-CD1 4.12Å; Y471-L473 HydrophobicContact CD1-CG 4.49Å; Y471-L473 HydrophobicContact CE1-CD1 4.38Å
472	D	39.5	Very low	38	Very low	163 Å²	163	174.5 Å²	174.5	87%	0.872	84%	0.843	S	S	*	*				-143.7	142	125.6	-133	-23.5	0	0	0	110.9
473	L	39.7	Very low	37.8	Very low	114 Å²	114	169.4 Å²	169.4	60%	0.597	84%	0.839	S	S	*	*			trans	-122	166.1	-174.8	-83.4	169.3	0	0	0	110.8	Y471	Y471-L473 HydrophobicContact CD1-CD1 4.12Å; Y471-L473 HydrophobicContact CD1-CG 4.49Å; Y471-L473 HydrophobicContact CE1-CD1 4.38Å
474	H	40.8	Very low	37.8	Very low	187 Å²	187	168.9 Å²	168.9	87%	0.866	84%	0.835	S	S	*	*			trans	70.4	126.6	177.7	-33.7	-75.1	0	0	0	114.8
475	G	29.1	Very low	38.1	Very low	73 Å²	73	171.3 Å²	171.3	75%	0.753	84%	0.839	S	S	*	*			cis	149.2	121.1	-12	0	0	0	0	0	113.4
476	R	37.4	Very low	38	Very low	254 Å²	254	166.2 Å²	166.2	96%	0.958	83%	0.83	S	S	*	*			trans	-151.8	153.3	158.2	-103.7	163.9	-160.3	-122.7	1.5	109.4
477	K	36.4	Very low	37.6	Very low	199 Å²	199	163.2 Å²	163.2	87%	0.865	83%	0.825	S	S	*	*			trans	-109	129.5	-159.5	-58.4	177.7	-178.6	176	0	113.6
478	R	35.6	Very low	37.7	Very low	245 Å²	245	157.9 Å²	157.9	93%	0.925	81%	0.813	S	S	*	*			trans	54.1	171	137.3	-72.3	-170.1	179.7	-165.8	1	119.4
479	P	45.3	Very low	37.5	Very low	116 Å²	116	160.6 Å²	160.6	75%	0.753	82%	0.815	S	S	*	*			cis	-120.4	179.1	-9.2	35.8	-18.9	0	0	0	114.2
480	R	43.9	Very low	37.2	Very low	232 Å²	232	162.7 Å²	162.7	88%	0.875	82%	0.815	S	S	*	*			trans	-78.1	158.7	154.4	-83.3	-176.8	167.1	119.2	-4.7	109.8
481	A	35.8	Very low	37.5	Very low	101 Å²	101	159.5 Å²	159.5	84%	0.835	81%	0.811	S	S	*	*			trans	-133.9	142.8	158.2	0	0	0	0	0	108.7
482	D	34.8	Very low	37.2	Very low	160 Å²	160	153.5 Å²	153.5	86%	0.856	81%	0.809	S	S	*	*			trans	-96.4	154.4	-176.3	-60.9	-77.6	0	0	0	111.8
483	G	30.7	Very low	37.1	Very low	72 Å²	72	155.4 Å²	155.4	74%	0.742	81%	0.81	S	S	*	*			trans	-158.9	141.6	177.4	0	0	0	0	0	110.9
484	P	44.9	Very low	37.2	Very low	126 Å²	126	157.1 Å²	157.1	82%	0.818	82%	0.819	S	S	*	*			trans	-98.6	165.6	-157.4	37.5	-35.7	0	0	0	115.2
485	P	54.9	Low	37.1	Very low	119 Å²	119	153.5 Å²	153.5	77%	0.773	81%	0.812	S	S	*	*			trans	-96.2	131.7	178.7	35.6	-30.8	0	0	0	113.4
486	D	35.7	Very low	37.4	Very low	145 Å²	145	156.4 Å²	156.4	78%	0.775	81%	0.81	S	S	*	*			trans	178.1	135.2	134	-114.1	-32.4	0	0	0	111.9
487	F	31	Very low	37.6	Very low	187 Å²	187	152.6 Å²	152.6	82%	0.82	81%	0.808	S	S	*	*				-164.5	103.1	126.9	-137.1	-104.4	0	0	0	114.5
488	N	32.5	Very low	38	Very low	116 Å²	116	154.1 Å²	154.1	62%	0.62	81%	0.808	S	S	*	*			trans	37.8	136.4	137.9	-64.7	-63	0	0	0	123.4
489	Q	35.7	Very low	37.9	Very low	180 Å²	180	147.3 Å²	147.3	84%	0.841	80%	0.798	S	S	*	*			trans	-82	170.5	165.1	-53.2	167.1	11.5	0	0	112.1
490	R	29.7	Very low	37.6	Very low	239 Å²	239	150 Å²	150	90%	0.902	80%	0.8	S	S	*	*			trans	103.2	160.4	163.9	-67.8	-174.6	160.6	-137.7	-3.4	116.4
491	P	36.9	Very low	37.3	Very low	123 Å²	123	144.6 Å²	144.6	80%	0.799	80%	0.796	S	S	*	*			cis	-125.4	170.5	-14.3	24	-2.9	0	0	0	114.4
492	G	31.3	Very low	37.4	Very low	73 Å²	73	146.4 Å²	146.4	75%	0.753	80%	0.796	S	S	*	*			trans	112.4	81.5	144.8	0	0	0	0	0	118.5
493	F	36.5	Very low	37.4	Very low	202 Å²	202	144 Å²	144	89%	0.886	78%	0.783	S	S	*	*			trans	-146.7	134.5	141.5	-141.9	-92.9	0	0	0	109.3
494	I	41.5	Very low	37.9	Very low	151 Å²	151	152 Å²	152	77%	0.774	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-95.8	125.8	-174.2	-61.7	169.5	0	0	0	109
495	P	39.6	Very low	37.7	Very low	111 Å²	111	155 Å²	155	72%	0.721	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75.7	124.6	167.1	-10.8	27.7	0	0	0	110.2
496	D	35	Very low	36.8	Very low	133 Å²	133	158.7 Å²	158.7	71%	0.711	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-69.7	134.1	166	-176.4	1.3	0	0	0	109.5	R498	D496-R498 VanDerWaalsContact C-N 3.33Å; D496-R498 WeakPolarHBondContact OD1-CB 3.39Å; D496-R498 PolarHBondContact OD1-N 3.49Å; D496-R498 VanDerWaalsContact OD1-N 3.11Å
497	L	42	Very low	37	Very low	175 Å²	175	157.6 Å²	157.6	92%	0.916	79%	0.793	S	S	*	*	S	Bend	trans	-88	6.1	-176.8	-83.5	165.3	0	0	0	113.6
498	R	45.2	Very low	37.3	Very low	230 Å²	230	153.3 Å²	153.3	87%	0.868	79%	0.787	S	S	*	*			trans	-95.5	8.9	-170.4	-142.3	171.9	-173.4	168.9	2.9	117	D496	D496-R498 VanDerWaalsContact C-N 3.33Å; D496-R498 WeakPolarHBondContact OD1-CB 3.39Å; D496-R498 PolarHBondContact OD1-N 3.49Å; D496-R498 VanDerWaalsContact OD1-N 3.11Å
499	S	33.6	Very low	37.5	Very low	102 Å²	102	153.7 Å²	153.7	71%	0.713	79%	0.793	S	S	*	*			trans	-120.2	113.3	174.8	63.8	0	0	0	0	113.3
500	Q	38.6	Very low	37.7	Very low	172 Å²	172	154.4 Å²	154.4	80%	0.804	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-62.8	144.5	168.1	-74.8	-77.6	1.1	0	0	111.1	V502	Q500-V502 PolarHBondContact O-N 3.01Å
501	P	38.3	Very low	38.3	Very low	120 Å²	120	154.4 Å²	154.4	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75.1	118.9	178	30.3	-32.5	0	0	0	111
502	V	37.4	Very low	38.4	Very low	138 Å²	138	154.2 Å²	154.2	84%	0.836	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-95.4	140.6	169	-155.9	0	0	0	0	109.4	Q500 R504	Q500-V502 PolarHBondContact O-N 3.01Å; V502-R504 PolarHBondContact O-N 2.91Å
503	D	34.6	Very low	39	Very low	109 Å²	109	155.6 Å²	155.6	58%	0.583	77%	0.774	S	S	*	*			trans	-67.1	114.5	-159.5	-155.4	5.4	0	0	0	113.8	R505	D503-R505 VanDerWaalsContact C-N 3.25Å; D503-R505 PolarHBondContact O-N 3.04Å; D503-R505 IonicContact OD1-NE 3.52Å; D503-R505 IonicContact OD2-CZ 2.73Å; D503-R505 IonicContact OD2-NE 3.16Å; D503-R505 PolarHBondContact OD2-NE 2.93Å; D503-R505 IonicContact OD2-NH2 3.63Å; D503-R505 PolarHBondContact OD2-NH2 3.14Å
504	R	41.7	Very low	39.2	Very low	242 Å²	242	154.6 Å²	154.6	91%	0.913	77%	0.77	S	S	*	*			trans	-78.9	66.8	-179.8	-90.2	-170.2	174.6	172	1.2	112.6	V502	V502-R504 PolarHBondContact O-N 2.91Å
505	R	40.1	Very low	39.3	Very low	188 Å²	188	155.6 Å²	155.6	71%	0.709	78%	0.776	S	S	*	*			trans	-83.6	156	159.9	-53.7	-173.6	-163	-125.4	-5	108.6	D503	D503-R505 VanDerWaalsContact C-N 3.25Å; D503-R505 PolarHBondContact O-N 3.04Å; D503-R505 IonicContact OD1-NE 3.52Å; D503-R505 IonicContact OD2-CZ 2.73Å; D503-R505 IonicContact OD2-NE 3.16Å; D503-R505 PolarHBondContact OD2-NE 2.93Å; D503-R505 IonicContact OD2-NH2 3.63Å; D503-R505 PolarHBondContact OD2-NH2 3.14Å
506	F	35.8	Very low	39.1	Very low	196 Å²	196	157.7 Å²	157.7	86%	0.86	78%	0.781	S	S	*	*			trans	69.2	61.3	-171.7	-52.9	-76.8	0	0	0	116.8
507	S	40.8	Very low	39.5	Very low	122 Å²	122	155.1 Å²	155.1	85%	0.853	79%	0.785	S	S	*	*			trans	-107.1	47.4	164.8	-178.9	0	0	0	0	112.2
508	S	35.7	Very low	39.3	Very low	98 Å²	98	151.5 Å²	151.5	69%	0.685	78%	0.775	S	S	*	*			trans	-138.2	2.5	-167	52.2	0	0	0	0	116.3
509	V	36.6	Very low	39.2	Very low	123 Å²	123	150.1 Å²	150.1	75%	0.745	77%	0.771	S	S	*	*			trans	-98.4	135.3	176.2	-175.5	0	0	0	0	110.1
510	R	40.2	Very low	39.6	Very low	195 Å²	195	149.4 Å²	149.4	74%	0.736	76%	0.759	S	S	*	*			trans	-82.7	159.2	-179.9	-71.2	-176.9	166.7	-157	-4.8	112.2	D512	R510-D512 VanDerWaalsContact C-N 3.31Å; R510-D512 VanDerWaalsContact C-OD1 3.28Å; R510-D512 WeakPolarHBondContact CB-OD1 3.42Å; R510-D512 PolarHBondContact O-N 3.4Å
511	R	42.4	Very low	39.9	Very low	240 Å²	240	150.2 Å²	150.2	91%	0.906	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	22.8	-166.2	-152.2	171.7	-177	153.1	0	113.9
512	D	40.7	Very low	40.3	Very low	118 Å²	118	150.1 Å²	150.1	63%	0.631	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	0.2	-172	44.1	-10.1	0	0	0	114.1	R510	R510-D512 VanDerWaalsContact C-N 3.31Å; R510-D512 VanDerWaalsContact C-OD1 3.28Å; R510-D512 WeakPolarHBondContact CB-OD1 3.42Å; R510-D512 PolarHBondContact O-N 3.4Å
513	V	43.1	Very low	40.7	Very low	103 Å²	103	151.4 Å²	151.4	62%	0.624	74%	0.737	S	S	*	*	S	Bend	trans	-83.4	-17	-178.5	-174.7	0	0	0	0	113.5	L515	V513-L515 VanDerWaalsContact C-N 3.29Å; V513-L515 PolarHBondContact O-N 2.88Å; V513-L515 VanDerWaalsContact O-N 3.13Å
514	F	40.3	Very low	41.1	Very low	181 Å²	181	151.1 Å²	151.1	79%	0.794	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	18.5	-168.3	-72.1	-74.8	0	0	0	116.4
515	L	44.3	Very low	41.2	Very low	172 Å²	172	147 Å²	147	90%	0.901	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	26.8	-177.8	-129.5	88.4	0	0	0	115.7	V513	V513-L515 VanDerWaalsContact C-N 3.29Å; V513-L515 PolarHBondContact O-N 2.88Å; V513-L515 VanDerWaalsContact O-N 3.13Å
516	N	35.3	Very low	41.5	Very low	154 Å²	154	145.3 Å²	145.3	82%	0.824	72%	0.721	S	S	*	*	S	Bend	trans	-148.1	133.7	153.8	-154.3	16.6	0	0	0	110.7	S518	N516-S518 PolarHBondContact O-N 2.57Å
517	G	43.2	Very low	42.2	Very low	79 Å²	79	143.1 Å²	143.1	81%	0.814	71%	0.713	S	S	*	*			trans	-76.7	118.5	-172.7	0	0	0	0	0	113
518	S	37.9	Very low	42.5	Very low	99 Å²	99	144.5 Å²	144.5	69%	0.692	71%	0.71	S	S	*	*			trans	-126.8	140.5	160.2	-171	0	0	0	0	109.5	N516	N516-S518 PolarHBondContact O-N 2.57Å
519	Y	42.2	Very low	43	Very low	202 Å²	202	144.4 Å²	144.4	79%	0.792	71%	0.706	S	S	*	*			trans	-99.8	11.6	-163	-127	-95	0	0	0	114.4	Y521 M522	Y519-Y521 PolarHBondContact O-N 2.94Å; Y519-M522 HydrophobicContact CD1-CE 3.87Å; Y519-M522 HydrophobicContact CE1-CE 3.5Å
520	D	43.5	Very low	43.5	Very low	87 Å²	87	141.2 Å²	141.2	47%	0.465	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	-16.7	-168.9	-84.1	-48.3	0	0	0	116	M522 R523	D520-M522 PolarHBondContact O-N 3.12Å; D520-R523 VanDerWaalsContact O-CB 3.27Å; D520-R523 WeakPolarHBondContact O-CB 3.23Å; D520-R523 PolarHBondContact O-N 2.8Å; D520-R523 IonicContact OD1-NH2 2.73Å
521	Y	43.7	Very low	43.9	Very low	188 Å²	188	138 Å²	138	74%	0.737	70%	0.702	S	S	*	*	H	α-helix	trans	-60.7	-22.6	-173.6	-168.4	-104.6	0	0	0	114.5	Y519	Y519-Y521 PolarHBondContact O-N 2.94Å
522	M	47.8	Very low	43.9	Very low	119 Å²	119	132.4 Å²	132.4	59%	0.586	70%	0.697	S	S	*	*	H	α-helix	trans	-81.7	-12.3	174.1	-71.9	-171.7	-70.8	0	0	114.1	Y519 D520 H526	Y519-M522 HydrophobicContact CD1-CE 3.87Å; Y519-M522 HydrophobicContact CE1-CE 3.5Å; D520-M522 PolarHBondContact O-N 3.12Å; M522-H526 PolarHBondContact O-CD2 3.49Å
523	R	45.2	Very low	44.3	Very low	164 Å²	164	130.8 Å²	130.8	62%	0.619	70%	0.7	S	S	*	*	H	α-helix	trans	-71	-55.4	177.5	-166.6	87.9	68.8	155.7	5.1	110.7	D520 Y525 H526	D520-R523 VanDerWaalsContact O-CB 3.27Å; D520-R523 WeakPolarHBondContact O-CB 3.23Å; D520-R523 PolarHBondContact O-N 2.8Å; D520-R523 IonicContact OD1-NH2 2.73Å; R523-Y525 VanDerWaalsContact C-N 3.34Å; R523-Y525 PolarHBondContact O-N 2.87Å; R523-H526 PolarHBondContact O-N 3Å
524	D	42.4	Very low	44.1	Very low	103 Å²	103	131.3 Å²	131.3	55%	0.551	71%	0.706	S	S	*	*	H	α-helix	trans	-68.7	-33	-170.2	-59.1	-27.9	0	0	0	112.5	H526 H527 N528	D524-H526 PolarHBondContact O-N 2.85Å; D524-H527 PolarHBondContact O-N 3.25Å; D524-H527 VanDerWaalsContact O-N 3.08Å; D524-N528 PolarHBondContact O-N 3.03Å
525	Y	44.7	Very low	44.1	Very low	156 Å²	156	134.8 Å²	134.8	61%	0.612	71%	0.714	S	S	*	*	H	α-helix	trans	-62.9	-31.6	178.8	-152	-84.1	0	0	0	112.4	R523 H527 V529	R523-Y525 VanDerWaalsContact C-N 3.34Å; R523-Y525 PolarHBondContact O-N 2.87Å; Y525-H527 VanDerWaalsContact C-N 3.35Å; Y525-V529 HydrophobicContact CE1-CG2 4.38Å
526	H	46.2	Very low	43.7	Very low	153 Å²	153	135.7 Å²	135.7	71%	0.708	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	1.1	176.4	-81.5	-67.4	0	0	0	114.4	M522 R523 D524	M522-H526 PolarHBondContact O-CD2 3.49Å; R523-H526 PolarHBondContact O-N 3Å; D524-H526 PolarHBondContact O-N 2.85Å
527	H	49.8	Very low	43.9	Very low	149 Å²	149	134.5 Å²	134.5	69%	0.69	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-20.3	176	-75.4	16.1	0	0	0	113.4	D524 Y525	D524-H527 PolarHBondContact O-N 3.25Å; D524-H527 VanDerWaalsContact O-N 3.08Å; Y525-H527 VanDerWaalsContact C-N 3.35Å
528	N	47	Very low	43.6	Very low	151 Å²	151	138.8 Å²	138.8	81%	0.807	72%	0.715	S	S	*	*	S	Bend	trans	-98.7	0.9	177.4	-79	-25.5	0	0	0	114.8	D524	D524-N528 PolarHBondContact O-N 3.03Å
529	V	46.6	Very low	43.5	Very low	96 Å²	96	138.7 Å²	138.7	58%	0.582	72%	0.721	S	S	*	*	S	Bend	trans	-118.8	111.5	172.8	-172.8	0	0	0	0	108.5	Y525	Y525-V529 HydrophobicContact CE1-CG2 4.38Å
530	G	46.7	Very low	42.9	Very low	57 Å²	57	133.8 Å²	133.8	59%	0.588	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-66.7	167.5	176.9	0	0	0	0	0	112.8
531	P	48.2	Very low	42.4	Very low	127 Å²	127	140.5 Å²	140.5	83%	0.825	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-55.6	140	179.6	-24.2	34.1	0	0	0	112
532	P	43.8	Very low	42.2	Very low	123 Å²	123	137.4 Å²	137.4	80%	0.799	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-63	140.6	176	27.5	-34.4	0	0	0	110.3
533	A	48.2	Very low	41.9	Very low	84 Å²	84	135.2 Å²	135.2	69%	0.694	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-62.7	144.1	177.3	0	0	0	0	0	111.2
534	P	40.2	Very low	41.7	Very low	114 Å²	114	134.8 Å²	134.8	74%	0.74	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-63.9	142.5	173.5	28	-34.3	0	0	0	110.5	Q536	P534-Q536 PolarHBondContact O-N 3.27Å; P534-Q536 VanDerWaalsContact O-N 3.13Å
535	W	38.7	Very low	41.7	Very low	253 Å²	253	138 Å²	138	96%	0.958	78%	0.78	S	S	*	*			trans	-64.7	111.5	-177.3	-68.9	67.1	0	0	0	110.6	T537	W535-T537 PolarHBondContact O-N 3.21Å
536	Q	37.6	Very low	41.2	Very low	191 Å²	191	139.5 Å²	139.5	89%	0.893	79%	0.793	S	S	*	*			trans	-80.6	108.6	167.2	-69.7	-172.4	-7.9	0	0	108.9	P534	P534-Q536 PolarHBondContact O-N 3.27Å; P534-Q536 VanDerWaalsContact O-N 3.13Å
537	T	38.7	Very low	40.7	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-67.7	155.9	174.2	47.2	0	0	0	0	111.6	W535	W535-T537 PolarHBondContact O-N 3.21Å
538	L	36	Very low	40.3	Very low	168 Å²	168	139 Å²	139	88%	0.88	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-62.2	164.5	-179	-83.2	73	0	0	0	113
539	A	35.6	Very low	40.2	Very low	98 Å²	98	137.3 Å²	137.3	81%	0.81	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-54.5	146.6	-175.9	0	0	0	0	0	114.2
540	A	30.8	Very low	39.7	Very low	99 Å²	99	140.4 Å²	140.4	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-71.7	135.4	178.2	0	0	0	0	0	112.3
541	Y	33.6	Very low	39.1	Very low	227 Å²	227	146.5 Å²	146.5	89%	0.89	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-91.1	136.6	158.5	-103.3	-96	0	0	0	109.3
542	P	39.1	Very low	38.8	Very low	123 Å²	123	145.9 Å²	145.9	80%	0.799	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-84.3	142.8	-179	32.8	-34.1	0	0	0	112.6
543	G	40.2	Very low	38.6	Very low	74 Å²	74	145.2 Å²	145.2	76%	0.763	81%	0.811	S	S	*	*			trans	89.1	67.9	151.9	0	0	0	0	0	118.3
544	V	42.8	Very low	38	Very low	154 Å²	154	152.6 Å²	152.6	93%	0.933	82%	0.822	S	S	*	*			trans	-146.3	140	140.7	-108.9	0	0	0	0	110.2
545	E	40.6	Very low	38	Very low	171 Å²	171	155.8 Å²	155.8	80%	0.799	82%	0.821	S	S	*	*			trans	-101.1	139.7	-173	-177.5	178.7	-179.9	0	0	111.1
546	Q	35.9	Very low	37.9	Very low	187 Å²	187	153.1 Å²	153.1	87%	0.874	82%	0.819	S	S	*	*			trans	-160.5	141.5	166	-118	156.3	98.6	0	0	111.2
547	Q	35.7	Very low	38.1	Very low	174 Å²	174	151.1 Å²	151.1	81%	0.813	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.6	152.3	-171.7	-71.1	-172.9	-8.8	0	0	113.7
548	P	40.6	Very low	38.1	Very low	119 Å²	119	150.3 Å²	150.3	77%	0.773	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-91	134.4	179.7	34.4	-33	0	0	0	113.4
549	P	45.5	Very low	38.4	Very low	114 Å²	114	150.8 Å²	150.8	74%	0.74	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-82.4	122.5	158.4	31.5	-29.2	0	0	0	110.8
550	H	34.4	Very low	39.2	Very low	162 Å²	162	151.5 Å²	151.5	75%	0.75	80%	0.802	S	S	*	*			trans	6.7	131.8	158.6	-45.7	-82.1	0	0	0	120.1
551	H	35.8	Very low	40.3	Very low	184 Å²	184	152.4 Å²	152.4	85%	0.852	80%	0.8	S	S	*	*				-170.8	145.8	105.8	-79.4	-46.5	0	0	0	110.7
552	P	40.6	Very low	41.4	Very low	115 Å²	115	147.2 Å²	147.2	75%	0.747	79%	0.794	S	S	*	*			trans	-84	158.9	-174.4	33.6	-35.9	0	0	0	114.1
553	P	39.3	Very low	42.1	Very low	109 Å²	109	146.2 Å²	146.2	71%	0.708	79%	0.788	S	S	*	*			trans	-81.5	137.2	-173.4	32	-35.5	0	0	0	114.1	Y555	P553-Y555 PolarHBondContact O-N 3.1Å
554	Y	35.4	Very low	42.3	Very low	238 Å²	238	148.6 Å²	148.6	93%	0.933	79%	0.79	S	S	*	*			trans	-76.4	104.1	165.5	-94.3	-93.9	0	0	0	110.7
555	Y	41.4	Very low	42.2	Very low	181 Å²	181	150.2 Å²	150.2	71%	0.71	79%	0.787	S	S	*	*			trans	-79.9	121.5	167.8	-106.1	-93.6	0	0	0	110.8	P553 H557	P553-Y555 PolarHBondContact O-N 3.1Å; Y555-H557 VanDerWaalsContact CB-CE1 3.47Å; Y555-H557 WeakPolarHBondContact CB-CE1 3.37Å; Y555-H557 PolarHBondContact O-N 2.67Å; Y555-H557 PolarHBondContact O-ND1 2.75Å
556	H	37	Very low	42	Very low	197 Å²	197	150.5 Å²	150.5	91%	0.912	79%	0.788	S	S	*	*			trans	-62.3	106.9	164.7	-89	-83.6	0	0	0	109.9
557	H	41.3	Very low	42	Very low	150 Å²	150	146.1 Å²	146.1	69%	0.694	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-96.9	119.7	172.1	-75.4	77.5	0	0	0	110.1	Y555 H559	Y555-H557 VanDerWaalsContact CB-CE1 3.47Å; Y555-H557 WeakPolarHBondContact CB-CE1 3.37Å; Y555-H557 PolarHBondContact O-N 2.67Å; Y555-H557 PolarHBondContact O-ND1 2.75Å; H557-H559 PolarHBondContact O-N 3.2Å
558	S	38.8	Very low	42	Very low	113 Å²	113	146.6 Å²	146.6	79%	0.79	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.4	119.4	165	52	0	0	0	0	109.6
559	H	41.7	Very low	41.7	Very low	178 Å²	178	148.7 Å²	148.7	82%	0.824	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-67.9	132.9	177.6	-67.2	-82.6	0	0	0	112	H557	H557-H559 PolarHBondContact O-N 3.2Å
560	P	52.8	Low	41.3	Very low	112 Å²	112	151 Å²	151	73%	0.727	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.7	158.7	166.7	32.3	-34.5	0	0	0	111.2
561	P	53.4	Low	41.3	Very low	119 Å²	119	151.5 Å²	151.5	77%	0.773	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-69.8	152.5	176.5	30.1	-35.6	0	0	0	112.4
562	P	57	Low	41.4	Very low	117 Å²	117	151.1 Å²	151.1	76%	0.76	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71.9	151.9	177.2	30.5	-35.3	0	0	0	112.5
563	P	54.1	Low	41.4	Very low	103 Å²	103	151.4 Å²	151.4	67%	0.669	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75.6	159.1	-179.7	32.2	-36.3	0	0	0	113
564	P	44.9	Very low	41.1	Very low	124 Å²	124	152 Å²	152	81%	0.805	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-72.2	128.7	175	29.9	-34.1	0	0	0	111.5	Q566	P564-Q566 PolarHBondContact O-N 3.42Å
565	H	39.6	Very low	41.4	Very low	188 Å²	188	148.3 Å²	148.3	87%	0.87	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.5	125.9	173.2	-75	-83.2	0	0	0	111.2
566	Q	36.7	Very low	41.8	Very low	177 Å²	177	145 Å²	145	83%	0.827	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75.3	152.5	171.4	-67.7	178.4	-15	0	0	111	P564	P564-Q566 PolarHBondContact O-N 3.42Å
567	A	35.5	Very low	42.1	Very low	94 Å²	94	141.6 Å²	141.6	78%	0.777	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73	130.9	-177.4	0	0	0	0	0	112.2
568	F	36.2	Very low	42	Very low	185 Å²	185	143.6 Å²	143.6	81%	0.811	79%	0.793	S	S	*	*			trans	-112.4	116.1	161.9	-92.9	-91.4	0	0	0	109.6	H570	F568-H570 PolarHBondContact O-N 3.01Å
569	H	35.2	Very low	41.9	Very low	163 Å²	163	146.9 Å²	146.9	76%	0.755	80%	0.796	S	S	*	*			trans	-70.4	123.8	166.2	-88.6	-91.1	0	0	0	109.4
570	H	36.7	Very low	42	Very low	163 Å²	163	142.7 Å²	142.7	76%	0.755	79%	0.792	S	S	*	*			trans	-122.9	130	159.4	-87.2	10.9	0	0	0	109.5	F568	F568-H570 PolarHBondContact O-N 3.01Å
571	H	33.9	Very low	41.9	Very low	171 Å²	171	143.1 Å²	143.1	79%	0.792	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-86.2	123.3	-176.5	-63.4	-100.9	0	0	0	109.4
572	H	37.6	Very low	41.6	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.815	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-91.8	128.7	162.3	-73.7	-86.9	0	0	0	108.9
573	P	40.8	Very low	40.9	Very low	122 Å²	122	142.9 Å²	142.9	79%	0.792	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.2	144.4	177.8	28.7	-33.9	0	0	0	111.3
574	S	34.3	Very low	40.3	Very low	120 Å²	120	150 Å²	150	84%	0.839	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71.2	126.9	180	51.8	0	0	0	0	112.3
575	L	41.3	Very low	39.8	Very low	162 Å²	162	152.5 Å²	152.5	85%	0.848	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-80.5	147.7	162.9	-69.6	171.8	0	0	0	110.2
576	P	49	Very low	39.6	Very low	111 Å²	111	152.8 Å²	152.8	72%	0.721	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-73	154.2	-174.7	30.1	-35.8	0	0	0	112.8
577	P	44.2	Very low	39.3	Very low	125 Å²	125	152 Å²	152	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-70.2	141.1	175	30.7	-34.7	0	0	0	111
578	H	38	Very low	39.3	Very low	192 Å²	192	155.2 Å²	155.2	89%	0.889	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-79.5	123	174	-153.6	-64.8	0	0	0	109.4
579	E	37.7	Very low	39.3	Very low	183 Å²	183	154.8 Å²	154.8	86%	0.855	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-65.1	141.4	178.1	-69.4	-176.9	112	0	0	111.5
580	A	43.8	Very low	39	Very low	89 Å²	89	158.5 Å²	158.5	74%	0.736	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-101.9	140	164.5	0	0	0	0	0	108.8
581	P	49.3	Very low	39.2	Very low	121 Å²	121	157 Å²	157	79%	0.786	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.2	145.2	-175.8	26.8	-34.5	0	0	0	112.1
582	P	48.2	Very low	39.3	Very low	113 Å²	113	154.4 Å²	154.4	73%	0.734	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-73.9	151.1	-170.2	29.2	-36.2	0	0	0	113.4	R584	P582-R584 PolarHBondContact O-N 3.06Å
583	P	41.4	Very low	39.1	Very low	119 Å²	119	154.7 Å²	154.7	77%	0.773	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-68.4	127.9	176	29	-34.3	0	0	0	110.8	F585	P583-F585 PolarHBondContact O-N 2.98Å
584	R	41.7	Very low	38.8	Very low	251 Å²	251	158.5 Å²	158.5	95%	0.947	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-70.2	119.9	173.8	-76.1	-174.1	174.8	168.9	-0.4	110.2	P582 R586	P582-R584 PolarHBondContact O-N 3.06Å; R584-R586 PolarHBondContact O-N 3.05Å
585	F	35	Very low	38.7	Very low	177 Å²	177	162.4 Å²	162.4	78%	0.776	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-83.8	118.4	-174.2	-143.2	-107.2	0	0	0	111.4	P583	P583-F585 PolarHBondContact O-N 2.98Å
586	R	34.5	Very low	38.9	Very low	194 Å²	194	159.5 Å²	159.5	73%	0.732	81%	0.809	S	S	*	*			trans	53.7	103.8	141.6	-167.3	-172.7	-152	166.1	9	117.8	R584	R584-R586 PolarHBondContact O-N 3.05Å
587	D	30.9	Very low	38.4	Very low	162 Å²	162	162.5 Å²	162.5	87%	0.866	81%	0.811	S	S	*	*			trans	-106.3	163.2	142.9	-139.4	-33.6	0	0	0	110.8
588	K	36.9	Very low	38.4	Very low	160 Å²	160	161.2 Å²	161.2	70%	0.696	81%	0.811	S	S	*	*			trans	-104.3	132.2	-159	-65.2	176.3	-176	170.9	0	114.7
589	Q	34.8	Very low	38.6	Very low	176 Å²	176	157.6 Å²	157.6	82%	0.822	81%	0.807	S	S	*	*			trans	53.6	88.4	130.1	-166.3	-179.4	8.5	0	0	117.7
590	R	29.8	Very low	39.5	Very low	241 Å²	241	152.1 Å²	152.1	91%	0.909	79%	0.789	S	S	*	*			trans	-133.4	142.1	140.3	-76.2	-166.6	177	-129.5	-2.4	109.6
591	V	40.8	Very low	40	Very low	133 Å²	133	152.7 Å²	152.7	81%	0.806	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-98.2	120.4	176.6	177.5	0	0	0	0	108.8
592	P	34.9	Very low	40.1	Very low	116 Å²	116	153.4 Å²	153.4	75%	0.753	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-87.8	136.8	156.2	-5.3	25.5	0	0	0	109.2
593	Q	34.3	Very low	40.4	Very low	182 Å²	182	151.9 Å²	151.9	85%	0.85	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-61.5	143	-177.3	-64.4	160.4	-33.8	0	0	111.9	R595	Q593-R595 PolarHBondContact O-N 2.77Å
594	H	33.2	Very low	41.3	Very low	201 Å²	201	154.6 Å²	154.6	93%	0.931	76%	0.76	S	S	*	*			trans	-64.4	98.3	162.8	-88.3	-105.1	0	0	0	109.2
595	R	34.2	Very low	42.2	Very low	203 Å²	203	147 Å²	147	77%	0.766	74%	0.738	S	S	*	*			trans	-82.6	121.5	154.2	-101.9	-176.4	172.6	157.6	-1.6	107.6	Q593 F597	Q593-R595 PolarHBondContact O-N 2.77Å; R595-F597 HydrophobicContact CB-CD2 4.11Å; R595-F597 HydrophobicContact CB-CE2 3.83Å; R595-F597 PolarHBondContact O-N 3.41Å
596	A	44.7	Very low	43.8	Very low	101 Å²	101	144.6 Å²	144.6	84%	0.835	73%	0.731	S	S	*	*			trans	-60.8	130.3	162.4	0	0	0	0	0	108.8
597	F	39.1	Very low	45.7	Very low	173 Å²	173	143.3 Å²	143.3	76%	0.759	73%	0.726	S	S	*	*			trans	-127	134.1	163.4	-83.4	-77.6	0	0	0	106.8	R595	R595-F597 HydrophobicContact CB-CD2 4.11Å; R595-F597 HydrophobicContact CB-CE2 3.83Å; R595-F597 PolarHBondContact O-N 3.41Å
598	A	42.3	Very low	47.5	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	70%	0.704	S	S	*	*			trans	-64.7	146.6	-168.4	0	0	0	0	0	112.5	S600	A598-S600 PolarHBondContact O-N 3.07Å
599	S	42.8	Very low	49	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	69%	0.69	S	S	*	*			trans	-63.6	103.3	163.8	46.4	0	0	0	0	109.4
600	S	56.6	Low	50.9	Low	68 Å²	68	130.4 Å²	130.4	48%	0.476	67%	0.672	S	S	.	*			trans	-65.8	135.1	171.5	-177.7	0	0	0	0	109.8	A598 H602 D603	A598-S600 PolarHBondContact O-N 3.07Å; S600-H602 PolarHBondContact O-N 3.36Å; S600-H602 VanDerWaalsContact O-N 3.1Å; S600-D603 PolarHBondContact O-N 3.49Å
601	P	54.4	Low	53.1	Low	101 Å²	101	125.3 Å²	125.3	66%	0.656	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	-35.9	-178.9	-30.3	36.3	0	0	0	114.4	D603 Y604 D605	P601-D603 PolarHBondContact O-N 2.96Å; P601-D603 VanDerWaalsContact O-N 3.15Å; P601-Y604 WeakPolarHBondContact O-CA 3.47Å; P601-Y604 VanDerWaalsContact O-CB 3.31Å; P601-Y604 WeakPolarHBondContact O-CB 3.11Å; P601-Y604 PolarHBondContact O-N 3.03Å; P601-D605 PolarHBondContact O-N 3.12Å
602	H	51.7	Low	54.9	Low	137 Å²	137	122.6 Å²	122.6	63%	0.634	64%	0.638	S	S	*	*	H	α-helix	trans	-59.2	-25.3	177.3	-79.8	-31.8	0	0	0	115	S600 Y604 D605 M606	S600-H602 PolarHBondContact O-N 3.36Å; S600-H602 VanDerWaalsContact O-N 3.1Å; H602-Y604 PolarHBondContact O-N 3.16Å; H602-D605 IonicContact ND1-OD2 2.71Å; H602-D605 PolarHBondContact ND1-OD2 3.01Å; H602-D605 PolarHBondContact O-N 3.28Å; H602-M606 WeakPolarHBondContact O-CB 3.31Å; H602-M606 WeakPolarHBondContact O-CG 3.2Å; H602-M606 PolarHBondContact O-N 2.82Å
603	D	54.1	Low	56.7	Low	81 Å²	81	122.8 Å²	122.8	43%	0.433	62%	0.623	S	S	.	*	H	α-helix	trans	-76.5	-13.5	176.5	-159.6	60.6	0	0	0	112.2	S600 P601 R607	S600-D603 PolarHBondContact O-N 3.49Å; P601-D603 PolarHBondContact O-N 2.96Å; P601-D603 VanDerWaalsContact O-N 3.15Å; D603-R607 WeakPolarHBondContact O-CD 3.36Å; D603-R607 WeakPolarHBondContact O-CG 3.39Å; D603-R607 PolarHBondContact O-NE 3.02Å; D603-R607 IonicContact OD2-CZ 2.65Å; D603-R607 IonicContact OD2-NE 3.92Å; D603-R607 PolarHBondContact OD2-NE 3.44Å; D603-R607 IonicContact OD2-NH2 3.28Å; D603-R607 PolarHBondContact OD2-NH2 3.03Å
604	Y	60.7	Low	58.2	Low	176 Å²	176	123.2 Å²	123.2	69%	0.69	62%	0.617	S	S	*	*	H	α-helix	trans	-83.9	-48.2	168.1	-149.5	-86.3	0	0	0	110.8	P601 H602 M606 R607 V608	P601-Y604 WeakPolarHBondContact O-CA 3.47Å; P601-Y604 VanDerWaalsContact O-CB 3.31Å; P601-Y604 WeakPolarHBondContact O-CB 3.11Å; P601-Y604 PolarHBondContact O-N 3.03Å; H602-Y604 PolarHBondContact O-N 3.16Å; Y604-M606 VanDerWaalsContact C-N 3.33Å; Y604-M606 PolarHBondContact O-N 3.17Å; Y604-R607 PolarHBondContact O-N 2.93Å; Y604-V608 HydrophobicContact CD1-CG2 3.83Å; Y604-V608 HydrophobicContact CE1-CG2 3.92Å; Y604-V608 PolarHBondContact O-N 2.83Å
605	D	60.9	Low	59.5	Low	91 Å²	91	116.1 Å²	116.1	49%	0.487	59%	0.588	S	S	.	*	H	α-helix	trans	-51.4	-51.6	174.7	-66	-35	0	0	0	111.2	P601 H602 R607 V608 D609	P601-D605 PolarHBondContact O-N 3.12Å; H602-D605 IonicContact ND1-OD2 2.71Å; H602-D605 PolarHBondContact ND1-OD2 3.01Å; H602-D605 PolarHBondContact O-N 3.28Å; D605-R607 PolarHBondContact O-N 3.45Å; D605-R607 VanDerWaalsContact O-N 3.12Å; D605-V608 PolarHBondContact O-N 2.89Å; D605-V608 VanDerWaalsContact O-N 3.17Å; D605-D609 WeakPolarHBondContact O-CB 3.36Å; D605-D609 PolarHBondContact O-N 3.4Å
606	M	69	Low	60.6	Low	126 Å²	126	112.6 Å²	112.6	62%	0.621	58%	0.58	S	S	*	*	H	α-helix	trans	-49.8	-38.9	177.2	-82.2	-81.4	-70.4	0	0	113.2	H602 Y604 D610	H602-M606 WeakPolarHBondContact O-CB 3.31Å; H602-M606 WeakPolarHBondContact O-CG 3.2Å; H602-M606 PolarHBondContact O-N 2.82Å; Y604-M606 VanDerWaalsContact C-N 3.33Å; Y604-M606 PolarHBondContact O-N 3.17Å; M606-D610 WeakPolarHBondContact O-CB 3.2Å; M606-D610 PolarHBondContact O-N 3.49Å; M606-D610 VanDerWaalsContact O-N 3.16Å
607	R	74.1	Confident	61.1	Low	167 Å²	167	110.4 Å²	110.4	63%	0.63	56%	0.562	S	S	*	*	H	α-helix	trans	-80.4	-40.7	-177.6	-63.6	168.2	-168.8	-150	3.2	111.9	D603 Y604 D605 D609 F611	D603-R607 WeakPolarHBondContact O-CD 3.36Å; D603-R607 WeakPolarHBondContact O-CG 3.39Å; D603-R607 PolarHBondContact O-NE 3.02Å; D603-R607 IonicContact OD2-CZ 2.65Å; D603-R607 IonicContact OD2-NE 3.92Å; D603-R607 PolarHBondContact OD2-NE 3.44Å; D603-R607 IonicContact OD2-NH2 3.28Å; D603-R607 PolarHBondContact OD2-NH2 3.03Å; Y604-R607 PolarHBondContact O-N 2.93Å; D605-R607 PolarHBondContact O-N 3.45Å; D605-R607 VanDerWaalsContact O-N 3.12Å; R607-D609 VanDerWaalsContact C-N 3.34Å; R607-F611 WeakPolarHBondContact O-CB 3.1Å; R607-F611 PolarHBondContact O-N 3.01Å
608	V	68	Low	61.9	Low	66 Å²	66	107 Å²	107	40%	0.4	56%	0.556	S	S	.	*	H	α-helix	trans	-62.6	-44.3	174.1	173.1	0	0	0	0	110.3	Y604 D605 F611 L612	Y604-V608 HydrophobicContact CD1-CG2 3.83Å; Y604-V608 HydrophobicContact CE1-CG2 3.92Å; Y604-V608 PolarHBondContact O-N 2.83Å; D605-V608 PolarHBondContact O-N 2.89Å; D605-V608 VanDerWaalsContact O-N 3.17Å; V608-F611 WeakPolarHBondContact O-CB 3.5Å; V608-F611 PolarHBondContact O-N 3.44Å; V608-L612 HydrophobicContact CG1-CD1 3.96Å; V608-L612 HydrophobicContact CG1-CG 4.43Å; V608-L612 WeakPolarHBondContact O-CB 3.48Å; V608-L612 VanDerWaalsContact O-CG 3.31Å; V608-L612 WeakPolarHBondContact O-CG 3.49Å; V608-L612 PolarHBondContact O-N 3.15Å
609	D	69.1	Low	62.5	Low	76 Å²	76	107 Å²	107	41%	0.406	55%	0.545	S	S	.	.	H	α-helix	trans	-70.9	-34.5	-176.2	-164.4	31.6	0	0	0	111.8	D605 R607 R613	D605-D609 WeakPolarHBondContact O-CB 3.36Å; D605-D609 PolarHBondContact O-N 3.4Å; R607-D609 VanDerWaalsContact C-N 3.34Å; D609-R613 VanDerWaalsContact CG-CZ 3.49Å; D609-R613 WeakPolarHBondContact O-CG 3.45Å; D609-R613 PolarHBondContact O-N 2.8Å; D609-R613 PolarHBondContact O-NE 3.11Å; D609-R613 IonicContact OD1-CZ 2.69Å; D609-R613 IonicContact OD1-NH1 3.26Å; D609-R613 PolarHBondContact OD1-NH1 2.83Å; D609-R613 IonicContact OD1-NH2 3.73Å; D609-R613 IonicContact OD2-CZ 3.41Å; D609-R613 IonicContact OD2-NH1 3.56Å; D609-R613 PolarHBondContact OD2-NH1 2.79Å; D609-R613 IonicContact OD2-NH2 2.73Å; D609-R613 PolarHBondContact OD2-NH2 3.08Å
610	D	74.4	Confident	63	Low	85 Å²	85	104.6 Å²	104.6	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-73.3	-35	170.5	-151.6	57.8	0	0	0	113	M606 R613 R614	M606-D610 WeakPolarHBondContact O-CB 3.2Å; M606-D610 PolarHBondContact O-N 3.49Å; M606-D610 VanDerWaalsContact O-N 3.16Å; D610-R613 PolarHBondContact O-N 2.83Å; D610-R613 IonicContact OD1-NE 3.96Å; D610-R614 WeakPolarHBondContact O-CB 3.31Å; D610-R614 PolarHBondContact O-N 2.82Å
611	F	75.6	Confident	62.8	Low	134 Å²	134	104.4 Å²	104.4	59%	0.588	53%	0.527	S	S	*	.	H	α-helix	trans	-62.5	-42	169.7	176.8	-95.6	0	0	0	111.9	R607 V608 R614 T615	R607-F611 WeakPolarHBondContact O-CB 3.1Å; R607-F611 PolarHBondContact O-N 3.01Å; V608-F611 WeakPolarHBondContact O-CB 3.5Å; V608-F611 PolarHBondContact O-N 3.44Å; F611-R614 PolarHBondContact O-N 3.5Å; F611-T615 HydrophobicContact CD1-CG2 4.37Å; F611-T615 HydrophobicContact CD2-CG2 4.37Å; F611-T615 HydrophobicContact CE1-CG2 4.03Å; F611-T615 HydrophobicContact CE2-CG2 4.03Å; F611-T615 HydrophobicContact CZ-CG2 3.86Å; F611-T615 WeakPolarHBondContact O-CB 3.14Å; F611-T615 WeakPolarHBondContact O-CG2 3.46Å; F611-T615 PolarHBondContact O-N 2.88Å; F611-T615 PolarHBondContact O-OG1 3.3Å
612	L	78.4	Confident	62.8	Low	76 Å²	76	109.1 Å²	109.1	40%	0.398	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-47.1	174.7	-74.4	170.5	0	0	0	111.5	V608 R614 T615 Q616	V608-L612 HydrophobicContact CG1-CD1 3.96Å; V608-L612 HydrophobicContact CG1-CG 4.43Å; V608-L612 WeakPolarHBondContact O-CB 3.48Å; V608-L612 VanDerWaalsContact O-CG 3.31Å; V608-L612 WeakPolarHBondContact O-CG 3.49Å; V608-L612 PolarHBondContact O-N 3.15Å; L612-R614 VanDerWaalsContact C-N 3.33Å; L612-R614 PolarHBondContact O-N 3.29Å; L612-T615 PolarHBondContact O-N 3.49Å; L612-T615 PolarHBondContact O-OG1 2.83Å; L612-Q616 VanDerWaalsContact O-CB 3.27Å; L612-Q616 WeakPolarHBondContact O-CB 3.26Å; L612-Q616 VanDerWaalsContact O-CG 3.26Å; L612-Q616 WeakPolarHBondContact O-CG 3.27Å; L612-Q616 PolarHBondContact O-N 3.41Å
613	R	72.4	Confident	62.8	Low	121 Å²	121	110 Å²	110	46%	0.457	53%	0.53	S	S	.	.	H	α-helix	trans	-55.3	-47.7	172.9	-81.4	-177.6	-83.8	-83.2	3.5	111.9	D609 D610 A617	D609-R613 VanDerWaalsContact CG-CZ 3.49Å; D609-R613 WeakPolarHBondContact O-CG 3.45Å; D609-R613 PolarHBondContact O-N 2.8Å; D609-R613 PolarHBondContact O-NE 3.11Å; D609-R613 IonicContact OD1-CZ 2.69Å; D609-R613 IonicContact OD1-NH1 3.26Å; D609-R613 PolarHBondContact OD1-NH1 2.83Å; D609-R613 IonicContact OD1-NH2 3.73Å; D609-R613 IonicContact OD2-CZ 3.41Å; D609-R613 IonicContact OD2-NH1 3.56Å; D609-R613 PolarHBondContact OD2-NH1 2.79Å; D609-R613 IonicContact OD2-NH2 2.73Å; D609-R613 PolarHBondContact OD2-NH2 3.08Å; D610-R613 PolarHBondContact O-N 2.83Å; D610-R613 IonicContact OD1-NE 3.96Å; R613-A617 WeakPolarHBondContact O-CB 3.48Å; R613-A617 PolarHBondContact O-N 3.41Å
614	R	66.4	Low	62.7	Low	190 Å²	190	112.6 Å²	112.6	72%	0.717	54%	0.539	S	S	*	.	H	α-helix	trans	-70	-35.1	-175.7	-164.9	169.1	-173.7	163.3	-0.9	113.2	D610 F611 L612	D610-R614 WeakPolarHBondContact O-CB 3.31Å; D610-R614 PolarHBondContact O-N 2.82Å; F611-R614 PolarHBondContact O-N 3.5Å; L612-R614 VanDerWaalsContact C-N 3.33Å; L612-R614 PolarHBondContact O-N 3.29Å
615	T	61.3	Low	62.4	Low	53 Å²	53	112.2 Å²	112.2	33%	0.325	54%	0.536	S	S	.	.	H	α-helix	trans	-76.8	-43.4	175.1	51.5	0	0	0	0	112.1	F611 L612 A617 V618 V619	F611-T615 HydrophobicContact CD1-CG2 4.37Å; F611-T615 HydrophobicContact CD2-CG2 4.37Å; F611-T615 HydrophobicContact CE1-CG2 4.03Å; F611-T615 HydrophobicContact CE2-CG2 4.03Å; F611-T615 HydrophobicContact CZ-CG2 3.86Å; F611-T615 WeakPolarHBondContact O-CB 3.14Å; F611-T615 WeakPolarHBondContact O-CG2 3.46Å; F611-T615 PolarHBondContact O-N 2.88Å; F611-T615 PolarHBondContact O-OG1 3.3Å; L612-T615 PolarHBondContact O-N 3.49Å; L612-T615 PolarHBondContact O-OG1 2.83Å; T615-A617 VanDerWaalsContact C-N 3.32Å; T615-A617 PolarHBondContact O-N 3.36Å; T615-V618 PolarHBondContact O-N 2.81Å; T615-V619 PolarHBondContact O-N 3.45Å
616	Q	56.1	Low	61.8	Low	128 Å²	128	114.1 Å²	114.1	60%	0.598	54%	0.542	S	S	*	.	H	α-helix	trans	-61	-38.2	176	-72.8	-173	24.6	0	0	112.4	L612 V618 V619 S620	L612-Q616 VanDerWaalsContact O-CB 3.27Å; L612-Q616 WeakPolarHBondContact O-CB 3.26Å; L612-Q616 VanDerWaalsContact O-CG 3.26Å; L612-Q616 WeakPolarHBondContact O-CG 3.27Å; L612-Q616 PolarHBondContact O-N 3.41Å; Q616-V618 VanDerWaalsContact C-N 3.28Å; Q616-V618 PolarHBondContact O-N 3Å; Q616-V619 PolarHBondContact O-N 2.76Å; Q616-V619 VanDerWaalsContact O-N 3.17Å; Q616-S620 WeakPolarHBondContact O-CB 3.27Å; Q616-S620 PolarHBondContact O-N 3.42Å; Q616-S620 PolarHBondContact O-OG 3.34Å
617	A	56.3	Low	61.1	Low	55 Å²	55	115 Å²	115	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-59.6	-34.4	176.5	0	0	0	0	0	113.6	R613 T615 S620 S621	R613-A617 WeakPolarHBondContact O-CB 3.48Å; R613-A617 PolarHBondContact O-N 3.41Å; T615-A617 VanDerWaalsContact C-N 3.32Å; T615-A617 PolarHBondContact O-N 3.36Å; A617-S620 WeakPolarHBondContact CA-OG 3.48Å; A617-S620 PolarHBondContact O-OG 3.04Å; A617-S620 VanDerWaalsContact O-OG 3.11Å; A617-S621 VanDerWaalsContact O-CB 3.24Å; A617-S621 WeakPolarHBondContact O-CB 3.37Å; A617-S621 PolarHBondContact O-N 2.95Å; A617-S621 VanDerWaalsContact O-N 3.14Å
618	V	56.1	Low	60	Low	103 Å²	103	112 Å²	112	62%	0.624	53%	0.532	S	S	*	.	H	α-helix	trans	-74.2	-38.9	176.4	177.3	0	0	0	0	110.8	T615 Q616 R622	T615-V618 PolarHBondContact O-N 2.81Å; Q616-V618 VanDerWaalsContact C-N 3.28Å; Q616-V618 PolarHBondContact O-N 3Å; V618-R622 WeakPolarHBondContact O-CB 3.34Å; V618-R622 PolarHBondContact O-N 3.48Å; V618-R622 VanDerWaalsContact O-N 3.14Å
619	V	54.7	Low	59.4	Low	96 Å²	96	117 Å²	117	58%	0.582	54%	0.544	S	S	*	.	H	α-helix	trans	-68.7	-43.2	177.6	176.4	0	0	0	0	111.5	T615 Q616 R622 R623	T615-V619 PolarHBondContact O-N 3.45Å; Q616-V619 PolarHBondContact O-N 2.76Å; Q616-V619 VanDerWaalsContact O-N 3.17Å; V619-R622 PolarHBondContact O-N 3.28Å; V619-R623 WeakPolarHBondContact O-CB 3.5Å; V619-R623 PolarHBondContact O-N 2.91Å; V619-R623 VanDerWaalsContact O-N 3.08Å
620	S	52.8	Low	58.5	Low	66 Å²	66	120.2 Å²	120.2	46%	0.462	56%	0.556	S	S	.	*	H	α-helix	trans	-64.8	-48.6	177.4	63.5	0	0	0	0	111.3	Q616 A617 R622 R623 E624	Q616-S620 WeakPolarHBondContact O-CB 3.27Å; Q616-S620 PolarHBondContact O-N 3.42Å; Q616-S620 PolarHBondContact O-OG 3.34Å; A617-S620 WeakPolarHBondContact CA-OG 3.48Å; A617-S620 PolarHBondContact O-OG 3.04Å; A617-S620 VanDerWaalsContact O-OG 3.11Å; S620-R622 VanDerWaalsContact C-N 3.29Å; S620-R622 PolarHBondContact O-N 3.28Å; S620-R623 PolarHBondContact O-N 3.45Å; S620-R623 VanDerWaalsContact O-N 3.1Å; S620-E624 WeakPolarHBondContact O-CB 3.39Å; S620-E624 PolarHBondContact O-N 3.4Å
621	S	53.2	Low	57.6	Low	65 Å²	65	125.9 Å²	125.9	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-57.3	-39.9	177.3	-173.1	0	0	0	0	112.7	A617 R625	A617-S621 VanDerWaalsContact O-CB 3.24Å; A617-S621 WeakPolarHBondContact O-CB 3.37Å; A617-S621 PolarHBondContact O-N 2.95Å; A617-S621 VanDerWaalsContact O-N 3.14Å; S621-R625 WeakPolarHBondContact O-CB 3.41Å; S621-R625 PolarHBondContact O-N 2.65Å
622	R	52.5	Low	56.5	Low	200 Å²	200	125.7 Å²	125.7	76%	0.755	57%	0.572	S	S	*	*	H	α-helix	trans	-64.6	-45.9	175.2	-171.9	174.9	-178.6	171.3	0.8	111.9	V618 V619 S620 E624 E626	V618-R622 WeakPolarHBondContact O-CB 3.34Å; V618-R622 PolarHBondContact O-N 3.48Å; V618-R622 VanDerWaalsContact O-N 3.14Å; V619-R622 PolarHBondContact O-N 3.28Å; S620-R622 VanDerWaalsContact C-N 3.29Å; S620-R622 PolarHBondContact O-N 3.28Å; R622-E624 VanDerWaalsContact C-N 3.33Å; R622-E624 PolarHBondContact O-N 3.03Å; R622-E626 PolarHBondContact O-N 2.99Å
623	R	53.3	Low	55.3	Low	156 Å²	156	133.1 Å²	133.1	59%	0.589	60%	0.595	S	S	*	*	H	α-helix	trans	-69.6	-29.6	-179.4	-154.7	175.3	-164.4	-177.7	5.3	112.6	V619 S620 R627	V619-R623 WeakPolarHBondContact O-CB 3.5Å; V619-R623 PolarHBondContact O-N 2.91Å; V619-R623 VanDerWaalsContact O-N 3.08Å; S620-R623 PolarHBondContact O-N 3.45Å; S620-R623 VanDerWaalsContact O-N 3.1Å; R623-R627 WeakPolarHBondContact O-CD 3.4Å; R623-R627 VanDerWaalsContact O-CG 3.31Å; R623-R627 WeakPolarHBondContact O-CG 3.44Å; R623-R627 PolarHBondContact O-N 3.18Å
624	E	51.9	Low	54.3	Low	135 Å²	135	129.6 Å²	129.6	63%	0.631	60%	0.596	S	S	*	*	H	α-helix	trans	-76.9	-44.8	175.9	-174.5	153.3	-128.1	0	0	112.3	S620 R622 E626 R627 Q628	S620-E624 WeakPolarHBondContact O-CB 3.39Å; S620-E624 PolarHBondContact O-N 3.4Å; R622-E624 VanDerWaalsContact C-N 3.33Å; R622-E624 PolarHBondContact O-N 3.03Å; E624-E626 PolarHBondContact O-N 3.38Å; E624-R627 PolarHBondContact O-N 2.83Å; E624-Q628 WeakPolarHBondContact O-CB 3.36Å; E624-Q628 PolarHBondContact O-N 3.32Å
625	R	53.1	Low	53.5	Low	168 Å²	168	122.2 Å²	122.2	63%	0.634	58%	0.579	S	S	*	*	H	α-helix	trans	-56.1	-34.5	171	-93.2	-177.8	162.1	-178.7	-2.6	112.9	S621 R629	S621-R625 WeakPolarHBondContact O-CB 3.41Å; S621-R625 PolarHBondContact O-N 2.65Å; R625-R629 WeakPolarHBondContact O-CD 3.16Å; R625-R629 VanDerWaalsContact O-CG 3.24Å; R625-R629 WeakPolarHBondContact O-CG 3.06Å; R625-R629 PolarHBondContact O-N 3.14Å
626	E	50	Low	52.9	Low	130 Å²	130	124.4 Å²	124.4	61%	0.607	59%	0.594	S	S	*	*	H	α-helix	trans	-71.1	-48.1	177.1	-166.7	156.5	-121.9	0	0	111.9	R622 E624 Q628 R629 E630	R622-E626 PolarHBondContact O-N 2.99Å; E624-E626 PolarHBondContact O-N 3.38Å; E626-Q628 VanDerWaalsContact C-N 3.31Å; E626-Q628 PolarHBondContact O-N 3.19Å; E626-R629 PolarHBondContact O-N 3.11Å; E626-R629 VanDerWaalsContact O-N 3.16Å; E626-E630 PolarHBondContact O-N 3.1Å
627	R	54.1	Low	52.6	Low	145 Å²	145	128.5 Å²	128.5	55%	0.547	60%	0.604	S	S	.	*	H	α-helix	trans	-60.9	-35.6	174.1	-74	168	169.6	176.6	-5.5	113.2	R623 E624 E630 R631	R623-R627 WeakPolarHBondContact O-CD 3.4Å; R623-R627 VanDerWaalsContact O-CG 3.31Å; R623-R627 WeakPolarHBondContact O-CG 3.44Å; R623-R627 PolarHBondContact O-N 3.18Å; E624-R627 PolarHBondContact O-N 2.83Å; R627-E630 PolarHBondContact O-N 3.29Å; R627-R631 WeakPolarHBondContact O-CG 3.35Å; R627-R631 PolarHBondContact O-N 3.22Å; R627-R631 VanDerWaalsContact O-N 3.09Å
628	Q	49.9	Very low	52.4	Low	105 Å²	105	135.2 Å²	135.2	49%	0.491	62%	0.618	S	S	.	*	H	α-helix	trans	-66.1	-43	175	-176.2	173.8	-9.1	0	0	111.3	E624 E626 E630 R631 E632	E624-Q628 WeakPolarHBondContact O-CB 3.36Å; E624-Q628 PolarHBondContact O-N 3.32Å; E626-Q628 VanDerWaalsContact C-N 3.31Å; E626-Q628 PolarHBondContact O-N 3.19Å; Q628-E630 VanDerWaalsContact C-N 3.32Å; Q628-E630 PolarHBondContact O-N 2.85Å; Q628-R631 WeakPolarHBondContact O-CB 3.29Å; Q628-R631 PolarHBondContact O-N 3.09Å; Q628-R631 VanDerWaalsContact O-N 3.16Å; Q628-E632 WeakPolarHBondContact CG-OE1 3.5Å; Q628-E632 PolarHBondContact NE2-OE1 2.83Å; Q628-E632 WeakPolarHBondContact O-CG 3.44Å; Q628-E632 PolarHBondContact O-N 3.17Å
629	R	54.8	Low	52.2	Low	171 Å²	171	134.7 Å²	134.7	65%	0.645	61%	0.611	S	S	*	*	H	α-helix	trans	-65.2	-30.9	175.7	-73.4	167.7	173.3	-168.9	-4.1	113.4	R625 E626 R633	R625-R629 WeakPolarHBondContact O-CD 3.16Å; R625-R629 VanDerWaalsContact O-CG 3.24Å; R625-R629 WeakPolarHBondContact O-CG 3.06Å; R625-R629 PolarHBondContact O-N 3.14Å; E626-R629 PolarHBondContact O-N 3.11Å; E626-R629 VanDerWaalsContact O-N 3.16Å; R629-R633 PolarHBondContact O-N 3.5Å; R629-R633 VanDerWaalsContact O-N 3.13Å
630	E	51.6	Low	52.2	Low	142 Å²	142	137.4 Å²	137.4	66%	0.664	61%	0.611	S	S	*	*	H	α-helix	trans	-67	-46.2	169.1	-75.3	-163.1	116.9	0	0	112	E626 R627 Q628 E632 R633 G634	E626-E630 PolarHBondContact O-N 3.1Å; R627-E630 PolarHBondContact O-N 3.29Å; Q628-E630 VanDerWaalsContact C-N 3.32Å; Q628-E630 PolarHBondContact O-N 2.85Å; E630-E632 VanDerWaalsContact C-N 3.32Å; E630-E632 PolarHBondContact O-N 3.37Å; E630-R633 PolarHBondContact O-N 3.21Å; E630-G634 PolarHBondContact O-N 3.2Å
631	R	55.7	Low	52.2	Low	205 Å²	205	140.3 Å²	140.3	77%	0.774	62%	0.617	S	S	*	*	H	α-helix	trans	-59.3	-41.6	177	-72.7	172.3	175.2	177.2	-2.1	112	R627 Q628 G634	R627-R631 WeakPolarHBondContact O-CG 3.35Å; R627-R631 PolarHBondContact O-N 3.22Å; R627-R631 VanDerWaalsContact O-N 3.09Å; Q628-R631 WeakPolarHBondContact O-CB 3.29Å; Q628-R631 PolarHBondContact O-N 3.09Å; Q628-R631 VanDerWaalsContact O-N 3.16Å; R631-G634 PolarHBondContact O-N 3.16Å
632	E	52.6	Low	52.4	Low	129 Å²	129	144.9 Å²	144.9	60%	0.603	63%	0.625	S	S	*	*	H	α-helix	trans	-69	-32.8	177.2	-71.9	167.4	-171	0	0	112.9	Q628 E630 G634	Q628-E632 WeakPolarHBondContact CG-OE1 3.5Å; Q628-E632 PolarHBondContact NE2-OE1 2.83Å; Q628-E632 WeakPolarHBondContact O-CG 3.44Å; Q628-E632 PolarHBondContact O-N 3.17Å; E630-E632 VanDerWaalsContact C-N 3.32Å; E630-E632 PolarHBondContact O-N 3.37Å; E632-G634 VanDerWaalsContact C-N 3.33Å
633	R	52.7	Low	52.6	Low	233 Å²	233	140.7 Å²	140.7	88%	0.879	61%	0.614	S	S	*	*	H	α-helix	trans	-75.3	-18.7	170.2	-82.2	-179.6	164.6	168.5	-3.8	113.8	R629 E630 G635	R629-R633 PolarHBondContact O-N 3.5Å; R629-R633 VanDerWaalsContact O-N 3.13Å; E630-R633 PolarHBondContact O-N 3.21Å; R633-G635 VanDerWaalsContact C-N 3.3Å; R633-G635 PolarHBondContact O-N 3.45Å
634	G	51.1	Low	52.9	Low	46 Å²	46	140.6 Å²	140.6	47%	0.474	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	21.7	-178.3	0	0	0	0	0	115.9	E630 R631 E632	E630-G634 PolarHBondContact O-N 3.2Å; R631-G634 PolarHBondContact O-N 3.16Å; E632-G634 VanDerWaalsContact C-N 3.33Å
635	G	48.8	Very low	53.5	Low	36 Å²	36	136.1 Å²	136.1	37%	0.371	60%	0.599	S	S	.	*			trans	-55.7	158.3	-169.8	0	0	0	0	0	116.4	R633 R637	R633-G635 VanDerWaalsContact C-N 3.3Å; R633-G635 PolarHBondContact O-N 3.45Å; G635-R637 PolarHBondContact O-N 3.04Å
636	P	49.2	Very low	54.2	Low	98 Å²	98	135.5 Å²	135.5	64%	0.636	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	26.4	-157.4	30.2	-38.8	0	0	0	116.9
637	R	49.7	Very low	55	Low	215 Å²	215	133 Å²	133	81%	0.811	59%	0.588	S	S	*	*	H	α-helix	trans	-79.5	-40.9	168.3	-75.9	-174	172	-172.5	-2.5	112	G635 D639 R640 E641	G635-R637 PolarHBondContact O-N 3.04Å; R637-D639 PolarHBondContact O-N 2.94Å; R637-R640 PolarHBondContact O-N 3.41Å; R637-E641 PolarHBondContact O-N 3.41Å
638	R	52.9	Low	55.7	Low	195 Å²	195	132.9 Å²	132.9	74%	0.736	59%	0.588	S	S	*	*	H	α-helix	trans	-63.9	-40.6	-174.8	-97.1	-176.7	168.8	-179.7	-2.5	113.5	E641 R642	R638-E641 PolarHBondContact O-N 3.16Å; R638-R642 WeakPolarHBondContact O-CG 3.24Å; R638-R642 PolarHBondContact O-N 3.23Å
639	D	51	Low	56.6	Low	92 Å²	92	131.8 Å²	131.8	49%	0.492	59%	0.585	S	S	.	*	H	α-helix	trans	-74.2	-38.1	-179.6	-59.1	-55.4	0	0	0	111.8	R637 E641 R642 E643	R637-D639 PolarHBondContact O-N 2.94Å; D639-E641 PolarHBondContact O-N 3.2Å; D639-R642 CarbonylContact O-C 3.59Å; D639-R642 WeakPolarHBondContact O-CA 3.48Å; D639-R642 PolarHBondContact O-N 3.14Å; D639-E643 PolarHBondContact O-N 3.21Å
640	R	54.3	Low	57.3	Low	153 Å²	153	130.5 Å²	130.5	58%	0.577	58%	0.58	S	S	*	*	H	α-helix	trans	-61.2	-29.1	170.3	-76.9	179.4	168.6	167.8	-3	113.4	R637 R644	R637-R640 PolarHBondContact O-N 3.41Å; R640-R644 WeakPolarHBondContact O-CB 3.2Å; R640-R644 VanDerWaalsContact O-CD 3.29Å; R640-R644 WeakPolarHBondContact O-CD 3.34Å; R640-R644 WeakPolarHBondContact O-CG 3.38Å; R640-R644 PolarHBondContact O-N 2.75Å
641	E	53.6	Low	58.2	Low	127 Å²	127	129.4 Å²	129.4	59%	0.593	58%	0.575	S	S	*	*	H	α-helix	trans	-74.6	-37.4	170.2	-74.5	-174.6	132.8	0	0	112.4	R637 R638 D639 A645	R637-E641 PolarHBondContact O-N 3.41Å; R638-E641 PolarHBondContact O-N 3.16Å; D639-E641 PolarHBondContact O-N 3.2Å; E641-A645 WeakPolarHBondContact O-CB 3.48Å; E641-A645 PolarHBondContact O-N 2.9Å
642	R	57	Low	58.8	Low	162 Å²	162	126.6 Å²	126.6	61%	0.611	56%	0.564	S	S	*	*	H	α-helix	trans	-67.7	-38.9	176.3	-75.7	178.5	162.7	-163.2	-7	112.9	R638 D639 A645 R646	R638-R642 WeakPolarHBondContact O-CG 3.24Å; R638-R642 PolarHBondContact O-N 3.23Å; D639-R642 CarbonylContact O-C 3.59Å; D639-R642 WeakPolarHBondContact O-CA 3.48Å; D639-R642 PolarHBondContact O-N 3.14Å; R642-A645 PolarHBondContact O-N 3.08Å; R642-R646 WeakPolarHBondContact O-CD 3.31Å; R642-R646 VanDerWaalsContact O-CG 3.3Å; R642-R646 WeakPolarHBondContact O-CG 3.42Å; R642-R646 PolarHBondContact O-N 3.3Å; R642-R646 VanDerWaalsContact O-N 3.1Å
643	E	56.3	Low	59.6	Low	111 Å²	111	126.8 Å²	126.8	52%	0.519	57%	0.565	S	S	.	*	H	α-helix	trans	-63.1	-53.2	171.4	-70.2	-179	132	0	0	110.8	D639 A645 R646 D647	D639-E643 PolarHBondContact O-N 3.21Å; E643-A645 PolarHBondContact O-N 3.47Å; E643-R646 PolarHBondContact O-N 2.85Å; E643-D647 PolarHBondContact O-N 3.43Å
644	R	60.6	Low	60.5	Low	155 Å²	155	124 Å²	124	59%	0.585	56%	0.555	S	S	*	*	H	α-helix	trans	-62	-15.1	177	-70.9	171.8	-177.6	152.2	-5	114.6	R640 R648	R640-R644 WeakPolarHBondContact O-CB 3.2Å; R640-R644 VanDerWaalsContact O-CD 3.29Å; R640-R644 WeakPolarHBondContact O-CD 3.34Å; R640-R644 WeakPolarHBondContact O-CG 3.38Å; R640-R644 PolarHBondContact O-N 2.75Å; R644-R648 PolarHBondContact O-NE 3.08Å; R644-R648 PolarHBondContact O-NH2 3.33Å
645	A	65	Low	61.2	Low	41 Å²	41	126.8 Å²	126.8	34%	0.339	56%	0.559	S	S	.	*	H	α-helix	trans	-80.6	-54.8	167.4	0	0	0	0	0	110.3	E641 R642 E643 D647 R648 D649	E641-A645 WeakPolarHBondContact O-CB 3.48Å; E641-A645 PolarHBondContact O-N 2.9Å; R642-A645 PolarHBondContact O-N 3.08Å; E643-A645 PolarHBondContact O-N 3.47Å; A645-D647 VanDerWaalsContact C-N 3.29Å; A645-D647 PolarHBondContact O-N 3.26Å; A645-R648 PolarHBondContact O-N 3.39Å; A645-D649 PolarHBondContact O-N 3.42Å; A645-D649 VanDerWaalsContact O-N 3.09Å
646	R	67.6	Low	62.1	Low	154 Å²	154	131.6 Å²	131.6	58%	0.581	57%	0.57	S	S	*	*	H	α-helix	trans	-54.7	-41	179.5	-72	166.2	171.6	173.9	-5.3	113	R642 E643 D649 R650	R642-R646 WeakPolarHBondContact O-CD 3.31Å; R642-R646 VanDerWaalsContact O-CG 3.3Å; R642-R646 WeakPolarHBondContact O-CG 3.42Å; R642-R646 PolarHBondContact O-N 3.3Å; R642-R646 VanDerWaalsContact O-N 3.1Å; E643-R646 PolarHBondContact O-N 2.85Å; R646-D649 PolarHBondContact O-N 2.88Å; R646-R650 WeakPolarHBondContact O-CD 3.41Å; R646-R650 VanDerWaalsContact O-CG 3.27Å; R646-R650 WeakPolarHBondContact O-CG 3.42Å; R646-R650 PolarHBondContact O-N 3.4Å
647	D	67.3	Low	62.7	Low	78 Å²	78	132.7 Å²	132.7	42%	0.417	57%	0.566	S	S	.	*	H	α-helix	trans	-73.5	-35.9	-178.3	-65.3	-32.8	0	0	0	112.8	E643 A645 D649 R650 E651	E643-D647 PolarHBondContact O-N 3.43Å; A645-D647 VanDerWaalsContact C-N 3.29Å; A645-D647 PolarHBondContact O-N 3.26Å; D647-D649 VanDerWaalsContact C-N 3.31Å; D647-D649 PolarHBondContact O-N 3.08Å; D647-R650 PolarHBondContact O-N 3.23Å; D647-R650 IonicContact OD1-CZ 2.94Å; D647-R650 IonicContact OD1-NH1 3.67Å; D647-R650 PolarHBondContact OD1-NH1 3Å; D647-E651 VanDerWaalsContact O-CB 3.31Å; D647-E651 WeakPolarHBondContact O-CB 3.43Å; D647-E651 PolarHBondContact O-N 2.91Å
648	R	67.6	Low	63.4	Low	143 Å²	143	131.2 Å²	131.2	54%	0.54	56%	0.56	S	S	.	*	H	α-helix	trans	-65.7	-33.9	171.2	-85.6	-179.6	-69.3	174.2	-0.6	112.4	R644 A645 R652	R644-R648 PolarHBondContact O-NE 3.08Å; R644-R648 PolarHBondContact O-NH2 3.33Å; A645-R648 PolarHBondContact O-N 3.39Å; R648-R652 WeakPolarHBondContact O-CB 3.49Å; R648-R652 VanDerWaalsContact O-CD 3.29Å; R648-R652 WeakPolarHBondContact O-CD 3.35Å; R648-R652 WeakPolarHBondContact O-CG 3.35Å; R648-R652 PolarHBondContact O-N 3.17Å
649	D	68.5	Low	63.7	Low	81 Å²	81	124.1 Å²	124.1	43%	0.433	55%	0.548	S	S	.	.	H	α-helix	trans	-76.1	-34.3	176.2	-70	-33.8	0	0	0	112.4	A645 R646 D647 R652 E653	A645-D649 PolarHBondContact O-N 3.42Å; A645-D649 VanDerWaalsContact O-N 3.09Å; R646-D649 PolarHBondContact O-N 2.88Å; D647-D649 VanDerWaalsContact C-N 3.31Å; D647-D649 PolarHBondContact O-N 3.08Å; D649-R652 PolarHBondContact O-N 2.74Å; D649-R652 WeakPolarHBondContact OD1-CD 3.49Å; D649-R652 IonicContact OD1-CZ 3.79Å; D649-R652 IonicContact OD1-NE 2.71Å; D649-R652 IonicContact OD1-NH1 3.33Å; D649-R652 PolarHBondContact OD1-NH1 3.01Å; D649-E653 PolarHBondContact O-N 3.19Å
650	R	70.9	Confident	64	Low	144 Å²	144	129.7 Å²	129.7	54%	0.543	56%	0.562	S	S	.	*	H	α-helix	trans	-62	-41.7	167.7	-72.3	162	172.4	163.6	-6.4	112.6	R646 D647 E653 R654	R646-R650 WeakPolarHBondContact O-CD 3.41Å; R646-R650 VanDerWaalsContact O-CG 3.27Å; R646-R650 WeakPolarHBondContact O-CG 3.42Å; R646-R650 PolarHBondContact O-N 3.4Å; D647-R650 PolarHBondContact O-N 3.23Å; D647-R650 IonicContact OD1-CZ 2.94Å; D647-R650 IonicContact OD1-NH1 3.67Å; D647-R650 PolarHBondContact OD1-NH1 3Å; R650-E653 PolarHBondContact O-N 3.13Å; R650-R654 WeakPolarHBondContact O-CG 3.4Å; R650-R654 PolarHBondContact O-N 2.9Å
651	E	69.6	Low	63.9	Low	119 Å²	119	131.8 Å²	131.8	56%	0.556	57%	0.572	S	S	*	*	H	α-helix	trans	-63.5	-44.7	176.4	-170.9	168.1	-125.9	0	0	110.8	D647 E653 R654 D655	D647-E651 VanDerWaalsContact O-CB 3.31Å; D647-E651 WeakPolarHBondContact O-CB 3.43Å; D647-E651 PolarHBondContact O-N 2.91Å; E651-E653 VanDerWaalsContact C-N 3.3Å; E651-E653 PolarHBondContact O-N 3.13Å; E651-R654 PolarHBondContact O-N 3.38Å; E651-R654 VanDerWaalsContact O-N 3.16Å; E651-D655 PolarHBondContact O-N 2.94Å
652	R	69.2	Low	64.1	Low	147 Å²	147	136.9 Å²	136.9	56%	0.555	59%	0.585	S	S	*	*	H	α-helix	trans	-61.2	-30.6	172.2	-73.5	161.3	168.3	179	-6.5	114.2	R648 D649 K656	R648-R652 WeakPolarHBondContact O-CB 3.49Å; R648-R652 VanDerWaalsContact O-CD 3.29Å; R648-R652 WeakPolarHBondContact O-CD 3.35Å; R648-R652 WeakPolarHBondContact O-CG 3.35Å; R648-R652 PolarHBondContact O-N 3.17Å; D649-R652 PolarHBondContact O-N 2.74Å; D649-R652 WeakPolarHBondContact OD1-CD 3.49Å; D649-R652 IonicContact OD1-CZ 3.79Å; D649-R652 IonicContact OD1-NE 2.71Å; D649-R652 IonicContact OD1-NH1 3.33Å; D649-R652 PolarHBondContact OD1-NH1 3.01Å; R652-K656 WeakPolarHBondContact O-CD 3.44Å; R652-K656 WeakPolarHBondContact O-CG 3.24Å; R652-K656 PolarHBondContact O-N 3.37Å
653	E	69.9	Low	63.5	Low	133 Å²	133	143.4 Å²	143.4	62%	0.621	61%	0.61	S	S	*	*	H	α-helix	trans	-72.2	-44.5	171.6	-73.5	-161.6	128.8	0	0	111.7	D649 R650 E651 D655 K656 E657	D649-E653 PolarHBondContact O-N 3.19Å; R650-E653 PolarHBondContact O-N 3.13Å; E651-E653 VanDerWaalsContact C-N 3.3Å; E651-E653 PolarHBondContact O-N 3.13Å; E653-D655 VanDerWaalsContact C-N 3.28Å; E653-D655 PolarHBondContact O-N 2.93Å; E653-K656 WeakPolarHBondContact O-CB 3.28Å; E653-K656 PolarHBondContact O-N 3.33Å; E653-K656 VanDerWaalsContact O-N 3.15Å; E653-E657 WeakPolarHBondContact O-CB 3.33Å; E653-E657 PolarHBondContact O-N 3.49Å
654	R	70.4	Confident	63.9	Low	174 Å²	174	145.1 Å²	145.1	66%	0.657	62%	0.615	S	S	*	*	H	α-helix	trans	-60.6	-35.9	176.1	-71.1	177.3	176.8	-159.4	-3.1	112.7	R650 E651 E657 R658	R650-R654 WeakPolarHBondContact O-CG 3.4Å; R650-R654 PolarHBondContact O-N 2.9Å; E651-R654 PolarHBondContact O-N 3.38Å; E651-R654 VanDerWaalsContact O-N 3.16Å; R654-E657 PolarHBondContact O-N 3.43Å; R654-R658 WeakPolarHBondContact O-CB 3.47Å; R654-R658 VanDerWaalsContact O-CG 3.22Å; R654-R658 WeakPolarHBondContact O-CG 3.27Å; R654-R658 PolarHBondContact O-N 3.47Å
655	D	65.6	Low	64	Low	104 Å²	104	144.5 Å²	144.5	56%	0.556	62%	0.616	S	S	*	*	H	α-helix	trans	-73.1	-36.5	174.6	-80.6	-13.8	0	0	0	113.1	E651 E653 E657 G659	E651-D655 PolarHBondContact O-N 2.94Å; E653-D655 VanDerWaalsContact C-N 3.28Å; E653-D655 PolarHBondContact O-N 2.93Å; D655-E657 VanDerWaalsContact C-N 3.29Å; D655-E657 PolarHBondContact O-N 3.3Å; D655-G659 PolarHBondContact O-N 3.13Å
656	K	67.3	Low	64	Low	138 Å²	138	150.3 Å²	150.3	60%	0.6	63%	0.632	S	S	*	*	H	α-helix	trans	-63.2	-37.4	170.5	-72.5	164.1	-168.7	168.3	0	111.7	R652 E653 R660	R652-K656 WeakPolarHBondContact O-CD 3.44Å; R652-K656 WeakPolarHBondContact O-CG 3.24Å; R652-K656 PolarHBondContact O-N 3.37Å; E653-K656 WeakPolarHBondContact O-CB 3.28Å; E653-K656 PolarHBondContact O-N 3.33Å; E653-K656 VanDerWaalsContact O-N 3.15Å; K656-R660 WeakPolarHBondContact O-CG 3.43Å; K656-R660 PolarHBondContact O-N 3.07Å
657	E	62.2	Low	63.8	Low	121 Å²	121	150.1 Å²	150.1	57%	0.565	64%	0.635	S	S	*	*	H	α-helix	trans	-70.3	-48.1	177.9	-171.3	169.2	-130.6	0	0	111.2	E653 R654 D655 G659 R660 Y661	E653-E657 WeakPolarHBondContact O-CB 3.33Å; E653-E657 PolarHBondContact O-N 3.49Å; R654-E657 PolarHBondContact O-N 3.43Å; D655-E657 VanDerWaalsContact C-N 3.29Å; D655-E657 PolarHBondContact O-N 3.3Å; E657-G659 PolarHBondContact O-N 3.29Å; E657-R660 WeakPolarHBondContact O-CB 3.4Å; E657-R660 PolarHBondContact O-N 3.03Å; E657-Y661 HydrophobicContact CG-CE2 4.45Å; E657-Y661 WeakPolarHBondContact O-CD2 3.47Å
658	R	65.5	Low	63.6	Low	183 Å²	183	154.6 Å²	154.6	69%	0.691	65%	0.648	S	S	*	*	H	α-helix	trans	-57.8	-35.6	171.6	-74.2	170.2	175.4	-132.1	-7.5	112.6	R654 R660 Y661	R654-R658 WeakPolarHBondContact O-CB 3.47Å; R654-R658 VanDerWaalsContact O-CG 3.22Å; R654-R658 WeakPolarHBondContact O-CG 3.27Å; R654-R658 PolarHBondContact O-N 3.47Å; R658-R660 VanDerWaalsContact C-N 3.28Å; R658-R660 PolarHBondContact O-N 3.48Å; R658-Y661 PolarHBondContact O-N 3.48Å
659	G	58.6	Low	63.3	Low	47 Å²	47	155.3 Å²	155.3	49%	0.485	66%	0.656	S	S	.	*	H	α-helix	trans	-65.8	-22.9	174	0	0	0	0	0	114.7	D655 E657	D655-G659 PolarHBondContact O-N 3.13Å; E657-G659 PolarHBondContact O-N 3.29Å
660	R	56.3	Low	62.9	Low	208 Å²	208	160.6 Å²	160.6	79%	0.785	67%	0.672	S	S	*	*	H	α-helix	trans	-80.7	-21.1	176.3	-71.6	177.4	-177	-161.6	1.5	113.7	K656 E657 R658 R662	K656-R660 WeakPolarHBondContact O-CG 3.43Å; K656-R660 PolarHBondContact O-N 3.07Å; E657-R660 WeakPolarHBondContact O-CB 3.4Å; E657-R660 PolarHBondContact O-N 3.03Å; R658-R660 VanDerWaalsContact C-N 3.28Å; R658-R660 PolarHBondContact O-N 3.48Å; R660-R662 VanDerWaalsContact C-N 3.35Å
661	Y	53.3	Low	62.3	Low	198 Å²	198	161.9 Å²	161.9	78%	0.776	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	16.4	177.1	-71.3	-79.3	0	0	0	113.7	E657 R658	E657-Y661 HydrophobicContact CG-CE2 4.45Å; E657-Y661 WeakPolarHBondContact O-CD2 3.47Å; R658-Y661 PolarHBondContact O-N 3.48Å
662	R	56.8	Low	61.7	Low	233 Å²	233	165.5 Å²	165.5	88%	0.879	69%	0.692	S	S	*	*			trans	-134.4	35.4	179.3	-84.6	-168.4	167.8	-167.8	-2.8	113.2	R660	R660-R662 VanDerWaalsContact C-N 3.35Å
663	R	45.3	Very low	61	Low	300 Å²	300	167.2 Å²	167.2	100%	1.132	70%	0.704	S	S	*	*			trans	-144.3	0	173.5	-164.8	173.9	-165.4	-115.3	-0.8	111.4

Retrieved 663 of 663 residues in 228.1 ms (Link to these results)

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