A0A087YP41_POEFO Loading...

Pseudouridylate synthase 1 homolog

Pseudouridylate synthase that catalyzes pseudouridylation of tRNAs and mRNAs. Acts on positions 27/28 in the anticodon stem and also positions 34 and 36 in the anticodon of an intron containing tRNA. Also catalyzes pseudouridylation of mRNAs: mediates pseudouridylation of mRNAs with the consensus sequence 5'-UGUAG-3'. Acts as a regulator of pre-mRNA splicing by mediating pseudouridylation of pre-mRNAs at locations associated with alternatively spliced regions. Pseudouridylation of pre-mRNAs near splice sites directly regulates mRNA splicing and mRNA 3'-end processing. Involved in regulation of nuclear receptor activity through pseudouridylation of SRA1 mRNA.

AlphaFold DB , UniProt , Accession A0A087YP41, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 417 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	36	Very low	31.6	Very low	235 Å²	235	166.6 Å²	166.6	100%	1.158	87%	0.868	S	S	*	*				0	147.9	0	-113.6	177.5	-177.2	0	0	108.2
2	F	26.4	Very low	31.8	Very low	211 Å²	211	162.8 Å²	162.8	93%	0.925	86%	0.856	S	S	*	*			trans	87.3	103.4	-170.5	-63.4	-77.1	0	0	0	116.8
3	K	26.7	Very low	32.1	Very low	195 Å²	195	160.6 Å²	160.6	85%	0.848	85%	0.846	S	S	*	*			trans	-96.7	148	167.4	-69.8	172.3	171	175.3	0	108.3
4	T	28.2	Very low	32.2	Very low	136 Å²	136	164.4 Å²	164.4	83%	0.834	85%	0.845	S	S	*	*			trans	177	103.6	139.3	35.4	0	0	0	0	108.3
5	R	31.7	Very low	32.4	Very low	244 Å²	244	168.8 Å²	168.8	92%	0.921	85%	0.847	S	S	*	*				79.7	134.5	89.5	-94.6	-168.9	178.3	-178.9	0.5	115.6
6	P	34.3	Very low	32.3	Very low	109 Å²	109	168.3 Å²	168.3	71%	0.708	84%	0.841	S	S	*	*			trans	-93.4	151.5	-167	37.9	-33.8	0	0	0	113.5	L8	P6-L8 PolarHBondContact O-N 3.47Å
7	L	30.3	Very low	32.2	Very low	177 Å²	177	167.4 Å²	167.4	93%	0.927	84%	0.838	S	S	*	*			trans	-78.9	99.4	173.1	-79.9	163.9	0	0	0	110.5
8	L	34.8	Very low	32.2	Very low	162 Å²	162	166.7 Å²	166.7	85%	0.848	84%	0.837	S	S	*	*			trans	-132.1	47.5	175.6	-138.4	157.9	0	0	0	110.3	P6	P6-L8 PolarHBondContact O-N 3.47Å
9	S	33	Very low	32.3	Very low	88 Å²	88	167.2 Å²	167.2	62%	0.615	84%	0.836	S	S	*	*			trans	-132.6	18.9	-173.9	73.7	0	0	0	0	116.5
10	A	31.7	Very low	32.3	Very low	104 Å²	104	164.4 Å²	164.4	86%	0.86	83%	0.828	S	S	*	*	S	Bend	trans	-90.3	0.1	-179.3	0	0	0	0	0	115.4
11	L	34.2	Very low	32.2	Very low	172 Å²	172	164.4 Å²	164.4	90%	0.901	83%	0.831	S	S	*	*	S	Bend	trans	-117.8	6.1	-173.6	-74.1	170.9	0	0	0	115.7
12	V	34.3	Very low	31.8	Very low	120 Å²	120	156.9 Å²	156.9	73%	0.727	81%	0.813	S	S	*	*	S	Bend	trans	-108.9	-13.3	-176.9	179.3	0	0	0	0	113.9	Y14	V12-Y14 PolarHBondContact O-N 3.22Å
13	N	36.2	Very low	31.7	Very low	135 Å²	135	155 Å²	155	72%	0.722	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	15.6	-175.1	-79.3	-7.3	0	0	0	116
14	Y	33.1	Very low	31.7	Very low	214 Å²	214	154.7 Å²	154.7	84%	0.839	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-4.4	178.1	-129.5	-91.9	0	0	0	114.5	V12	V12-Y14 PolarHBondContact O-N 3.22Å
15	R	34.9	Very low	31.4	Very low	230 Å²	230	156.5 Å²	156.5	87%	0.868	81%	0.814	S	S	*	*	S	Bend	trans	-96.6	-5.4	-176.9	-136.9	178.2	-168.1	178.3	3.3	114.7
16	Q	31.2	Very low	31	Very low	161 Å²	161	151.9 Å²	151.9	75%	0.752	81%	0.807	S	S	*	*	S	Bend	trans	-116.8	9.3	-170.3	-150.5	155.1	13.2	0	0	114.6
17	L	30	Very low	30.3	Very low	153 Å²	153	152.1 Å²	152.1	80%	0.801	81%	0.81	S	S	*	*	S	Bend	trans	-110.8	12.1	176.9	-142.5	91.6	0	0	0	114
18	L	32.7	Very low	30	Very low	154 Å²	154	149.8 Å²	149.8	81%	0.806	80%	0.803	S	S	*	*	S	Bend	trans	-113.5	1.6	178.8	-72.6	173.4	0	0	0	114.2
19	E	33.3	Very low	29.5	Very low	176 Å²	176	150 Å²	150	82%	0.822	80%	0.802	S	S	*	*	S	Bend	trans	-102.9	5.4	179.7	-73.4	-171.1	161.8	0	0	114.8
20	T	33.4	Very low	29.1	Very low	111 Å²	111	151.5 Å²	151.5	68%	0.681	81%	0.813	S	S	*	*	S	Bend	trans	-130.6	74.6	179.4	16.3	0	0	0	0	110.3
21	N	29.5	Very low	28.8	Very low	166 Å²	166	154.9 Å²	154.9	89%	0.888	81%	0.811	S	S	*	*			trans	-168.1	85.3	145	-89.7	-26.5	0	0	0	109
22	G	28.5	Very low	28.3	Very low	76 Å²	76	155.6 Å²	155.6	78%	0.784	81%	0.809	S	S	*	*			trans	-74.5	125	166.3	0	0	0	0	0	110.5
23	L	24.7	Very low	27.9	Very low	171 Å²	171	153.3 Å²	153.3	90%	0.895	80%	0.803	S	S	*	*			trans	-128.1	109.8	150.2	-110.8	99.7	0	0	0	108.7
24	K	25.3	Very low	27.4	Very low	190 Å²	190	157.3 Å²	157.3	83%	0.826	81%	0.808	S	S	*	*			trans	-66.3	134.3	163.3	-76.5	173.3	173.2	175.7	0	108.6
25	L	22.8	Very low	27	Very low	174 Å²	174	153.3 Å²	153.3	91%	0.911	80%	0.801	S	S	*	*			trans	-141.1	130.3	144.8	-144.8	78.1	0	0	0	110.1
26	L	23.1	Very low	26.5	Very low	146 Å²	146	150.5 Å²	150.5	76%	0.764	80%	0.798	S	S	*	*			trans	-69.3	145.9	-166.6	-83.5	87.3	0	0	0	113.6
27	C	19.8	Very low	26.2	Very low	114 Å²	114	150.9 Å²	150.9	77%	0.77	80%	0.8	S	S	*	*			trans	-71.8	129	155.9	-178.9	0	0	0	0	109.4
28	T	23.9	Very low	25.9	Very low	128 Å²	128	150 Å²	150	79%	0.785	80%	0.8	S	S	*	*			trans	-126.1	118.8	161.1	46.2	0	0	0	0	108.3
29	M	24.3	Very low	25.6	Very low	168 Å²	168	147.4 Å²	147.4	83%	0.828	80%	0.801	S	S	*	*			trans	-77.5	143.5	166.5	-64.5	-155.1	69.6	0	0	110
30	S	24.3	Very low	25.2	Very low	119 Å²	119	148.3 Å²	148.3	83%	0.832	80%	0.803	S	S	*	*			trans	-153.2	124.6	151.9	58.2	0	0	0	0	109.7
31	E	24.5	Very low	24.8	Very low	175 Å²	175	150.8 Å²	150.8	82%	0.818	81%	0.811	S	S	*	*			trans	-70.1	148.5	166.2	-66.2	170.3	137.3	0	0	110.3
32	E	25.2	Very low	24.7	Very low	186 Å²	186	150.9 Å²	150.9	87%	0.869	81%	0.811	S	S	*	*				167.3	127.4	118.4	-90.1	-177.5	173.5	0	0	114.1
33	A	24.6	Very low	24.5	Very low	73 Å²	73	156.9 Å²	156.9	60%	0.603	82%	0.815	S	S	*	*			trans	54.1	125.2	136.3	0	0	0	0	0	124.6
34	R	25	Very low	24.4	Very low	219 Å²	219	160.2 Å²	160.2	83%	0.826	82%	0.816	S	S	*	*				54.3	137.5	130	-69.4	-176	-78.8	-171.2	-2.9	118.6
35	D	25.7	Very low	24.7	Very low	129 Å²	129	156.8 Å²	156.8	69%	0.69	81%	0.813	S	S	*	*			cis	-165.5	174.7	32.3	-108.2	-33.7	0	0	0	111.4
36	Q	24.5	Very low	24.8	Very low	171 Å²	171	156.1 Å²	156.1	80%	0.799	81%	0.81	S	S	*	*			trans	-23.2	150	169.9	-59.9	159.6	-0.6	0	0	117
37	E	23.9	Very low	25	Very low	170 Å²	170	158.4 Å²	158.4	79%	0.794	82%	0.817	S	S	*	*				176.8	163.7	65.1	-161.6	172.9	-169.7	0	0	110.7
38	T	25.2	Very low	25.3	Very low	133 Å²	133	158.5 Å²	158.5	82%	0.816	81%	0.814	S	S	*	*			trans	86.8	129.8	167.4	76.7	0	0	0	0	117.3
39	A	26	Very low	25.3	Very low	100 Å²	100	160.5 Å²	160.5	83%	0.826	82%	0.82	S	S	*	*			cis	-151.4	140.8	7.1	0	0	0	0	0	111.5
40	K	25.6	Very low	25.3	Very low	195 Å²	195	160.5 Å²	160.5	85%	0.848	82%	0.818	S	S	*	*			trans	-85.2	165.1	162.2	-79.1	175.1	175.9	170.4	0	109.8
41	L	25.2	Very low	25.3	Very low	163 Å²	163	162.4 Å²	162.4	85%	0.853	82%	0.818	S	S	*	*			trans	113.7	114.5	166.3	-67.4	149.3	0	0	0	110.4
42	L	26.1	Very low	25.4	Very low	169 Å²	169	159.4 Å²	159.4	89%	0.885	82%	0.817	S	S	*	*			cis	-146.8	137.1	43.3	-73.7	116.4	0	0	0	113.1
43	K	23.9	Very low	25.3	Very low	202 Å²	202	155.1 Å²	155.1	88%	0.878	81%	0.814	S	S	*	*			trans	-134.5	136.6	156.9	-95.5	-172.7	177.9	-178.8	0	107.5
44	R	24	Very low	25.4	Very low	240 Å²	240	161 Å²	161	91%	0.906	83%	0.829	S	S	*	*			trans	174.8	159.1	151.4	-102.7	173.7	-178.9	-160.4	0	109.3
45	P	31	Very low	25.5	Very low	118 Å²	118	155.3 Å²	155.3	77%	0.766	82%	0.822	S	S	*	*			cis	-133.3	175	-48.4	29.3	-8.7	0	0	0	112.6
46	N	25.8	Very low	25.8	Very low	160 Å²	160	154.3 Å²	154.3	86%	0.856	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-62.2	146.5	171.4	-81.9	-10.8	0	0	0	113.3
47	E	26.7	Very low	25.9	Very low	195 Å²	195	151.7 Å²	151.7	91%	0.911	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-102.3	143	151.6	-78	-177.1	161.7	0	0	109.9
48	V	25.2	Very low	26.3	Very low	116 Å²	116	153.3 Å²	153.3	70%	0.703	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-91.3	144.2	179.5	174.4	0	0	0	0	108.6
49	N	24.2	Very low	26.4	Very low	170 Å²	170	158.4 Å²	158.4	91%	0.909	84%	0.836	S	S	*	*			trans	-147.4	123.8	142	-100.6	-17.5	0	0	0	109.7
50	E	24.1	Very low	26.6	Very low	168 Å²	168	161.4 Å²	161.4	79%	0.785	84%	0.837	S	S	*	*			trans	-71.5	136.9	166.5	-67.5	171.5	143.8	0	0	109
51	D	24.9	Very low	26.7	Very low	158 Å²	158	161.6 Å²	161.6	85%	0.845	84%	0.837	S	S	*	*				177.1	153.7	119.5	-102.8	-27	0	0	0	113.3
52	S	25.8	Very low	26.9	Very low	113 Å²	113	158 Å²	158	79%	0.79	83%	0.831	S	S	*	*			trans	85.9	87	169.2	72	0	0	0	0	117.8
53	A	24.4	Very low	27	Very low	96 Å²	96	159.4 Å²	159.4	79%	0.793	83%	0.833	S	S	*	*			trans	-61.4	133.1	147.3	0	0	0	0	0	110.4
54	E	26.2	Very low	27.4	Very low	197 Å²	197	152.4 Å²	152.4	92%	0.921	82%	0.819	S	S	*	*				-177.2	147.7	128.2	-107.1	177.9	172.8	0	0	112.8
55	S	26.9	Very low	27.9	Very low	99 Å²	99	150.1 Å²	150.1	69%	0.692	82%	0.818	S	S	*	*			trans	80.1	73.6	169.4	-146.6	0	0	0	0	118	T57	S55-T57 PolarHBondContact O-N 3.45Å; S55-T57 PolarHBondContact OG-OG1 3.03Å
56	A	31.6	Very low	28.1	Very low	107 Å²	107	152.2 Å²	152.2	88%	0.884	82%	0.817	S	S	*	*			trans	-62	105.5	144.4	0	0	0	0	0	110
57	T	27.7	Very low	29	Very low	117 Å²	117	149.5 Å²	149.5	72%	0.718	80%	0.803	S	S	*	*			trans	-124	102.4	156.8	6.9	0	0	0	0	109.6	S55 R59	S55-T57 PolarHBondContact O-N 3.45Å; S55-T57 PolarHBondContact OG-OG1 3.03Å; T57-R59 PolarHBondContact O-N 3.07Å
58	K	32.1	Very low	29.9	Very low	203 Å²	203	148.1 Å²	148.1	88%	0.883	80%	0.796	S	S	*	*			trans	-50.3	108.4	164.4	-80	175.1	173.7	174.1	0	109.3
59	R	27.1	Very low	31	Very low	241 Å²	241	147.7 Å²	147.7	91%	0.909	79%	0.79	S	S	*	*			trans	-101.5	100.3	154	-87	-176.8	174.6	176.7	-0.7	107.8	T57 K61	T57-R59 PolarHBondContact O-N 3.07Å; R59-K61 PolarHBondContact O-N 3.25Å
60	I	30.3	Very low	32.2	Very low	163 Å²	163	143.5 Å²	143.5	84%	0.836	77%	0.768	S	S	*	*			trans	-51.7	107.6	161.8	-64.2	167.7	0	0	0	106.2	A62	I60-A62 PolarHBondContact O-N 2.84Å
61	K	27.4	Very low	33.4	Very low	198 Å²	198	143.8 Å²	143.8	86%	0.861	77%	0.767	S	S	*	*			trans	-86.9	108.9	173.4	-151.5	176.4	-173.7	-179.5	0	105.9	R59 E63	R59-K61 PolarHBondContact O-N 3.25Å; K61-E63 PolarHBondContact O-N 3.02Å
62	A	29	Very low	34.9	Very low	87 Å²	87	145.4 Å²	145.4	72%	0.719	76%	0.761	S	S	*	*			trans	-43.2	124.2	171.1	0	0	0	0	0	109.7	I60 G64	I60-A62 PolarHBondContact O-N 2.84Å; A62-G64 PolarHBondContact O-N 3.46Å
63	E	28.3	Very low	36.4	Very low	199 Å²	199	145.8 Å²	145.8	93%	0.93	75%	0.748	S	S	*	*			trans	-63.7	87.4	166.9	-68.2	-178	155	0	0	107.3	K61 E65	K61-E63 PolarHBondContact O-N 3.02Å; E63-E65 PolarHBondContact O-N 2.81Å
64	G	33.1	Very low	39.1	Very low	56 Å²	56	145.6 Å²	145.6	58%	0.577	74%	0.739	S	S	*	*			trans	-68	126	166.4	0	0	0	0	0	108.1	A62 H66	A62-G64 PolarHBondContact O-N 3.46Å; G64-H66 PolarHBondContact O-N 3.17Å
65	E	33.6	Very low	42.2	Very low	191 Å²	191	138.8 Å²	138.8	89%	0.893	71%	0.706	S	S	*	*			trans	-30	91.6	171.1	-65	170.3	155.9	0	0	112.4	E63 N67	E63-E65 PolarHBondContact O-N 2.81Å; E65-N67 VanDerWaalsContact C-N 3.31Å; E65-N67 PolarHBondContact O-N 3.02Å
66	H	36.9	Very low	45.4	Very low	162 Å²	162	137.9 Å²	137.9	75%	0.75	69%	0.69	S	S	*	*			trans	-73.4	95.5	163	-99.4	-60.3	0	0	0	106.5	G64 E68	G64-H66 PolarHBondContact O-N 3.17Å; H66-E68 PolarHBondContact O-N 3.26Å; H66-E68 VanDerWaalsContact O-N 3.17Å
67	N	44.5	Very low	48.5	Very low	103 Å²	103	133.2 Å²	133.2	55%	0.551	65%	0.65	S	S	*	*			trans	-30	117.2	170.9	-100.1	-17.3	0	0	0	111.3	E65 D69 D70	E65-N67 VanDerWaalsContact C-N 3.31Å; E65-N67 PolarHBondContact O-N 3.02Å; N67-D69 PolarHBondContact O-N 2.76Å; N67-D70 PolarHBondContact O-N 3.01Å
68	E	44.1	Very low	51.8	Low	166 Å²	166	127.7 Å²	127.7	78%	0.776	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-55	-24.4	178.4	-71.6	-154	138.3	0	0	113	H66 D70 K71	H66-E68 PolarHBondContact O-N 3.26Å; H66-E68 VanDerWaalsContact O-N 3.17Å; E68-D70 VanDerWaalsContact C-N 3.25Å; E68-D70 PolarHBondContact O-N 3.21Å; E68-K71 PolarHBondContact O-N 3.24Å
69	D	48.9	Very low	54.9	Low	108 Å²	108	118 Å²	118	58%	0.578	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-60.9	-26.2	175.5	-86.3	-26.4	0	0	0	114.8	N67 K71 R153	N67-D69 PolarHBondContact O-N 2.76Å; D69-K71 VanDerWaalsContact C-N 3.32Å; D69-R153 PolarHBondContact O-NH2 3.26Å
70	D	49.1	Very low	58.3	Low	81 Å²	81	106.5 Å²	106.5	43%	0.433	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-78.9	-16.2	-179.7	-112.1	14.4	0	0	0	112.8	N67 E68 K75	N67-D70 PolarHBondContact O-N 3.01Å; E68-D70 VanDerWaalsContact C-N 3.25Å; E68-D70 PolarHBondContact O-N 3.21Å; D70-K75 VanDerWaalsContact CG-NZ 3.26Å; D70-K75 WeakPolarHBondContact OD1-CE 3.19Å; D70-K75 IonicContact OD1-NZ 2.76Å; D70-K75 PolarHBondContact OD1-NZ 2.81Å; D70-K75 IonicContact OD2-NZ 3.42Å; D70-K75 PolarHBondContact OD2-NZ 3.4Å
71	K	49.1	Very low	61.6	Low	175 Å²	175	98.9 Å²	98.9	76%	0.761	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-82.1	-16.6	177.5	-72.7	-179.5	179.6	172	0	113.4	E68 D69	E68-K71 PolarHBondContact O-N 3.24Å; D69-K71 VanDerWaalsContact C-N 3.32Å
72	R	56	Low	65	Low	191 Å²	191	89.4 Å²	89.4	72%	0.721	45%	0.45	S	S	*	.	S	Bend	trans	-79.2	-27.9	-167	-141	165.9	-175.6	170.4	0.6	114.4
73	F	58.8	Low	68.3	Low	121 Å²	121	85.3 Å²	85.3	53%	0.531	42%	0.416	S	S	.	.	S	Bend	trans	-155.6	132.6	174.7	-68.1	-80.2	0	0	0	112.8	K75 R153	F73-K75 PolarHBondContact O-N 3.04Å; F73-R153 HydrophobicContact CB-CG 4.03Å
74	P	81.2	Confident	71.7	Confident	92 Å²	92	75.8 Å²	75.8	60%	0.597	37%	0.372	S	S	*	.			trans	-71.6	125.9	-176.2	27.8	-33.6	0	0	0	112.4
75	K	89.9	Confident	74.7	Confident	54 Å²	54	73.3 Å²	73.3	24%	0.235	35%	0.345	C	S	.	.			trans	-62.5	138.1	172.7	-64.1	169.9	-173.9	158.1	0	110.4	D70 F73 H122 K151 L152	D70-K75 VanDerWaalsContact CG-NZ 3.26Å; D70-K75 WeakPolarHBondContact OD1-CE 3.19Å; D70-K75 IonicContact OD1-NZ 2.76Å; D70-K75 PolarHBondContact OD1-NZ 2.81Å; D70-K75 IonicContact OD2-NZ 3.42Å; D70-K75 PolarHBondContact OD2-NZ 3.4Å; F73-K75 PolarHBondContact O-N 3.04Å; K75-H122 PolarHBondContact NZ-CE1 3.28Å; K75-H122 PolarHBondContact NZ-NE2 3.33Å; K75-H122 VanDerWaalsContact NZ-NE2 3.14Å; K75-K151 HydrophobicContact CB-CB 4.48Å; K75-L152 CarbonylContact C-O 3.48Å; K75-L152 WeakPolarHBondContact CA-O 3.33Å
76	K	94.9	Very high	77.7	Confident	81 Å²	81	64.3 Å²	64.3	35%	0.352	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	143.3	176.4	-59.5	-61.7	-177.3	177.6	0	110.4	K151 L152 L154	K76-K151 WeakPolarHBondContact O-CA 3.36Å; K76-L152 PolarHBondContact N-O 3.49Å; K76-L152 PolarHBondContact O-N 2.9Å; K76-L154 HydrophobicContact CB-CD1 3.93Å; K76-L154 HydrophobicContact CB-CG 4.12Å; K76-L154 HydrophobicContact CG-CD1 3.72Å; K76-L154 HydrophobicContact CG-CG 4.14Å
77	K	96.6	Very high	80.3	Confident	9 Å²	9	60.6 Å²	60.6	4%	0.039	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.2	173.1	-171.3	75.9	-176.6	-167.4	0	108.6	S130 K151 V178 T179 F182	K77-S130 PolarHBondContact NZ-O 2.89Å; K77-K151 HydrophobicContact CB-CG 4.43Å; K77-K151 HydrophobicContact CD-CG 3.75Å; K77-V178 HydrophobicContact CB-CG2 4.32Å; K77-V178 HydrophobicContact CG-CG2 3.72Å; K77-V178 PolarHBondContact O-N 3.26Å; K77-V178 VanDerWaalsContact O-N 3.11Å; K77-T179 WeakPolarHBondContact CG-O 3.47Å; K77-F182 WeakPolarHBondContact CE-O 3.43Å; K77-F182 PolarHBondContact NZ-O 3.14Å
78	V	97.1	Very high	82.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	168.2	-177.5	-54.1	0	0	0	0	111.2	L80 S149 L150 L152 L154 L175 K176 R177	V78-L80 HydrophobicContact CG2-CD2 4.28Å; V78-S149 VanDerWaalsContact O-CA 3.22Å; V78-S149 WeakPolarHBondContact O-CA 3.23Å; V78-S149 WeakPolarHBondContact O-CB 3.42Å; V78-L150 HydrophobicContact CG2-CD2 4.03Å; V78-L150 HydrophobicContact CG2-CG 4.4Å; V78-L150 PolarHBondContact N-O 3.04Å; V78-L150 PolarHBondContact O-N 2.85Å; V78-L150 VanDerWaalsContact O-N 3.08Å; V78-L152 HydrophobicContact CG1-CD1 4.14Å; V78-L152 HydrophobicContact CG1-CG 4.5Å; V78-L152 HydrophobicContact CG2-CD1 4.1Å; V78-L152 HydrophobicContact CG2-CD2 3.7Å; V78-L152 HydrophobicContact CG2-CG 3.66Å; V78-L154 HydrophobicContact CG1-CD2 4Å; V78-L175 HydrophobicContact CB-CD2 4.48Å; V78-L175 HydrophobicContact CB-CG 4.44Å; V78-L175 HydrophobicContact CG1-CD2 4.29Å; V78-K176 CarbonylContact C-O 3.59Å; V78-K176 VanDerWaalsContact CA-O 3.25Å; V78-K176 WeakPolarHBondContact CA-O 3.22Å; V78-K176 WeakPolarHBondContact CB-O 3.35Å; V78-R177 HydrophobicContact CG1-CG 4.47Å
79	V	98	Very high	84.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.7	168	178.1	0	0	0	0	108.2	V147 V148 L175 K176 V178 F182 L349 W351	V79-V147 HydrophobicContact CG1-CG1 3.19Å; V79-V148 CarbonylContact C-O 3.51Å; V79-V148 VanDerWaalsContact CA-O 3.23Å; V79-V148 WeakPolarHBondContact CA-O 3.25Å; V79-V148 WeakPolarHBondContact CG1-O 3.36Å; V79-L175 WeakPolarHBondContact O-CA 3.18Å; V79-K176 PolarHBondContact N-O 3.04Å; V79-K176 PolarHBondContact O-N 2.64Å; V79-V178 HydrophobicContact CB-CG1 4.39Å; V79-V178 HydrophobicContact CG2-CB 4.36Å; V79-V178 HydrophobicContact CG2-CG1 3.53Å; V79-V178 HydrophobicContact CG2-CG2 3.91Å; V79-F182 HydrophobicContact CG2-CD1 3.7Å; V79-F182 HydrophobicContact CG2-CE1 3.34Å; V79-F182 HydrophobicContact CG2-CZ 4.19Å; V79-L349 HydrophobicContact CB-CD2 4.31Å; V79-L349 HydrophobicContact CG1-CD2 4.49Å; V79-L349 HydrophobicContact CG2-CD2 4.26Å; V79-W351 HydrophobicContact CG1-CH2 4.31Å; V79-W351 HydrophobicContact CG1-CZ2 3.91Å
80	L	98.5	Very high	86.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.1	171.6	-52.6	178.7	0	0	0	109.6	V78 L82 L108 V147 V148 L150 V172 G174 L175	V78-L80 HydrophobicContact CG2-CD2 4.28Å; L80-L82 HydrophobicContact CB-CG 4.49Å; L80-L108 HydrophobicContact CD1-CD1 4.49Å; L80-V147 WeakPolarHBondContact O-CA 3.31Å; L80-V148 HydrophobicContact CB-CG2 3.76Å; L80-V148 HydrophobicContact CD1-CG2 4.22Å; L80-V148 HydrophobicContact CG-CG2 4.21Å; L80-V148 PolarHBondContact N-O 3.1Å; L80-V148 PolarHBondContact O-N 3.12Å; L80-V148 VanDerWaalsContact O-N 3.08Å; L80-L150 HydrophobicContact CD1-CD2 3.83Å; L80-L150 HydrophobicContact CG-CD2 3.88Å; L80-V172 HydrophobicContact CB-CG1 4.4Å; L80-V172 HydrophobicContact CD2-CG1 4.32Å; L80-G174 WeakPolarHBondContact CA-O 3.42Å; L80-L175 HydrophobicContact CD2-CB 3.92Å; L80-L175 HydrophobicContact CD2-CD1 3.51Å; L80-L175 HydrophobicContact CD2-CG 3.68Å
81	L	98.8	Very high	89	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.4	164.7	176.3	69.1	0	0	0	108.5	V147 V172 L173 G174 W351 E354 I358	L81-V147 HydrophobicContact CD1-CG2 4.23Å; L81-V172 CarbonylContact O-C 3.39Å; L81-V172 WeakPolarHBondContact O-CA 3.42Å; L81-L173 HydrophobicContact CD2-CB 3.83Å; L81-L173 HydrophobicContact CG-CB 4.12Å; L81-L173 PolarHBondContact O-N 3.13Å; L81-G174 PolarHBondContact N-O 3.08Å; L81-W351 HydrophobicContact CB-CD2 3.93Å; L81-W351 HydrophobicContact CB-CE3 3.93Å; L81-W351 HydrophobicContact CB-CH2 3.94Å; L81-W351 HydrophobicContact CB-CZ2 3.94Å; L81-W351 HydrophobicContact CB-CZ3 3.94Å; L81-W351 HydrophobicContact CD1-CD2 4.35Å; L81-W351 HydrophobicContact CD1-CG 4.25Å; L81-W351 HydrophobicContact CD2-CB 3.96Å; L81-W351 HydrophobicContact CD2-CD2 3.82Å; L81-W351 HydrophobicContact CD2-CE3 3.96Å; L81-W351 HydrophobicContact CD2-CG 3.83Å; L81-W351 HydrophobicContact CG-CD2 4.25Å; L81-W351 HydrophobicContact CG-CG 4.46Å; L81-E354 HydrophobicContact CD2-CB 3.82Å; L81-E354 HydrophobicContact CD2-CG 4.19Å; L81-I358 HydrophobicContact CD2-CD1 3.9Å; L81-I358 HydrophobicContact CD2-CG1 4.15Å
82	L	98.6	Very high	91.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.5	-175.1	-70.2	154.8	0	0	0	110.2	L80 M92 L108 Q146 V148 R171 V172	L80-L82 HydrophobicContact CB-CG 4.49Å; L82-M92 HydrophobicContact CD1-CE 4.41Å; L82-L108 HydrophobicContact CD1-CD2 3.72Å; L82-L108 HydrophobicContact CD2-CD1 3.88Å; L82-L108 HydrophobicContact CD2-CD2 4.09Å; L82-Q146 HydrophobicContact CB-CB 4.02Å; L82-Q146 HydrophobicContact CB-CG 4.24Å; L82-Q146 HydrophobicContact CD1-CG 4.21Å; L82-Q146 PolarHBondContact N-O 3.36Å; L82-Q146 WeakPolarHBondContact O-CB 3.37Å; L82-Q146 PolarHBondContact O-N 3.16Å; L82-V148 HydrophobicContact CD1-CB 4.1Å; L82-V148 HydrophobicContact CD1-CG1 3.55Å; L82-V148 HydrophobicContact CD1-CG2 3.45Å; L82-V148 VanDerWaalsContact CD1-CG2 3.45Å; L82-V148 HydrophobicContact CG-CG2 4.46Å; L82-R171 WeakPolarHBondContact CA-O 3.32Å; L82-V172 HydrophobicContact CD2-CG2 3.67Å
83	A	98.8	Very high	93.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.9	166.7	0	0	0	0	0	110.3	A143 I170 R171 L173 F361	A83-A143 CarbonylContact C-O 3.58Å; A83-A143 WeakPolarHBondContact CA-O 3.5Å; A83-I170 CarbonylContact O-C 3.58Å; A83-I170 WeakPolarHBondContact O-CA 3.44Å; A83-R171 PolarHBondContact N-O 3.07Å; A83-R171 PolarHBondContact O-N 2.85Å; A83-L173 HydrophobicContact CB-CD1 3.64Å; A83-L173 HydrophobicContact CB-CG 4.18Å; A83-F361 HydrophobicContact CB-CB 4.47Å; A83-F361 HydrophobicContact CB-CD1 3.41Å; A83-F361 VanDerWaalsContact CB-CD1 3.41Å; A83-F361 HydrophobicContact CB-CD2 4.35Å; A83-F361 HydrophobicContact CB-CE1 3.62Å; A83-F361 HydrophobicContact CB-CG 3.81Å; A83-F361 HydrophobicContact CB-CZ 4.2Å
84	Y	98.7	Very high	94.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	148.9	177.4	53.4	-94.8	0	0	0	113.6	M92 I104 T137 S142 A143 Q146 Q169	Y84-M92 HydrophobicContact CE1-SD 4.22Å; Y84-I104 HydrophobicContact CD1-CD1 4.48Å; Y84-I104 HydrophobicContact CD1-CG1 4.33Å; Y84-I104 HydrophobicContact CD1-CG2 3.71Å; Y84-I104 HydrophobicContact CD2-CD1 3.67Å; Y84-I104 HydrophobicContact CD2-CG1 3.77Å; Y84-I104 HydrophobicContact CE1-CG1 4.42Å; Y84-I104 HydrophobicContact CE1-CG2 3.97Å; Y84-I104 HydrophobicContact CE2-CD1 4.3Å; Y84-I104 HydrophobicContact CE2-CG1 3.89Å; Y84-I104 HydrophobicContact CG-CD1 3.78Å; Y84-I104 HydrophobicContact CG-CG1 4Å; Y84-I104 HydrophobicContact CG-CG2 4.07Å; Y84-T137 VanDerWaalsContact OH-CG2 3.28Å; Y84-T137 WeakPolarHBondContact OH-CG2 3.25Å; Y84-T137 PolarHBondContact OH-OG1 3.1Å; Y84-S142 WeakPolarHBondContact O-CB 3.23Å; Y84-A143 HydrophobicContact CD1-CB 4.13Å; Y84-A143 HydrophobicContact CD2-CB 4.34Å; Y84-A143 HydrophobicContact CE1-CB 3.54Å; Y84-A143 HydrophobicContact CE2-CB 3.78Å; Y84-A143 HydrophobicContact CG-CB 4.49Å; Y84-A143 PolarHBondContact N-O 2.83Å; Y84-A143 PolarHBondContact O-N 3.41Å; Y84-A143 WeakPolarHBondContact OH-CB 3.4Å; Y84-Q146 HydrophobicContact CE1-CB 3.67Å; Y84-Q146 HydrophobicContact CE1-CG 3.97Å; Y84-Q146 PolarHBondContact OH-NE2 3.12Å; Y84-Q169 CarbonylContact C-O 3.58Å; Y84-Q169 WeakPolarHBondContact CA-O 3.33Å; Y84-Q169 WeakPolarHBondContact CB-O 3.28Å
85	S	97.8	Very high	94.5	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.028	15%	0.149	C	C	.	.			trans	-86.3	123.8	161.3	179.2	0	0	0	0	109.4	K87 Q169	S85-K87 VanDerWaalsContact C-N 3.31Å; S85-K87 PolarHBondContact O-N 3.29Å; S85-Q169 PolarHBondContact N-O 3Å; S85-Q169 PolarHBondContact O-NE2 3.31Å; S85-Q169 VanDerWaalsContact O-NE2 3.08Å
86	G	95.1	Very high	93.4	Very high	2 Å²	2	32.4 Å²	32.4	2%	0.021	18%	0.178	C	C	.	.			trans	-77.3	-9.7	-175.5	0	0	0	0	0	115	G88 Y89 G140 V141 S142	G86-G88 PolarHBondContact O-N 3Å; G86-Y89 PolarHBondContact O-N 3.44Å; G86-G140 WeakPolarHBondContact O-CA 3.39Å; G86-V141 WeakPolarHBondContact CA-O 3.17Å; G86-S142 PolarHBondContact N-OG 2.76Å
87	K	91.2	Very high	91.9	Very high	83 Å²	83	32.7 Å²	32.7	36%	0.361	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	128.5	-179.8	-171.8	170.5	-173.6	165.9	0	110	S85 Q169 T369 T373 E377	S85-K87 VanDerWaalsContact C-N 3.31Å; S85-K87 PolarHBondContact O-N 3.29Å; K87-Q169 PolarHBondContact O-NE2 3.32Å; K87-Q169 VanDerWaalsContact O-NE2 3.12Å; K87-T369 HydrophobicContact CB-CG2 3.74Å; K87-T369 HydrophobicContact CD-CG2 3.56Å; K87-T369 HydrophobicContact CG-CG2 4.25Å; K87-T373 PolarHBondContact NZ-OG1 2.98Å; K87-E377 IonicContact NZ-OE1 2.7Å; K87-E377 PolarHBondContact NZ-OE1 2.99Å
88	G	90.1	Very high	90.3	Very high	68 Å²	68	35.5 Å²	35.5	70%	0.701	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.8	-3.9	-176.5	0	0	0	0	0	115.3	G86	G86-G88 PolarHBondContact O-N 3Å
89	Y	93.4	Very high	88.6	Confident	15 Å²	15	41.6 Å²	41.6	6%	0.059	26%	0.262	C	S	.	.			trans	-111.9	146.5	-179.4	-69.7	-94.3	0	0	0	112.7	G86 G91 R102 T103 I104 D107 G140 Q169 I170	G86-Y89 PolarHBondContact O-N 3.44Å; Y89-G91 PolarHBondContact O-N 2.91Å; Y89-G91 VanDerWaalsContact O-N 3.16Å; Y89-R102 WeakPolarHBondContact CA-O 3.43Å; Y89-R102 HydrophobicContact CD1-CG 4.39Å; Y89-R102 HydrophobicContact CE1-CG 3.99Å; Y89-T103 VanDerWaalsContact CD1-C 3.46Å; Y89-I104 HydrophobicContact CD1-CD1 3.71Å; Y89-I104 HydrophobicContact CD1-CG1 4.39Å; Y89-I104 HydrophobicContact CD2-CD1 3.93Å; Y89-I104 HydrophobicContact CE1-CD1 4.11Å; Y89-I104 HydrophobicContact CE2-CD1 4.36Å; Y89-I104 HydrophobicContact CG-CD1 3.59Å; Y89-I104 HydrophobicContact CG-CG1 4.41Å; Y89-D107 PolarHBondContact OH-OD2 3.02Å; Y89-G140 PolarHBondContact O-N 3.34Å; Y89-Q169 HydrophobicContact CE2-CG 4.4Å; Y89-Q169 VanDerWaalsContact CE2-NE2 3.27Å; Y89-I170 HydrophobicContact CE1-CD1 4.03Å; Y89-I170 HydrophobicContact CE2-CD1 4.43Å
90	Y	93.3	Very high	87.3	Confident	78 Å²	78	49.4 Å²	49.4	31%	0.306	30%	0.299	S	S	.	.			trans	-88.9	39.4	176.9	-77.1	-104.8	0	0	0	112.5	F101 R102 K139	Y90-F101 HydrophobicContact CD1-CB 3.89Å; Y90-F101 HydrophobicContact CD1-CD1 4.08Å; Y90-F101 AromaticContact CD1-CD2 3.98Å; Y90-F101 HydrophobicContact CD1-CD2 3.98Å; Y90-F101 AromaticContact CD1-CG 3.7Å; Y90-F101 HydrophobicContact CD1-CG 3.7Å; Y90-F101 HydrophobicContact CD2-CB 3.48Å; Y90-F101 VanDerWaalsContact CD2-CB 3.48Å; Y90-F101 AromaticContact CD2-CD1 3.71Å; Y90-F101 HydrophobicContact CD2-CD1 3.71Å; Y90-F101 AromaticContact CD2-CG 3.75Å; Y90-F101 HydrophobicContact CD2-CG 3.75Å; Y90-F101 HydrophobicContact CE1-CB 4.29Å; Y90-F101 AromaticContact CE1-CD1 3.57Å; Y90-F101 HydrophobicContact CE1-CD1 3.57Å; Y90-F101 AromaticContact CE1-CD2 3.89Å; Y90-F101 HydrophobicContact CE1-CD2 3.89Å; Y90-F101 AromaticContact CE1-CE1 3.78Å; Y90-F101 HydrophobicContact CE1-CE1 3.78Å; Y90-F101 HydrophobicContact CE1-CE2 4.08Å; Y90-F101 AromaticContact CE1-CG 3.63Å; Y90-F101 HydrophobicContact CE1-CG 3.63Å; Y90-F101 HydrophobicContact CE1-CZ 4.03Å; Y90-F101 HydrophobicContact CE2-CB 3.94Å; Y90-F101 AromaticContact CE2-CD1 3.15Å; Y90-F101 HydrophobicContact CE2-CD1 3.15Å; Y90-F101 AromaticContact CE2-CE1 3.84Å; Y90-F101 HydrophobicContact CE2-CE1 3.84Å; Y90-F101 AromaticContact CE2-CG 3.69Å; Y90-F101 HydrophobicContact CE2-CG 3.69Å; Y90-F101 HydrophobicContact CG-CB 3.47Å; Y90-F101 VanDerWaalsContact CG-CB 3.47Å; Y90-F101 HydrophobicContact CG-CD1 4.14Å; Y90-F101 HydrophobicContact CG-CD2 4.44Å; Y90-F101 AromaticContact CG-CG 3.77Å; Y90-F101 HydrophobicContact CG-CG 3.77Å; Y90-F101 AromaticContact CZ-CD1 3.08Å; Y90-F101 AromaticContact CZ-CE1 3.3Å; Y90-F101 AromaticContact CZ-CG 3.64Å; Y90-F101 WeakPolarHBondContact OH-CD1 3.44Å; Y90-F101 WeakPolarHBondContact OH-CE1 3.26Å; Y90-R102 PolarHBondContact N-O 2.82Å; Y90-K139 HydrophobicContact CD1-CD 3.79Å; Y90-K139 HydrophobicContact CD1-CG 4.33Å; Y90-K139 HydrophobicContact CE1-CD 3.73Å; Y90-K139 HydrophobicContact CG-CD 4.41Å; Y90-K139 PolarHBondContact OH-NZ 3.18Å; Y90-K139 VanDerWaalsContact OH-NZ 3.16Å
91	G	93.8	Very high	86.5	Confident	4 Å²	4	52.6 Å²	52.6	4%	0.041	31%	0.313	C	S	.	.			trans	89.2	-172.6	179.6	0	0	0	0	0	113.6	Y89 T103 I104 T137 D138	Y89-G91 PolarHBondContact O-N 2.91Å; Y89-G91 VanDerWaalsContact O-N 3.16Å; G91-T103 WeakPolarHBondContact O-CA 3.49Å; G91-T103 WeakPolarHBondContact O-CB 3.47Å; G91-I104 PolarHBondContact O-N 3.46Å; G91-I104 VanDerWaalsContact O-N 3.12Å; G91-T137 VanDerWaalsContact CA-O 3.23Å; G91-T137 WeakPolarHBondContact CA-O 3.38Å; G91-D138 WeakPolarHBondContact CA-O 3.45Å
92	M	96.2	Very high	86.1	Confident	0 Å²	0	59 Å²	59	0%	0	34%	0.337	C	S	.	.	S	Bend	trans	-71.3	-52.4	-177.1	175.8	67	-178.8	0	0	112.6	L82 Y84 I104 E105 F131 R133 T137 Q146 V148	L82-M92 HydrophobicContact CD1-CE 4.41Å; Y84-M92 HydrophobicContact CE1-SD 4.22Å; M92-I104 HydrophobicContact SD-CB 3.84Å; M92-I104 HydrophobicContact SD-CG2 3.8Å; M92-E105 HydrophobicContact CE-CG 3.72Å; M92-E105 HydrophobicContact CG-CG 4.31Å; M92-E105 VanDerWaalsContact O-CB 3.25Å; M92-E105 WeakPolarHBondContact O-CB 3.34Å; M92-E105 WeakPolarHBondContact O-CG 3.44Å; M92-E105 PolarHBondContact O-N 3.4Å; M92-E105 HydrophobicContact SD-CG 4.2Å; M92-F131 HydrophobicContact CE-CZ 4.36Å; M92-R133 HydrophobicContact CE-CB 4.13Å; M92-R133 HydrophobicContact CG-CG 4.43Å; M92-T137 WeakPolarHBondContact CB-OG1 3.33Å; M92-T137 PolarHBondContact N-O 3.01Å; M92-T137 VanDerWaalsContact N-O 3.13Å; M92-T137 PolarHBondContact N-OG1 3.32Å; M92-Q146 HydrophobicContact CE-CG 4.15Å; M92-Q146 HydrophobicContact SD-CG 4.29Å; M92-V148 HydrophobicContact CE-CG1 3.4Å; M92-V148 VanDerWaalsContact CE-CG1 3.4Å
93	Q	94.6	Very high	86	Confident	63 Å²	63	59 Å²	59	29%	0.294	34%	0.337	S	S	.	.	S	Bend	trans	-85.6	134.9	-164	-173	-175.5	-21.5	0	0	111.8	T103 R136	Q93-T103 WeakPolarHBondContact O-CG2 3.37Å; Q93-R136 VanDerWaalsContact OE1-CD 3.27Å
94	R	89.4	Confident	85.9	Confident	49 Å²	49	59 Å²	59	19%	0.185	34%	0.337	C	S	.	.			trans	-56.1	140.4	171.3	-65.5	-172.2	164	177	-13.2	111.9	P96 E105 D106 V109 G123 M126	R94-P96 WeakPolarHBondContact O-CD 3.23Å; R94-E105 HydrophobicContact CG-CB 3.68Å; R94-E105 PolarHBondContact N-OE2 3.46Å; R94-D106 VanDerWaalsContact CD-OD1 3.26Å; R94-D106 WeakPolarHBondContact CD-OD1 3.26Å; R94-D106 VanDerWaalsContact CG-OD1 3.28Å; R94-D106 WeakPolarHBondContact CG-OD1 3.36Å; R94-D106 IonicContact CZ-OD1 3.86Å; R94-D106 IonicContact NE-OD1 3.42Å; R94-D106 PolarHBondContact NE-OD1 3.41Å; R94-D106 PolarHBondContact NH2-O 2.99Å; R94-D106 IonicContact NH2-OD1 3.7Å; R94-V109 VanDerWaalsContact NH2-CG1 3.27Å; R94-G123 PolarHBondContact NH1-O 3.03Å; R94-M126 HydrophobicContact CG-SD 4.41Å
95	N	80.2	Confident	85.9	Confident	91 Å²	91	59 Å²	59	49%	0.487	34%	0.337	S	S	.	.			trans	-107.9	98.3	170.4	-67.9	-39.4	0	0	0	109.3	G97 N98	N95-G97 PolarHBondContact O-N 3.4Å; N95-G97 VanDerWaalsContact O-N 3.16Å; N95-N98 PolarHBondContact O-N 3.41Å
96	P	67.6	Low	85.8	Confident	131 Å²	131	60.9 Å²	60.9	85%	0.851	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	119.1	178	-16.5	29.8	0	0	0	109.4	R94	R94-P96 WeakPolarHBondContact O-CD 3.23Å
97	G	62.2	Low	85.9	Confident	88 Å²	88	61.1 Å²	61.1	91%	0.907	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.4	-5.2	178.5	0	0	0	0	0	115.8	N95	N95-G97 PolarHBondContact O-N 3.4Å; N95-G97 VanDerWaalsContact O-N 3.16Å
98	N	63.3	Low	86.2	Confident	68 Å²	68	57.1 Å²	57.1	36%	0.364	33%	0.33	S	S	.	.			trans	-132.4	84.5	173.2	-165.3	-20.7	0	0	0	111.1	N95 Q100 F101	N95-N98 PolarHBondContact O-N 3.41Å; N98-Q100 PolarHBondContact O-N 3.41Å; N98-Q100 PolarHBondContact OD1-N 3.42Å; N98-F101 VanDerWaalsContact ND2-CD2 3.28Å; N98-F101 WeakPolarHBondContact ND2-CD2 3.39Å; N98-F101 VanDerWaalsContact ND2-CE2 3.26Å; N98-F101 WeakPolarHBondContact ND2-CE2 3.28Å
99	S	62.3	Low	86.6	Confident	128 Å²	128	54 Å²	54	90%	0.895	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-8	-177.3	58.5	0	0	0	0	114.3	F101	S99-F101 PolarHBondContact O-N 3.29Å
100	Q	69.8	Low	86.7	Confident	163 Å²	163	56.3 Å²	56.3	76%	0.762	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-19.6	178.8	-70.3	-179.5	-3.3	0	0	112.6	N98	N98-Q100 PolarHBondContact O-N 3.41Å; N98-Q100 PolarHBondContact OD1-N 3.42Å
101	F	81.7	Confident	87	Confident	67 Å²	67	52.6 Å²	52.6	29%	0.294	30%	0.298	S	S	.	.	S	Bend	trans	-116.3	94.6	-169	-65.1	-33.2	0	0	0	111.7	Y90 N98 S99	Y90-F101 HydrophobicContact CD1-CB 3.89Å; Y90-F101 HydrophobicContact CD1-CD1 4.08Å; Y90-F101 AromaticContact CD1-CD2 3.98Å; Y90-F101 HydrophobicContact CD1-CD2 3.98Å; Y90-F101 AromaticContact CD1-CG 3.7Å; Y90-F101 HydrophobicContact CD1-CG 3.7Å; Y90-F101 HydrophobicContact CD2-CB 3.48Å; Y90-F101 VanDerWaalsContact CD2-CB 3.48Å; Y90-F101 AromaticContact CD2-CD1 3.71Å; Y90-F101 HydrophobicContact CD2-CD1 3.71Å; Y90-F101 AromaticContact CD2-CG 3.75Å; Y90-F101 HydrophobicContact CD2-CG 3.75Å; Y90-F101 HydrophobicContact CE1-CB 4.29Å; Y90-F101 AromaticContact CE1-CD1 3.57Å; Y90-F101 HydrophobicContact CE1-CD1 3.57Å; Y90-F101 AromaticContact CE1-CD2 3.89Å; Y90-F101 HydrophobicContact CE1-CD2 3.89Å; Y90-F101 AromaticContact CE1-CE1 3.78Å; Y90-F101 HydrophobicContact CE1-CE1 3.78Å; Y90-F101 HydrophobicContact CE1-CE2 4.08Å; Y90-F101 AromaticContact CE1-CG 3.63Å; Y90-F101 HydrophobicContact CE1-CG 3.63Å; Y90-F101 HydrophobicContact CE1-CZ 4.03Å; Y90-F101 HydrophobicContact CE2-CB 3.94Å; Y90-F101 AromaticContact CE2-CD1 3.15Å; Y90-F101 HydrophobicContact CE2-CD1 3.15Å; Y90-F101 AromaticContact CE2-CE1 3.84Å; Y90-F101 HydrophobicContact CE2-CE1 3.84Å; Y90-F101 AromaticContact CE2-CG 3.69Å; Y90-F101 HydrophobicContact CE2-CG 3.69Å; Y90-F101 HydrophobicContact CG-CB 3.47Å; Y90-F101 VanDerWaalsContact CG-CB 3.47Å; Y90-F101 HydrophobicContact CG-CD1 4.14Å; Y90-F101 HydrophobicContact CG-CD2 4.44Å; Y90-F101 AromaticContact CG-CG 3.77Å; Y90-F101 HydrophobicContact CG-CG 3.77Å; Y90-F101 AromaticContact CZ-CD1 3.08Å; Y90-F101 AromaticContact CZ-CE1 3.3Å; Y90-F101 AromaticContact CZ-CG 3.64Å; Y90-F101 WeakPolarHBondContact OH-CD1 3.44Å; Y90-F101 WeakPolarHBondContact OH-CE1 3.26Å; N98-F101 VanDerWaalsContact ND2-CD2 3.28Å; N98-F101 WeakPolarHBondContact ND2-CD2 3.39Å; N98-F101 VanDerWaalsContact ND2-CE2 3.26Å; N98-F101 WeakPolarHBondContact ND2-CE2 3.28Å; S99-F101 PolarHBondContact O-N 3.29Å
102	R	90.7	Very high	87.2	Confident	136 Å²	136	52.4 Å²	52.4	51%	0.513	30%	0.296	S	S	.	.			trans	-62.3	135.7	178.6	-160.2	177.3	-174.6	-174.3	-4.6	111.5	Y89 Y90 D106 D107	Y89-R102 WeakPolarHBondContact CA-O 3.43Å; Y89-R102 HydrophobicContact CD1-CG 4.39Å; Y89-R102 HydrophobicContact CE1-CG 3.99Å; Y90-R102 PolarHBondContact N-O 2.82Å; R102-D106 HydrophobicContact CG-CB 4.31Å; R102-D107 VanDerWaalsContact CZ-CG 3.5Å; R102-D107 IonicContact CZ-OD1 3.62Å; R102-D107 IonicContact CZ-OD2 3.26Å; R102-D107 VanDerWaalsContact CZ-OD2 3.23Å; R102-D107 IonicContact NE-OD1 3.98Å; R102-D107 PolarHBondContact NE-OD1 3.36Å; R102-D107 IonicContact NE-OD2 3.64Å; R102-D107 PolarHBondContact NE-OD2 3.5Å; R102-D107 IonicContact NH2-OD1 2.77Å; R102-D107 PolarHBondContact NH2-OD1 2.94Å; R102-D107 IonicContact NH2-OD2 3.68Å; R102-D107 PolarHBondContact NH2-OD2 3.2Å
103	T	95.9	Very high	87.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.311	C	S	.	.			trans	-117.2	163.9	178.5	66.8	0	0	0	0	111	Y89 G91 Q93 E105 D106	Y89-T103 VanDerWaalsContact CD1-C 3.46Å; G91-T103 WeakPolarHBondContact O-CA 3.49Å; G91-T103 WeakPolarHBondContact O-CB 3.47Å; Q93-T103 WeakPolarHBondContact O-CG2 3.37Å; T103-E105 VanDerWaalsContact C-N 3.27Å; T103-E105 PolarHBondContact O-N 2.96Å; T103-D106 WeakPolarHBondContact CB-OD2 3.28Å; T103-D106 PolarHBondContact N-OD2 2.95Å; T103-D106 WeakPolarHBondContact O-CB 3.4Å; T103-D106 PolarHBondContact O-N 2.65Å; T103-D106 VanDerWaalsContact O-N 3.11Å; T103-D106 PolarHBondContact OG1-N 3.08Å; T103-D106 PolarHBondContact OG1-OD2 3.02Å
104	I	97.8	Very high	87.4	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-37.2	178.5	-56.8	-63.1	0	0	0	110.9	Y84 Y89 G91 M92 D106 D107 L108 I170	Y84-I104 HydrophobicContact CD1-CD1 4.48Å; Y84-I104 HydrophobicContact CD1-CG1 4.33Å; Y84-I104 HydrophobicContact CD1-CG2 3.71Å; Y84-I104 HydrophobicContact CD2-CD1 3.67Å; Y84-I104 HydrophobicContact CD2-CG1 3.77Å; Y84-I104 HydrophobicContact CE1-CG1 4.42Å; Y84-I104 HydrophobicContact CE1-CG2 3.97Å; Y84-I104 HydrophobicContact CE2-CD1 4.3Å; Y84-I104 HydrophobicContact CE2-CG1 3.89Å; Y84-I104 HydrophobicContact CG-CD1 3.78Å; Y84-I104 HydrophobicContact CG-CG1 4Å; Y84-I104 HydrophobicContact CG-CG2 4.07Å; Y89-I104 HydrophobicContact CD1-CD1 3.71Å; Y89-I104 HydrophobicContact CD1-CG1 4.39Å; Y89-I104 HydrophobicContact CD2-CD1 3.93Å; Y89-I104 HydrophobicContact CE1-CD1 4.11Å; Y89-I104 HydrophobicContact CE2-CD1 4.36Å; Y89-I104 HydrophobicContact CG-CD1 3.59Å; Y89-I104 HydrophobicContact CG-CG1 4.41Å; G91-I104 PolarHBondContact O-N 3.46Å; G91-I104 VanDerWaalsContact O-N 3.12Å; M92-I104 HydrophobicContact SD-CB 3.84Å; M92-I104 HydrophobicContact SD-CG2 3.8Å; I104-D106 VanDerWaalsContact C-N 3.25Å; I104-D106 PolarHBondContact O-N 2.94Å; I104-D107 PolarHBondContact O-N 3.42Å; I104-L108 WeakPolarHBondContact O-CB 3.43Å; I104-L108 PolarHBondContact O-N 3.22Å; I104-I170 HydrophobicContact CD1-CD1 3.83Å; I104-I170 HydrophobicContact CD1-CG1 4.23Å; I104-I170 HydrophobicContact CG2-CD1 4.41Å; I104-I170 HydrophobicContact CG2-CG2 4.48Å
105	E	97.3	Very high	87.7	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-28.7	174.6	-79.4	175.7	-169.4	0	0	112.7	M92 R94 T103 V109 M126 F131 R133	M92-E105 HydrophobicContact CE-CG 3.72Å; M92-E105 HydrophobicContact CG-CG 4.31Å; M92-E105 VanDerWaalsContact O-CB 3.25Å; M92-E105 WeakPolarHBondContact O-CB 3.34Å; M92-E105 WeakPolarHBondContact O-CG 3.44Å; M92-E105 PolarHBondContact O-N 3.4Å; M92-E105 HydrophobicContact SD-CG 4.2Å; R94-E105 HydrophobicContact CG-CB 3.68Å; R94-E105 PolarHBondContact N-OE2 3.46Å; T103-E105 VanDerWaalsContact C-N 3.27Å; T103-E105 PolarHBondContact O-N 2.96Å; E105-V109 VanDerWaalsContact O-CB 3.25Å; E105-V109 WeakPolarHBondContact O-CB 3.49Å; E105-V109 WeakPolarHBondContact O-CG2 3.19Å; E105-V109 PolarHBondContact O-N 3.38Å; E105-M126 HydrophobicContact CB-CE 4.34Å; E105-M126 HydrophobicContact CG-CE 4.23Å; E105-F131 HydrophobicContact CG-CE1 3.96Å; E105-F131 HydrophobicContact CG-CZ 3.97Å; E105-F131 WeakPolarHBondContact OE1-CE1 3.43Å; E105-R133 IonicContact OE1-CZ 3.73Å; E105-R133 IonicContact OE1-NE 3.59Å; E105-R133 PolarHBondContact OE1-NE 3.46Å; E105-R133 IonicContact OE1-NH2 2.73Å; E105-R133 PolarHBondContact OE1-NH2 2.74Å; E105-R133 IonicContact OE2-CZ 3.89Å; E105-R133 IonicContact OE2-NH2 3.56Å; E105-R133 PolarHBondContact OE2-NH2 3.45Å
106	D	95.8	Very high	88.5	Confident	43 Å²	43	54.5 Å²	54.5	23%	0.23	32%	0.318	C	S	.	.	H	α-helix	trans	-59.4	-50.9	173.6	-66.6	-46.1	0	0	0	111.4	R94 R102 T103 I104 V109 T110	R94-D106 VanDerWaalsContact CD-OD1 3.26Å; R94-D106 WeakPolarHBondContact CD-OD1 3.26Å; R94-D106 VanDerWaalsContact CG-OD1 3.28Å; R94-D106 WeakPolarHBondContact CG-OD1 3.36Å; R94-D106 IonicContact CZ-OD1 3.86Å; R94-D106 IonicContact NE-OD1 3.42Å; R94-D106 PolarHBondContact NE-OD1 3.41Å; R94-D106 PolarHBondContact NH2-O 2.99Å; R94-D106 IonicContact NH2-OD1 3.7Å; R102-D106 HydrophobicContact CG-CB 4.31Å; T103-D106 WeakPolarHBondContact CB-OD2 3.28Å; T103-D106 PolarHBondContact N-OD2 2.95Å; T103-D106 WeakPolarHBondContact O-CB 3.4Å; T103-D106 PolarHBondContact O-N 2.65Å; T103-D106 VanDerWaalsContact O-N 3.11Å; T103-D106 PolarHBondContact OG1-N 3.08Å; T103-D106 PolarHBondContact OG1-OD2 3.02Å; I104-D106 VanDerWaalsContact C-N 3.25Å; I104-D106 PolarHBondContact O-N 2.94Å; D106-V109 PolarHBondContact O-N 3.39Å; D106-T110 WeakPolarHBondContact O-CB 3.45Å; D106-T110 PolarHBondContact O-N 3.23Å; D106-T110 PolarHBondContact O-OG1 2.89Å; D106-T110 VanDerWaalsContact O-OG1 3.08Å
107	D	97.4	Very high	89.8	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.032	28%	0.278	C	S	.	.	H	α-helix	trans	-68.7	-43.5	-178.2	-81.6	15.8	0	0	0	113	Y89 R102 I104 V109 T110 A111 L166 P167 I170	Y89-D107 PolarHBondContact OH-OD2 3.02Å; R102-D107 VanDerWaalsContact CZ-CG 3.5Å; R102-D107 IonicContact CZ-OD1 3.62Å; R102-D107 IonicContact CZ-OD2 3.26Å; R102-D107 VanDerWaalsContact CZ-OD2 3.23Å; R102-D107 IonicContact NE-OD1 3.98Å; R102-D107 PolarHBondContact NE-OD1 3.36Å; R102-D107 IonicContact NE-OD2 3.64Å; R102-D107 PolarHBondContact NE-OD2 3.5Å; R102-D107 IonicContact NH2-OD1 2.77Å; R102-D107 PolarHBondContact NH2-OD1 2.94Å; R102-D107 IonicContact NH2-OD2 3.68Å; R102-D107 PolarHBondContact NH2-OD2 3.2Å; I104-D107 PolarHBondContact O-N 3.42Å; D107-V109 VanDerWaalsContact C-N 3.32Å; D107-V109 PolarHBondContact O-N 3.3Å; D107-T110 PolarHBondContact O-N 2.81Å; D107-A111 VanDerWaalsContact O-CB 3.28Å; D107-A111 WeakPolarHBondContact O-CB 3.32Å; D107-A111 PolarHBondContact O-N 2.84Å; D107-L166 HydrophobicContact CB-CD2 4.04Å; D107-P167 WeakPolarHBondContact OD2-CD 3.25Å; D107-P167 VanDerWaalsContact OD2-CG 3.32Å; D107-P167 WeakPolarHBondContact OD2-CG 3.15Å; D107-I170 HydrophobicContact CB-CD1 3.74Å
108	L	98.3	Very high	91.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-46.9	177.3	179.2	59.3	0	0	0	111	L80 L82 I104 A111 L112 F131 V148 I162 V172	L80-L108 HydrophobicContact CD1-CD1 4.49Å; L82-L108 HydrophobicContact CD1-CD2 3.72Å; L82-L108 HydrophobicContact CD2-CD1 3.88Å; L82-L108 HydrophobicContact CD2-CD2 4.09Å; I104-L108 WeakPolarHBondContact O-CB 3.43Å; I104-L108 PolarHBondContact O-N 3.22Å; L108-A111 PolarHBondContact O-N 3.05Å; L108-L112 HydrophobicContact CD1-CD1 4.15Å; L108-L112 HydrophobicContact CD1-CG 4.26Å; L108-L112 HydrophobicContact CG-CD1 3.94Å; L108-L112 HydrophobicContact CG-CG 4.49Å; L108-L112 WeakPolarHBondContact O-CB 3.03Å; L108-L112 WeakPolarHBondContact O-CG 3.43Å; L108-L112 PolarHBondContact O-N 3.2Å; L108-F131 HydrophobicContact CD2-CE2 3.95Å; L108-F131 HydrophobicContact CD2-CZ 4.01Å; L108-V148 HydrophobicContact CD2-CG2 4.22Å; L108-I162 HydrophobicContact CD1-CG2 4.5Å; L108-V172 HydrophobicContact CD1-CG2 4.26Å
109	V	97.3	Very high	92.8	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-69.3	-41.5	-179.1	169.5	0	0	0	0	111.3	R94 E105 D106 D107 A111 L112 V113 I118 G123 M126 M129	R94-V109 VanDerWaalsContact NH2-CG1 3.27Å; E105-V109 VanDerWaalsContact O-CB 3.25Å; E105-V109 WeakPolarHBondContact O-CB 3.49Å; E105-V109 WeakPolarHBondContact O-CG2 3.19Å; E105-V109 PolarHBondContact O-N 3.38Å; D106-V109 PolarHBondContact O-N 3.39Å; D107-V109 VanDerWaalsContact C-N 3.32Å; D107-V109 PolarHBondContact O-N 3.3Å; V109-A111 VanDerWaalsContact C-N 3.29Å; V109-A111 PolarHBondContact O-N 2.92Å; V109-L112 PolarHBondContact O-N 2.85Å; V109-V113 WeakPolarHBondContact O-CG2 3.32Å; V109-V113 PolarHBondContact O-N 3.28Å; V109-I118 HydrophobicContact CG1-CD1 4.37Å; V109-G123 VanDerWaalsContact CG1-CA 3.42Å; V109-M126 HydrophobicContact CG2-CE 3.61Å; V109-M126 HydrophobicContact CG2-CG 4.19Å; V109-M126 HydrophobicContact CG2-SD 3.9Å; V109-M129 HydrophobicContact CG2-CE 3.89Å
110	T	97.1	Very high	94.3	Very high	62 Å²	62	39.1 Å²	39.1	38%	0.38	21%	0.209	S	C	.	.	H	α-helix	trans	-58.8	-42.8	174.1	-66.5	0	0	0	0	111.2	D106 D107 V113 K114	D106-T110 WeakPolarHBondContact O-CB 3.45Å; D106-T110 PolarHBondContact O-N 3.23Å; D106-T110 PolarHBondContact O-OG1 2.89Å; D106-T110 VanDerWaalsContact O-OG1 3.08Å; D107-T110 PolarHBondContact O-N 2.81Å; T110-V113 PolarHBondContact O-N 3.19Å; T110-K114 HydrophobicContact CG2-CD 4.11Å; T110-K114 HydrophobicContact CG2-CG 4.48Å; T110-K114 WeakPolarHBondContact O-CB 3.31Å; T110-K114 WeakPolarHBondContact O-CG 3.43Å; T110-K114 PolarHBondContact O-N 2.74Å
111	A	98.4	Very high	95.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-38.8	176.2	0	0	0	0	0	112.9	D107 L108 V109 V113 K114 S115 I162 N165 L166	D107-A111 VanDerWaalsContact O-CB 3.28Å; D107-A111 WeakPolarHBondContact O-CB 3.32Å; D107-A111 PolarHBondContact O-N 2.84Å; L108-A111 PolarHBondContact O-N 3.05Å; V109-A111 VanDerWaalsContact C-N 3.29Å; V109-A111 PolarHBondContact O-N 2.92Å; A111-V113 PolarHBondContact O-N 3.42Å; A111-K114 PolarHBondContact O-N 3.16Å; A111-S115 VanDerWaalsContact O-CB 3.3Å; A111-S115 WeakPolarHBondContact O-CB 3.45Å; A111-S115 PolarHBondContact O-N 2.98Å; A111-S115 PolarHBondContact O-OG 3.46Å; A111-I162 HydrophobicContact CB-CG2 4.13Å; A111-N165 HydrophobicContact CB-CB 3.73Å; A111-L166 HydrophobicContact CB-CD2 3.69Å; A111-L166 HydrophobicContact CB-CG 3.73Å
112	L	98.1	Very high	95.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-37	175.8	-73.3	166.4	0	0	0	112.4	L108 V109 S115 C117 I118 L150 L152 I162	L108-L112 HydrophobicContact CD1-CD1 4.15Å; L108-L112 HydrophobicContact CD1-CG 4.26Å; L108-L112 HydrophobicContact CG-CD1 3.94Å; L108-L112 HydrophobicContact CG-CG 4.49Å; L108-L112 WeakPolarHBondContact O-CB 3.03Å; L108-L112 WeakPolarHBondContact O-CG 3.43Å; L108-L112 PolarHBondContact O-N 3.2Å; V109-L112 PolarHBondContact O-N 2.85Å; L112-S115 WeakPolarHBondContact CA-OG 3.44Å; L112-S115 PolarHBondContact O-OG 3Å; L112-C117 HydrophobicContact CB-CB 4.49Å; L112-C117 HydrophobicContact CD2-CB 3.87Å; L112-C117 WeakPolarHBondContact O-CB 3.44Å; L112-C117 PolarHBondContact O-N 2.64Å; L112-I118 HydrophobicContact CB-CD1 3.72Å; L112-I118 HydrophobicContact CB-CG1 3.84Å; L112-I118 HydrophobicContact CD1-CD1 4.43Å; L112-I118 PolarHBondContact O-N 3.3Å; L112-L150 HydrophobicContact CD1-CD1 3.56Å; L112-L150 HydrophobicContact CD2-CD1 4.4Å; L112-L152 HydrophobicContact CD2-CD2 4.13Å; L112-I162 HydrophobicContact CD2-CD1 3.65Å; L112-I162 HydrophobicContact CD2-CG1 4.08Å
113	V	97.2	Very high	95.9	Very high	51 Å²	51	25.5 Å²	25.5	31%	0.309	16%	0.156	S	C	.	.	H	α-helix	trans	-69.6	-50.1	174.9	173.1	0	0	0	0	110.3	V109 T110 A111 S115 G116 I118	V109-V113 WeakPolarHBondContact O-CG2 3.32Å; V109-V113 PolarHBondContact O-N 3.28Å; T110-V113 PolarHBondContact O-N 3.19Å; A111-V113 PolarHBondContact O-N 3.42Å; V113-S115 VanDerWaalsContact C-N 3.32Å; V113-S115 PolarHBondContact O-N 2.86Å; V113-G116 PolarHBondContact O-N 3.05Å; V113-I118 HydrophobicContact CG2-CD1 3.95Å; V113-I118 HydrophobicContact CG2-CG1 3.75Å
114	K	97.7	Very high	95.6	Very high	143 Å²	143	32.2 Å²	32.2	62%	0.622	19%	0.191	S	C	*	.	H	α-helix	trans	-62.4	-35.4	-178.3	-74.6	-177	176.5	-174.7	0	113.6	T110 A111 G116 N165	T110-K114 HydrophobicContact CG2-CD 4.11Å; T110-K114 HydrophobicContact CG2-CG 4.48Å; T110-K114 WeakPolarHBondContact O-CB 3.31Å; T110-K114 WeakPolarHBondContact O-CG 3.43Å; T110-K114 PolarHBondContact O-N 2.74Å; A111-K114 PolarHBondContact O-N 3.16Å; K114-G116 PolarHBondContact O-N 3.16Å; K114-N165 HydrophobicContact CB-CB 4.31Å; K114-N165 WeakPolarHBondContact CB-OD1 3.15Å; K114-N165 HydrophobicContact CD-CB 4.49Å; K114-N165 WeakPolarHBondContact CD-OD1 3.45Å
115	S	96.9	Very high	95.4	Very high	17 Å²	17	33.8 Å²	33.8	12%	0.119	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-5.4	175.7	56.4	0	0	0	0	113.8	A111 L112 V113 C117 I155	A111-S115 VanDerWaalsContact O-CB 3.3Å; A111-S115 WeakPolarHBondContact O-CB 3.45Å; A111-S115 PolarHBondContact O-N 2.98Å; A111-S115 PolarHBondContact O-OG 3.46Å; L112-S115 WeakPolarHBondContact CA-OG 3.44Å; L112-S115 PolarHBondContact O-OG 3Å; V113-S115 VanDerWaalsContact C-N 3.32Å; V113-S115 PolarHBondContact O-N 2.86Å; S115-C117 VanDerWaalsContact C-N 3.26Å; S115-C117 PolarHBondContact O-N 2.6Å; S115-C117 PolarHBondContact OG-SG 2.91Å; S115-I155 WeakPolarHBondContact O-CD1 3.32Å
116	G	95.2	Very high	95.2	Very high	36 Å²	36	34.9 Å²	34.9	37%	0.371	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	12.5	-177.4	0	0	0	0	0	114.4	V113 K114 I118	V113-G116 PolarHBondContact O-N 3.05Å; K114-G116 PolarHBondContact O-N 3.16Å; G116-I118 VanDerWaalsContact C-N 3.35Å
117	C	95.6	Very high	95.2	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.007	23%	0.23	C	C	.	.	S	Bend	trans	-70.8	-31.4	177	-68.2	0	0	0	0	112.2	L112 S115 L152 R153	L112-C117 HydrophobicContact CB-CB 4.49Å; L112-C117 HydrophobicContact CD2-CB 3.87Å; L112-C117 WeakPolarHBondContact O-CB 3.44Å; L112-C117 PolarHBondContact O-N 2.64Å; S115-C117 VanDerWaalsContact C-N 3.26Å; S115-C117 PolarHBondContact O-N 2.6Å; S115-C117 PolarHBondContact OG-SG 2.91Å; C117-L152 HydrophobicContact CB-CB 4.33Å; C117-L152 WeakPolarHBondContact O-CB 3.42Å; C117-R153 PolarHBondContact O-N 2.88Å
118	I	95.8	Very high	95	Very high	6 Å²	6	47 Å²	47	3%	0.031	25%	0.25	C	S	.	.	S	Bend	trans	-136.4	149	175.6	68.3	179.7	0	0	0	110.6	V109 L112 V113 G116 H122 M129 L152	V109-I118 HydrophobicContact CG1-CD1 4.37Å; L112-I118 HydrophobicContact CB-CD1 3.72Å; L112-I118 HydrophobicContact CB-CG1 3.84Å; L112-I118 HydrophobicContact CD1-CD1 4.43Å; L112-I118 PolarHBondContact O-N 3.3Å; V113-I118 HydrophobicContact CG2-CD1 3.95Å; V113-I118 HydrophobicContact CG2-CG1 3.75Å; G116-I118 VanDerWaalsContact C-N 3.35Å; I118-H122 HydrophobicContact CB-CB 4.22Å; I118-H122 HydrophobicContact CD1-CB 4.45Å; I118-M129 HydrophobicContact CD1-CE 4.04Å; I118-M129 HydrophobicContact CD1-SD 3.73Å; I118-M129 HydrophobicContact CG2-SD 4.11Å; I118-L152 HydrophobicContact CG2-CB 4Å
119	P	93.8	Very high	94.9	Very high	49 Å²	49	47 Å²	47	32%	0.318	25%	0.25	S	S	.	.			trans	-71.6	155.9	172.2	31.3	-36.2	0	0	0	111.4	N121 H122 G123	P119-N121 VanDerWaalsContact C-N 3.29Å; P119-N121 WeakPolarHBondContact CB-OD1 3.43Å; P119-N121 VanDerWaalsContact CG-OD1 3.22Å; P119-N121 WeakPolarHBondContact CG-OD1 3.47Å; P119-N121 PolarHBondContact O-N 3.01Å; P119-H122 HydrophobicContact CG-CB 4.09Å; P119-H122 VanDerWaalsContact CG-CD2 3.43Å; P119-H122 WeakPolarHBondContact CG-CD2 3.46Å; P119-H122 WeakPolarHBondContact O-CB 3.39Å; P119-H122 PolarHBondContact O-N 3.12Å; P119-G123 PolarHBondContact O-N 3.11Å
120	G	91.9	Very high	94.8	Very high	37 Å²	37	48.7 Å²	48.7	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-54.6	-41.9	-177.3	0	0	0	0	0	113.7	H122 G123 D124	G120-H122 PolarHBondContact O-N 3.41Å; G120-H122 VanDerWaalsContact O-N 3.12Å; G120-G123 WeakPolarHBondContact O-CA 3.28Å; G120-G123 PolarHBondContact O-N 3.44Å; G120-D124 PolarHBondContact O-N 3.33Å; G120-D124 VanDerWaalsContact O-N 3.07Å
121	N	91.9	Very high	94.9	Very high	61 Å²	61	46 Å²	46	33%	0.326	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-19.1	178.8	71.5	-24.2	0	0	0	114.6	P119 D125 K128	P119-N121 VanDerWaalsContact C-N 3.29Å; P119-N121 WeakPolarHBondContact CB-OD1 3.43Å; P119-N121 VanDerWaalsContact CG-OD1 3.22Å; P119-N121 WeakPolarHBondContact CG-OD1 3.47Å; P119-N121 PolarHBondContact O-N 3.01Å; N121-D125 PolarHBondContact O-N 3.39Å; N121-K128 WeakPolarHBondContact O-CD 3.38Å; N121-K128 PolarHBondContact O-NZ 3.08Å
122	H	92.6	Very high	94.9	Very high	13 Å²	13	48.5 Å²	48.5	6%	0.06	26%	0.257	C	S	.	.	H	α-helix	trans	-83.5	-26.1	170	-76	-148.4	0	0	0	112	K75 I118 P119 G120 D125 M126 M129	K75-H122 PolarHBondContact NZ-CE1 3.28Å; K75-H122 PolarHBondContact NZ-NE2 3.33Å; K75-H122 VanDerWaalsContact NZ-NE2 3.14Å; I118-H122 HydrophobicContact CB-CB 4.22Å; I118-H122 HydrophobicContact CD1-CB 4.45Å; P119-H122 HydrophobicContact CG-CB 4.09Å; P119-H122 VanDerWaalsContact CG-CD2 3.43Å; P119-H122 WeakPolarHBondContact CG-CD2 3.46Å; P119-H122 WeakPolarHBondContact O-CB 3.39Å; P119-H122 PolarHBondContact O-N 3.12Å; G120-H122 PolarHBondContact O-N 3.41Å; G120-H122 VanDerWaalsContact O-N 3.12Å; H122-D125 CarbonylContact O-C 3.55Å; H122-D125 VanDerWaalsContact O-O 3.11Å; H122-M126 WeakPolarHBondContact O-CA 3.3Å; H122-M126 PolarHBondContact O-N 2.72Å; H122-M129 HydrophobicContact CB-CB 4.39Å
123	G	91.1	Very high	94.9	Very high	5 Å²	5	49.8 Å²	49.8	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-70.5	-36.5	171.6	0	0	0	0	0	112.2	R94 V109 P119 G120	R94-G123 PolarHBondContact NH1-O 3.03Å; V109-G123 VanDerWaalsContact CG1-CA 3.42Å; P119-G123 PolarHBondContact O-N 3.11Å; G120-G123 WeakPolarHBondContact O-CA 3.28Å; G120-G123 PolarHBondContact O-N 3.44Å
124	D	90.7	Very high	94.9	Very high	141 Å²	141	47.7 Å²	47.7	75%	0.754	25%	0.249	S	C	*	.	H	α-helix	trans	-69.7	-40.8	174.4	-56.1	-35.9	0	0	0	111.7	G120	G120-D124 PolarHBondContact O-N 3.33Å; G120-D124 VanDerWaalsContact O-N 3.07Å
125	D	92.9	Very high	94.8	Very high	35 Å²	35	41.1 Å²	41.1	19%	0.187	22%	0.222	C	C	.	.			trans	-125.9	92.3	176.2	-173.8	-0.7	0	0	0	111.7	N121 H122 R127 K128	N121-D125 PolarHBondContact O-N 3.39Å; H122-D125 CarbonylContact O-C 3.55Å; H122-D125 VanDerWaalsContact O-O 3.11Å; D125-R127 PolarHBondContact O-N 2.89Å; D125-R127 WeakPolarHBondContact OD1-CB 3.16Å; D125-R127 WeakPolarHBondContact OD1-CG 3.49Å; D125-R127 IonicContact OD1-CZ 3.51Å; D125-R127 PolarHBondContact OD1-N 2.87Å; D125-R127 IonicContact OD1-NE 2.66Å; D125-R127 PolarHBondContact OD1-NE 2.71Å; D125-R127 IonicContact OD1-NH2 3.27Å; D125-R127 IonicContact OD2-CZ 3.22Å; D125-R127 IonicContact OD2-NE 2.71Å; D125-R127 PolarHBondContact OD2-NE 3.26Å; D125-R127 IonicContact OD2-NH2 2.87Å; D125-R127 PolarHBondContact OD2-NH2 2.81Å; D125-K128 HydrophobicContact CB-CD 4.14Å; D125-K128 HydrophobicContact CB-CG 4.19Å; D125-K128 WeakPolarHBondContact O-CB 3.18Å; D125-K128 PolarHBondContact O-N 3.37Å
126	M	94.4	Very high	94.7	Very high	24 Å²	24	47.2 Å²	47.2	12%	0.118	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-15.4	-179.2	-60.2	175.9	68.1	0	0	113.6	R94 E105 V109 H122 K128 M129 S130 F131	R94-M126 HydrophobicContact CG-SD 4.41Å; E105-M126 HydrophobicContact CB-CE 4.34Å; E105-M126 HydrophobicContact CG-CE 4.23Å; V109-M126 HydrophobicContact CG2-CE 3.61Å; V109-M126 HydrophobicContact CG2-CG 4.19Å; V109-M126 HydrophobicContact CG2-SD 3.9Å; H122-M126 WeakPolarHBondContact O-CA 3.3Å; H122-M126 PolarHBondContact O-N 2.72Å; M126-K128 VanDerWaalsContact C-N 3.26Å; M126-K128 PolarHBondContact O-N 3.36Å; M126-M129 HydrophobicContact CB-CE 3.75Å; M126-M129 HydrophobicContact CE-CE 3.91Å; M126-M129 HydrophobicContact CG-CE 3.61Å; M126-M129 VanDerWaalsContact O-CG 3.23Å; M126-M129 WeakPolarHBondContact O-CG 3.47Å; M126-M129 PolarHBondContact O-N 2.87Å; M126-S130 PolarHBondContact O-N 3.26Å; M126-F131 HydrophobicContact CB-CB 4.02Å; M126-F131 HydrophobicContact CE-CB 4Å; M126-F131 HydrophobicContact CE-CD1 3.29Å; M126-F131 HydrophobicContact CE-CD2 3.64Å; M126-F131 HydrophobicContact CE-CE1 3.5Å; M126-F131 VanDerWaalsContact CE-CE1 3.5Å; M126-F131 HydrophobicContact CE-CE2 3.82Å; M126-F131 HydrophobicContact CE-CG 3.36Å; M126-F131 HydrophobicContact CE-CZ 3.75Å; M126-F131 WeakPolarHBondContact O-CB 3.43Å; M126-F131 PolarHBondContact O-N 3.3Å
127	R	94.1	Very high	94.6	Very high	199 Å²	199	45.9 Å²	45.9	75%	0.751	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-31.8	174	-59.5	172.2	-65.9	-176.4	3	111.3	D125 M129 S130	D125-R127 PolarHBondContact O-N 2.89Å; D125-R127 WeakPolarHBondContact OD1-CB 3.16Å; D125-R127 WeakPolarHBondContact OD1-CG 3.49Å; D125-R127 IonicContact OD1-CZ 3.51Å; D125-R127 PolarHBondContact OD1-N 2.87Å; D125-R127 IonicContact OD1-NE 2.66Å; D125-R127 PolarHBondContact OD1-NE 2.71Å; D125-R127 IonicContact OD1-NH2 3.27Å; D125-R127 IonicContact OD2-CZ 3.22Å; D125-R127 IonicContact OD2-NE 2.71Å; D125-R127 PolarHBondContact OD2-NE 3.26Å; D125-R127 IonicContact OD2-NH2 2.87Å; D125-R127 PolarHBondContact OD2-NH2 2.81Å; R127-M129 VanDerWaalsContact C-N 3.27Å; R127-M129 PolarHBondContact O-N 2.84Å; R127-S130 WeakPolarHBondContact O-CA 3.43Å; R127-S130 PolarHBondContact O-N 3.38Å
128	K	94.7	Very high	94.4	Very high	103 Å²	103	47.6 Å²	47.6	45%	0.448	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-28.3	179.5	-63.1	179	-173.8	165.6	0	113.1	N121 D125 M126	N121-K128 WeakPolarHBondContact O-CD 3.38Å; N121-K128 PolarHBondContact O-NZ 3.08Å; D125-K128 HydrophobicContact CB-CD 4.14Å; D125-K128 HydrophobicContact CB-CG 4.19Å; D125-K128 WeakPolarHBondContact O-CB 3.18Å; D125-K128 PolarHBondContact O-N 3.37Å; M126-K128 VanDerWaalsContact C-N 3.26Å; M126-K128 PolarHBondContact O-N 3.36Å
129	M	95	Very high	94.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	10.6	170.6	58.5	165.5	171.1	0	0	113.5	V109 I118 H122 M126 R127 F131 L150 K151	V109-M129 HydrophobicContact CG2-CE 3.89Å; I118-M129 HydrophobicContact CD1-CE 4.04Å; I118-M129 HydrophobicContact CD1-SD 3.73Å; I118-M129 HydrophobicContact CG2-SD 4.11Å; H122-M129 HydrophobicContact CB-CB 4.39Å; M126-M129 HydrophobicContact CB-CE 3.75Å; M126-M129 HydrophobicContact CE-CE 3.91Å; M126-M129 HydrophobicContact CG-CE 3.61Å; M126-M129 VanDerWaalsContact O-CG 3.23Å; M126-M129 WeakPolarHBondContact O-CG 3.47Å; M126-M129 PolarHBondContact O-N 2.87Å; R127-M129 VanDerWaalsContact C-N 3.27Å; R127-M129 PolarHBondContact O-N 2.84Å; M129-F131 HydrophobicContact CE-CB 3.9Å; M129-F131 HydrophobicContact CE-CD2 3.61Å; M129-F131 HydrophobicContact CE-CE2 4.47Å; M129-F131 HydrophobicContact CE-CG 4.05Å; M129-F131 HydrophobicContact CG-CB 4.07Å; M129-F131 PolarHBondContact O-N 2.86Å; M129-F131 HydrophobicContact SD-CB 4.32Å; M129-F131 HydrophobicContact SD-CD2 4.13Å; M129-L150 CarbonylContact O-C 3.58Å; M129-L150 WeakPolarHBondContact O-CA 3.4Å; M129-L150 HydrophobicContact SD-CB 4.28Å; M129-L150 HydrophobicContact SD-CD1 3.74Å; M129-K151 WeakPolarHBondContact CB-O 3.14Å; M129-K151 PolarHBondContact O-N 2.96Å
130	S	96.6	Very high	94.1	Very high	39 Å²	39	51.9 Å²	51.9	27%	0.273	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	41	-178.4	-48.6	0	0	0	0	112.8	K77 M126 R127	K77-S130 PolarHBondContact NZ-O 2.89Å; M126-S130 PolarHBondContact O-N 3.26Å; R127-S130 WeakPolarHBondContact O-CA 3.43Å; R127-S130 PolarHBondContact O-N 3.38Å
131	F	97.9	Very high	94.3	Very high	5 Å²	5	50.3 Å²	50.3	2%	0.022	24%	0.238	C	C	.	.			trans	-69.4	131.4	-176.7	-171.3	-80.7	0	0	0	111.4	M92 E105 L108 M126 M129 R133 V148 S149 L150	M92-F131 HydrophobicContact CE-CZ 4.36Å; E105-F131 HydrophobicContact CG-CE1 3.96Å; E105-F131 HydrophobicContact CG-CZ 3.97Å; E105-F131 WeakPolarHBondContact OE1-CE1 3.43Å; L108-F131 HydrophobicContact CD2-CE2 3.95Å; L108-F131 HydrophobicContact CD2-CZ 4.01Å; M126-F131 HydrophobicContact CB-CB 4.02Å; M126-F131 HydrophobicContact CE-CB 4Å; M126-F131 HydrophobicContact CE-CD1 3.29Å; M126-F131 HydrophobicContact CE-CD2 3.64Å; M126-F131 HydrophobicContact CE-CE1 3.5Å; M126-F131 VanDerWaalsContact CE-CE1 3.5Å; M126-F131 HydrophobicContact CE-CE2 3.82Å; M126-F131 HydrophobicContact CE-CG 3.36Å; M126-F131 HydrophobicContact CE-CZ 3.75Å; M126-F131 WeakPolarHBondContact O-CB 3.43Å; M126-F131 PolarHBondContact O-N 3.3Å; M129-F131 HydrophobicContact CE-CB 3.9Å; M129-F131 HydrophobicContact CE-CD2 3.61Å; M129-F131 HydrophobicContact CE-CE2 4.47Å; M129-F131 HydrophobicContact CE-CG 4.05Å; M129-F131 HydrophobicContact CG-CB 4.07Å; M129-F131 PolarHBondContact O-N 2.86Å; M129-F131 HydrophobicContact SD-CB 4.32Å; M129-F131 HydrophobicContact SD-CD2 4.13Å; F131-R133 HydrophobicContact CE1-CB 4.42Å; F131-V148 HydrophobicContact CE1-CB 4.48Å; F131-V148 HydrophobicContact CE1-CG1 4.17Å; F131-V148 HydrophobicContact CE2-CB 4.24Å; F131-V148 HydrophobicContact CE2-CG1 4.44Å; F131-V148 HydrophobicContact CE2-CG2 4.33Å; F131-V148 HydrophobicContact CZ-CB 3.94Å; F131-V148 HydrophobicContact CZ-CG1 3.7Å; F131-V148 HydrophobicContact CZ-CG2 4.39Å; F131-S149 CarbonylContact C-O 3.15Å; F131-S149 VanDerWaalsContact CA-O 3.31Å; F131-S149 WeakPolarHBondContact CA-O 3.3Å; F131-L150 HydrophobicContact CB-CB 4.45Å; F131-L150 HydrophobicContact CD2-CB 3.95Å; F131-L150 HydrophobicContact CD2-CD1 4.09Å; F131-L150 HydrophobicContact CD2-CG 4.49Å; F131-L150 HydrophobicContact CE2-CD1 4.45Å
132	Q	98.1	Very high	94.6	Very high	53 Å²	53	47.6 Å²	47.6	25%	0.248	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.7	176.1	-59.9	-70.6	-57.3	0	0	109.5	V148 S149 N183 S184	Q132-V148 CarbonylContact O-C 3.59Å; Q132-V148 WeakPolarHBondContact O-CA 3.45Å; Q132-V148 VanDerWaalsContact O-CB 3.31Å; Q132-V148 WeakPolarHBondContact O-CB 3.22Å; Q132-S149 PolarHBondContact N-O 2.73Å; Q132-S149 PolarHBondContact O-N 3.22Å; Q132-N183 WeakPolarHBondContact CG-ND2 3.4Å; Q132-N183 PolarHBondContact OE1-ND2 3.2Å; Q132-S184 PolarHBondContact O-OG 2.78Å
133	R	97.9	Very high	94.9	Very high	28 Å²	28	47 Å²	47	11%	0.106	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.5	178.6	72.7	-67.4	-64.9	164.9	-7.9	110.4	M92 E105 F131 R136 V148 K185	M92-R133 HydrophobicContact CE-CB 4.13Å; M92-R133 HydrophobicContact CG-CG 4.43Å; E105-R133 IonicContact OE1-CZ 3.73Å; E105-R133 IonicContact OE1-NE 3.59Å; E105-R133 PolarHBondContact OE1-NE 3.46Å; E105-R133 IonicContact OE1-NH2 2.73Å; E105-R133 PolarHBondContact OE1-NH2 2.74Å; E105-R133 IonicContact OE2-CZ 3.89Å; E105-R133 IonicContact OE2-NH2 3.56Å; E105-R133 PolarHBondContact OE2-NH2 3.45Å; F131-R133 HydrophobicContact CE1-CB 4.42Å; R133-R136 HydrophobicContact CG-CG 4.18Å; R133-V148 HydrophobicContact CB-CG1 3.95Å; R133-K185 WeakPolarHBondContact O-CB 3.22Å
134	C	97.2	Very high	95.2	Very high	6 Å²	6	46.7 Å²	46.7	4%	0.041	22%	0.219	C	C	.	.	S	Bend	trans	-74.6	-38.3	-179	-71.6	0	0	0	0	113.3	V147 S184 R191 V331	C134-V147 HydrophobicContact CB-CB 4.3Å; C134-V147 WeakPolarHBondContact CB-O 3.35Å; C134-V147 PolarHBondContact N-O 2.71Å; C134-V147 PolarHBondContact SG-O 2.91Å; C134-S184 WeakPolarHBondContact SG-CB 3.41Å; C134-S184 PolarHBondContact SG-O 2.78Å; C134-R191 PolarHBondContact O-NH2 3.48Å; C134-V331 HydrophobicContact CB-CB 4.46Å; C134-V331 HydrophobicContact CB-CG1 3.73Å; C134-V331 HydrophobicContact CB-CG2 3.85Å
135	A	96.3	Very high	95.6	Very high	5 Å²	5	40.1 Å²	40.1	4%	0.041	18%	0.184	C	C	.	.			trans	-128.9	138.7	179.9	0	0	0	0	0	110.6	Q146 L328	A135-Q146 PolarHBondContact O-NE2 2.83Å; A135-L328 HydrophobicContact CB-CD2 3.52Å
136	R	94.9	Very high	95.9	Very high	145 Å²	145	38.5 Å²	38.5	55%	0.547	18%	0.175	S	C	.	.			trans	-100.5	92.3	168.2	-67.7	173.8	173.8	177.6	-9	106.4	Q93 R133	Q93-R136 VanDerWaalsContact OE1-CD 3.27Å; R133-R136 HydrophobicContact CG-CG 4.18Å
137	T	94.3	Very high	96.1	Very high	9 Å²	9	37.4 Å²	37.4	6%	0.055	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-73.3	140.3	177.1	49.8	0	0	0	0	109.7	Y84 G91 M92 V141 L328	Y84-T137 VanDerWaalsContact OH-CG2 3.28Å; Y84-T137 WeakPolarHBondContact OH-CG2 3.25Å; Y84-T137 PolarHBondContact OH-OG1 3.1Å; G91-T137 VanDerWaalsContact CA-O 3.23Å; G91-T137 WeakPolarHBondContact CA-O 3.38Å; M92-T137 WeakPolarHBondContact CB-OG1 3.33Å; M92-T137 PolarHBondContact N-O 3.01Å; M92-T137 VanDerWaalsContact N-O 3.13Å; M92-T137 PolarHBondContact N-OG1 3.32Å; T137-V141 HydrophobicContact CG2-CG1 3.8Å; T137-L328 HydrophobicContact CG2-CB 4.48Å
138	D	90.6	Very high	96.3	Very high	37 Å²	37	27.9 Å²	27.9	20%	0.198	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-72.2	172.1	179	-64.2	-22.3	0	0	0	111.5	G91 G140 V141 L284 H285 R288	G91-D138 WeakPolarHBondContact CA-O 3.45Å; D138-G140 PolarHBondContact O-N 2.81Å; D138-V141 HydrophobicContact CB-CG2 3.87Å; D138-V141 WeakPolarHBondContact O-CB 3.31Å; D138-V141 PolarHBondContact O-N 3.11Å; D138-V141 VanDerWaalsContact O-N 3.1Å; D138-L284 WeakPolarHBondContact OD1-CD1 3.5Å; D138-H285 IonicContact OD2-CD2 2.74Å; D138-H285 PolarHBondContact OD2-CD2 2.63Å; D138-R288 IonicContact OD2-NH1 2.75Å
139	K	91.3	Very high	96.5	Very high	124 Å²	124	23 Å²	23	54%	0.539	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.3	129.1	171.9	177.6	178.7	178.1	175.4	0	111.3	Y90 V141	Y90-K139 HydrophobicContact CD1-CD 3.79Å; Y90-K139 HydrophobicContact CD1-CG 4.33Å; Y90-K139 HydrophobicContact CE1-CD 3.73Å; Y90-K139 HydrophobicContact CG-CD 4.41Å; Y90-K139 PolarHBondContact OH-NZ 3.18Å; Y90-K139 VanDerWaalsContact OH-NZ 3.16Å; K139-V141 PolarHBondContact O-N 3.04Å
140	G	91.1	Very high	96.6	Very high	21 Å²	21	23 Å²	23	22%	0.216	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	-10.6	178	0	0	0	0	0	115.9	G86 Y89 D138	G86-G140 WeakPolarHBondContact O-CA 3.39Å; Y89-G140 PolarHBondContact O-N 3.34Å; D138-G140 PolarHBondContact O-N 2.81Å
141	V	96.4	Very high	96.7	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.018	11%	0.113	C	C	.	.			trans	-76.2	133.5	-177.8	174.7	0	0	0	0	110.1	G86 T137 D138 K139 L326	G86-V141 WeakPolarHBondContact CA-O 3.17Å; T137-V141 HydrophobicContact CG2-CG1 3.8Å; D138-V141 HydrophobicContact CB-CG2 3.87Å; D138-V141 WeakPolarHBondContact O-CB 3.31Å; D138-V141 PolarHBondContact O-N 3.11Å; D138-V141 VanDerWaalsContact O-N 3.1Å; K139-V141 PolarHBondContact O-N 3.04Å; V141-L326 HydrophobicContact CG1-CB 4.11Å; V141-L326 HydrophobicContact CG1-CD2 3.94Å; V141-L326 HydrophobicContact CG1-CG 3.96Å; V141-L326 WeakPolarHBondContact CG1-O 3.49Å; V141-L326 HydrophobicContact CG2-CB 4.26Å; V141-L326 HydrophobicContact CG2-CD2 4.03Å
142	S	98.4	Very high	96.5	Very high	4 Å²	4	24 Å²	24	3%	0.028	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	168.3	-179	-60	0	0	0	0	111.9	Y84 G86 L326 V327 L328	Y84-S142 WeakPolarHBondContact O-CB 3.23Å; G86-S142 PolarHBondContact N-OG 2.76Å; S142-L326 PolarHBondContact N-O 3.11Å; S142-V327 WeakPolarHBondContact O-CA 3.43Å; S142-L328 PolarHBondContact O-N 2.85Å
143	A	98.6	Very high	96.4	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	135.1	171.3	0	0	0	0	0	111.2	A83 Y84 Q146 L328 I366	A83-A143 CarbonylContact C-O 3.58Å; A83-A143 WeakPolarHBondContact CA-O 3.5Å; Y84-A143 HydrophobicContact CD1-CB 4.13Å; Y84-A143 HydrophobicContact CD2-CB 4.34Å; Y84-A143 HydrophobicContact CE1-CB 3.54Å; Y84-A143 HydrophobicContact CE2-CB 3.78Å; Y84-A143 HydrophobicContact CG-CB 4.49Å; Y84-A143 PolarHBondContact N-O 2.83Å; Y84-A143 PolarHBondContact O-N 3.41Å; Y84-A143 WeakPolarHBondContact OH-CB 3.4Å; A143-Q146 HydrophobicContact CB-CB 3.85Å; A143-L328 CarbonylContact C-O 3.54Å; A143-L328 WeakPolarHBondContact CA-O 3.06Å; A143-L328 HydrophobicContact CB-CB 3.81Å; A143-L328 HydrophobicContact CB-CD2 4.27Å; A143-L328 HydrophobicContact CB-CG 4.44Å; A143-I366 WeakPolarHBondContact O-CD1 3.28Å
144	A	98.5	Very high	96.1	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-27.4	170.4	0	0	0	0	0	111.8	V327 L328 I358 K362 I366	A144-V327 HydrophobicContact CB-CG1 4.23Å; A144-L328 PolarHBondContact N-O 3.24Å; A144-I358 HydrophobicContact CB-CG2 3.88Å; A144-K362 HydrophobicContact CB-CD 3.6Å; A144-K362 HydrophobicContact CB-CG 3.6Å; A144-I366 HydrophobicContact CB-CD1 4.31Å
145	G	98.1	Very high	96	Very high	3 Å²	3	28.7 Å²	28.7	3%	0.031	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	49.9	-177.2	0	0	0	0	0	113.5	L328 E329 V331	G145-L328 PolarHBondContact N-O 3.15Å; G145-E329 WeakPolarHBondContact CA-O 3.34Å; G145-E329 PolarHBondContact N-O 2.55Å; G145-V331 WeakPolarHBondContact O-CG2 3.43Å
146	Q	98.6	Very high	95.9	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	144.1	168.9	171.6	70.9	-83.1	0	0	109.6	L82 Y84 M92 A135 A143 V148 L328	L82-Q146 HydrophobicContact CB-CB 4.02Å; L82-Q146 HydrophobicContact CB-CG 4.24Å; L82-Q146 HydrophobicContact CD1-CG 4.21Å; L82-Q146 PolarHBondContact N-O 3.36Å; L82-Q146 WeakPolarHBondContact O-CB 3.37Å; L82-Q146 PolarHBondContact O-N 3.16Å; Y84-Q146 HydrophobicContact CE1-CB 3.67Å; Y84-Q146 HydrophobicContact CE1-CG 3.97Å; Y84-Q146 PolarHBondContact OH-NE2 3.12Å; M92-Q146 HydrophobicContact CE-CG 4.15Å; M92-Q146 HydrophobicContact SD-CG 4.29Å; A135-Q146 PolarHBondContact O-NE2 2.83Å; A143-Q146 HydrophobicContact CB-CB 3.85Å; Q146-V148 HydrophobicContact CG-CG1 4.48Å; Q146-L328 HydrophobicContact CB-CD2 4.14Å
147	V	98.6	Very high	95.9	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.1	178	177.8	0	0	0	0	110.5	V79 L80 L81 C134 V331 F333	V79-V147 HydrophobicContact CG1-CG1 3.19Å; L80-V147 WeakPolarHBondContact O-CA 3.31Å; L81-V147 HydrophobicContact CD1-CG2 4.23Å; C134-V147 HydrophobicContact CB-CB 4.3Å; C134-V147 WeakPolarHBondContact CB-O 3.35Å; C134-V147 PolarHBondContact N-O 2.71Å; C134-V147 PolarHBondContact SG-O 2.91Å; V147-V331 HydrophobicContact CB-CB 4.29Å; V147-V331 HydrophobicContact CB-CG1 4.34Å; V147-V331 HydrophobicContact CB-CG2 4.3Å; V147-V331 HydrophobicContact CG2-CB 3.94Å; V147-V331 HydrophobicContact CG2-CG1 4.42Å; V147-V331 HydrophobicContact CG2-CG2 4.17Å; V147-F333 HydrophobicContact CB-CE2 4.27Å; V147-F333 HydrophobicContact CB-CZ 4.32Å; V147-F333 HydrophobicContact CG1-CE2 3.9Å; V147-F333 HydrophobicContact CG1-CZ 3.81Å; V147-F333 HydrophobicContact CG2-CE2 4.22Å
148	V	98.6	Very high	96	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	153.4	173.1	-61.2	0	0	0	0	110.4	V79 L80 L82 M92 L108 F131 Q132 R133 Q146 L150	V79-V148 CarbonylContact C-O 3.51Å; V79-V148 VanDerWaalsContact CA-O 3.23Å; V79-V148 WeakPolarHBondContact CA-O 3.25Å; V79-V148 WeakPolarHBondContact CG1-O 3.36Å; L80-V148 HydrophobicContact CB-CG2 3.76Å; L80-V148 HydrophobicContact CD1-CG2 4.22Å; L80-V148 HydrophobicContact CG-CG2 4.21Å; L80-V148 PolarHBondContact N-O 3.1Å; L80-V148 PolarHBondContact O-N 3.12Å; L80-V148 VanDerWaalsContact O-N 3.08Å; L82-V148 HydrophobicContact CD1-CB 4.1Å; L82-V148 HydrophobicContact CD1-CG1 3.55Å; L82-V148 HydrophobicContact CD1-CG2 3.45Å; L82-V148 VanDerWaalsContact CD1-CG2 3.45Å; L82-V148 HydrophobicContact CG-CG2 4.46Å; M92-V148 HydrophobicContact CE-CG1 3.4Å; M92-V148 VanDerWaalsContact CE-CG1 3.4Å; L108-V148 HydrophobicContact CD2-CG2 4.22Å; F131-V148 HydrophobicContact CE1-CB 4.48Å; F131-V148 HydrophobicContact CE1-CG1 4.17Å; F131-V148 HydrophobicContact CE2-CB 4.24Å; F131-V148 HydrophobicContact CE2-CG1 4.44Å; F131-V148 HydrophobicContact CE2-CG2 4.33Å; F131-V148 HydrophobicContact CZ-CB 3.94Å; F131-V148 HydrophobicContact CZ-CG1 3.7Å; F131-V148 HydrophobicContact CZ-CG2 4.39Å; Q132-V148 CarbonylContact O-C 3.59Å; Q132-V148 WeakPolarHBondContact O-CA 3.45Å; Q132-V148 VanDerWaalsContact O-CB 3.31Å; Q132-V148 WeakPolarHBondContact O-CB 3.22Å; R133-V148 HydrophobicContact CB-CG1 3.95Å; Q146-V148 HydrophobicContact CG-CG1 4.48Å; V148-L150 HydrophobicContact CG2-CD2 4.15Å
149	S	98.5	Very high	96.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.5	171.2	57.5	0	0	0	0	110.9	V78 F131 Q132 S184	V78-S149 VanDerWaalsContact O-CA 3.22Å; V78-S149 WeakPolarHBondContact O-CA 3.23Å; V78-S149 WeakPolarHBondContact O-CB 3.42Å; F131-S149 CarbonylContact C-O 3.15Å; F131-S149 VanDerWaalsContact CA-O 3.31Å; F131-S149 WeakPolarHBondContact CA-O 3.3Å; Q132-S149 PolarHBondContact N-O 2.73Å; Q132-S149 PolarHBondContact O-N 3.22Å; S149-S184 PolarHBondContact N-OG 2.65Å; S149-S184 VanDerWaalsContact OG-CB 3.31Å; S149-S184 WeakPolarHBondContact OG-CB 3.42Å; S149-S184 PolarHBondContact OG-N 3.17Å; S149-S184 PolarHBondContact OG-OG 3.08Å; S149-S184 VanDerWaalsContact OG-OG 3.11Å
150	L	98.4	Very high	96.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	168.3	-175.1	67.3	166.1	0	0	0	110.8	V78 L80 L112 M129 F131 V148 L152	V78-L150 HydrophobicContact CG2-CD2 4.03Å; V78-L150 HydrophobicContact CG2-CG 4.4Å; V78-L150 PolarHBondContact N-O 3.04Å; V78-L150 PolarHBondContact O-N 2.85Å; V78-L150 VanDerWaalsContact O-N 3.08Å; L80-L150 HydrophobicContact CD1-CD2 3.83Å; L80-L150 HydrophobicContact CG-CD2 3.88Å; L112-L150 HydrophobicContact CD1-CD1 3.56Å; L112-L150 HydrophobicContact CD2-CD1 4.4Å; M129-L150 CarbonylContact O-C 3.58Å; M129-L150 WeakPolarHBondContact O-CA 3.4Å; M129-L150 HydrophobicContact SD-CB 4.28Å; M129-L150 HydrophobicContact SD-CD1 3.74Å; F131-L150 HydrophobicContact CB-CB 4.45Å; F131-L150 HydrophobicContact CD2-CB 3.95Å; F131-L150 HydrophobicContact CD2-CD1 4.09Å; F131-L150 HydrophobicContact CD2-CG 4.49Å; F131-L150 HydrophobicContact CE2-CD1 4.45Å; V148-L150 HydrophobicContact CG2-CD2 4.15Å; L150-L152 HydrophobicContact CD1-CD2 4.22Å; L150-L152 HydrophobicContact CG-CD2 4.27Å
151	K	97.4	Very high	97	Very high	65 Å²	65	35.9 Å²	35.9	28%	0.283	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.7	171.1	-66.6	-178.1	178	-179.4	0	109	K75 K76 K77 M129	K75-K151 HydrophobicContact CB-CB 4.48Å; K76-K151 WeakPolarHBondContact O-CA 3.36Å; K77-K151 HydrophobicContact CB-CG 4.43Å; K77-K151 HydrophobicContact CD-CG 3.75Å; M129-K151 WeakPolarHBondContact CB-O 3.14Å; M129-K151 PolarHBondContact O-N 2.96Å
152	L	95.4	Very high	97.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	166.4	178.1	56.3	69.6	0	0	0	111.8	K75 K76 V78 L112 C117 I118 L150 L154 I158	K75-L152 CarbonylContact C-O 3.48Å; K75-L152 WeakPolarHBondContact CA-O 3.33Å; K76-L152 PolarHBondContact N-O 3.49Å; K76-L152 PolarHBondContact O-N 2.9Å; V78-L152 HydrophobicContact CG1-CD1 4.14Å; V78-L152 HydrophobicContact CG1-CG 4.5Å; V78-L152 HydrophobicContact CG2-CD1 4.1Å; V78-L152 HydrophobicContact CG2-CD2 3.7Å; V78-L152 HydrophobicContact CG2-CG 3.66Å; L112-L152 HydrophobicContact CD2-CD2 4.13Å; C117-L152 HydrophobicContact CB-CB 4.33Å; C117-L152 WeakPolarHBondContact O-CB 3.42Å; I118-L152 HydrophobicContact CG2-CB 4Å; L150-L152 HydrophobicContact CD1-CD2 4.22Å; L150-L152 HydrophobicContact CG-CD2 4.27Å; L152-L154 HydrophobicContact CD1-CD2 3.64Å; L152-L154 HydrophobicContact CD1-CG 4.28Å; L152-I158 HydrophobicContact CD1-CD1 3.53Å; L152-I158 HydrophobicContact CD2-CD1 4.11Å; L152-I158 HydrophobicContact CG-CD1 4.46Å
153	R	94.4	Very high	97.2	Very high	74 Å²	74	36.9 Å²	36.9	28%	0.279	18%	0.176	S	C	.	.			trans	-79.7	122.5	169	-177	-179.3	-68.1	-178.6	-1.3	108.4	D69 F73 C117 I155	D69-R153 PolarHBondContact O-NH2 3.26Å; F73-R153 HydrophobicContact CB-CG 4.03Å; C117-R153 PolarHBondContact O-N 2.88Å; R153-I155 HydrophobicContact CG-CG2 4.1Å; R153-I155 PolarHBondContact O-N 3.27Å
154	L	93.4	Very high	97.1	Very high	69 Å²	69	44 Å²	44	36%	0.361	21%	0.209	S	C	.	.			trans	-76.8	110.1	173.6	-67.1	177.9	0	0	0	108.7	K76 V78 L152 I158 L175 R177	K76-L154 HydrophobicContact CB-CD1 3.93Å; K76-L154 HydrophobicContact CB-CG 4.12Å; K76-L154 HydrophobicContact CG-CD1 3.72Å; K76-L154 HydrophobicContact CG-CG 4.14Å; V78-L154 HydrophobicContact CG1-CD2 4Å; L152-L154 HydrophobicContact CD1-CD2 3.64Å; L152-L154 HydrophobicContact CD1-CG 4.28Å; L154-I158 HydrophobicContact CD2-CD1 4.25Å; L154-L175 HydrophobicContact CD2-CD1 4.49Å; L154-L175 HydrophobicContact CD2-CD2 4.24Å; L154-R177 HydrophobicContact CD1-CG 4.25Å
155	I	93.8	Very high	97.1	Very high	42 Å²	42	46.9 Å²	46.9	22%	0.215	23%	0.225	C	C	.	.			trans	-104.9	161.4	173.9	63.4	179.4	0	0	0	109.3	S115 R153 I158 K161	S115-I155 WeakPolarHBondContact O-CD1 3.32Å; R153-I155 HydrophobicContact CG-CG2 4.1Å; R153-I155 PolarHBondContact O-N 3.27Å; I155-I158 HydrophobicContact CG1-CB 3.84Å; I155-I158 HydrophobicContact CG1-CD1 4.36Å; I155-I158 HydrophobicContact CG1-CG1 4.02Å; I155-I158 WeakPolarHBondContact O-CB 3.26Å; I155-K161 HydrophobicContact CD1-CB 4.34Å; I155-K161 HydrophobicContact CD1-CD 3.64Å; I155-K161 HydrophobicContact CG1-CD 4.36Å
156	E	93.6	Very high	97.1	Very high	157 Å²	157	47.2 Å²	47.2	73%	0.734	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	142.2	170.1	-66.4	176.5	176.6	0	0	110.4	I158 K161	E156-I158 PolarHBondContact O-N 2.66Å; E156-K161 WeakPolarHBondContact O-CD 3.43Å; E156-K161 WeakPolarHBondContact O-CE 3.32Å; E156-K161 PolarHBondContact O-NZ 3.42Å
157	D	95.7	Very high	97.1	Very high	101 Å²	101	48.7 Å²	48.7	54%	0.54	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	42	-179.8	-47.4	-41.9	0	0	0	112.8	I159 E160 K161	D157-I159 VanDerWaalsContact C-N 3.3Å; D157-I159 PolarHBondContact O-N 3.19Å; D157-E160 VanDerWaalsContact CA-OE2 3.27Å; D157-E160 WeakPolarHBondContact CA-OE2 3.49Å; D157-E160 HydrophobicContact CB-CB 4.23Å; D157-E160 HydrophobicContact CB-CG 4.46Å; D157-E160 PolarHBondContact O-N 3.05Å; D157-K161 WeakPolarHBondContact O-CG 3.14Å; D157-K161 PolarHBondContact O-N 3.12Å
158	I	97.1	Very high	97	Very high	18 Å²	18	52.6 Å²	52.6	9%	0.092	26%	0.261	C	S	.	.	H	α-helix	trans	-59.1	-38.1	-173	-177.1	163.4	0	0	0	112.9	L152 L154 I155 E156 I162 L175	L152-I158 HydrophobicContact CD1-CD1 3.53Å; L152-I158 HydrophobicContact CD2-CD1 4.11Å; L152-I158 HydrophobicContact CG-CD1 4.46Å; L154-I158 HydrophobicContact CD2-CD1 4.25Å; I155-I158 HydrophobicContact CG1-CB 3.84Å; I155-I158 HydrophobicContact CG1-CD1 4.36Å; I155-I158 HydrophobicContact CG1-CG1 4.02Å; I155-I158 WeakPolarHBondContact O-CB 3.26Å; E156-I158 PolarHBondContact O-N 2.66Å; I158-I162 HydrophobicContact CD1-CD1 4.48Å; I158-I162 HydrophobicContact CG1-CD1 3.77Å; I158-I162 HydrophobicContact CG1-CG1 4.44Å; I158-I162 WeakPolarHBondContact O-CB 3.4Å; I158-I162 WeakPolarHBondContact O-CD1 3.36Å; I158-I162 WeakPolarHBondContact O-CG1 3.45Å; I158-I162 PolarHBondContact O-N 3.08Å; I158-I162 VanDerWaalsContact O-N 3.1Å; I158-L175 HydrophobicContact CD1-CD1 3.88Å; I158-L175 HydrophobicContact CG1-CD1 4.25Å; I158-L175 HydrophobicContact CG2-CD1 3.78Å
159	I	98.1	Very high	96.9	Very high	39 Å²	39	55.6 Å²	55.6	20%	0.2	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-45.6	-178.7	-67.4	179.5	0	0	0	109.5	D157 I162 N163 V172 L175	D157-I159 VanDerWaalsContact C-N 3.3Å; D157-I159 PolarHBondContact O-N 3.19Å; I159-I162 PolarHBondContact O-N 3.21Å; I159-N163 WeakPolarHBondContact CG2-ND2 3.45Å; I159-N163 WeakPolarHBondContact O-CB 3.23Å; I159-N163 PolarHBondContact O-N 3.42Å; I159-N163 PolarHBondContact O-ND2 3.16Å; I159-V172 HydrophobicContact CG1-CG1 4.27Å; I159-V172 HydrophobicContact CG2-CB 4.42Å; I159-V172 HydrophobicContact CG2-CG1 4.26Å; I159-V172 WeakPolarHBondContact CG2-O 3.27Å; I159-L175 HydrophobicContact CD1-CB 3.94Å; I159-L175 HydrophobicContact CG1-CB 4.11Å
160	E	98.1	Very high	96.9	Very high	105 Å²	105	55.6 Å²	55.6	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-58.9	-52.7	178.2	-64.7	72.6	-162.4	0	0	110.3	D157 I162 N163 E164	D157-E160 VanDerWaalsContact CA-OE2 3.27Å; D157-E160 WeakPolarHBondContact CA-OE2 3.49Å; D157-E160 HydrophobicContact CB-CB 4.23Å; D157-E160 HydrophobicContact CB-CG 4.46Å; D157-E160 PolarHBondContact O-N 3.05Å; E160-I162 VanDerWaalsContact C-N 3.33Å; E160-I162 PolarHBondContact O-N 3.08Å; E160-N163 CarbonylContact O-C 3.56Å; E160-N163 PolarHBondContact O-N 2.87Å; E160-E164 WeakPolarHBondContact O-CG 3.13Å; E160-E164 PolarHBondContact O-N 3.1Å
161	K	98.3	Very high	96.9	Very high	71 Å²	71	58.7 Å²	58.7	31%	0.309	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-35.7	-179.9	-72.8	175.1	-179.4	157.5	0	113.5	I155 E156 D157 N165	I155-K161 HydrophobicContact CD1-CB 4.34Å; I155-K161 HydrophobicContact CD1-CD 3.64Å; I155-K161 HydrophobicContact CG1-CD 4.36Å; E156-K161 WeakPolarHBondContact O-CD 3.43Å; E156-K161 WeakPolarHBondContact O-CE 3.32Å; E156-K161 PolarHBondContact O-NZ 3.42Å; D157-K161 WeakPolarHBondContact O-CG 3.14Å; D157-K161 PolarHBondContact O-N 3.12Å; K161-N165 PolarHBondContact O-ND2 3.4Å
162	I	98.5	Very high	97	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-47.2	172.8	-67	164.3	0	0	0	109.5	L108 A111 L112 I158 I159 E160 E164 N165 L166 V172	L108-I162 HydrophobicContact CD1-CG2 4.5Å; A111-I162 HydrophobicContact CB-CG2 4.13Å; L112-I162 HydrophobicContact CD2-CD1 3.65Å; L112-I162 HydrophobicContact CD2-CG1 4.08Å; I158-I162 HydrophobicContact CD1-CD1 4.48Å; I158-I162 HydrophobicContact CG1-CD1 3.77Å; I158-I162 HydrophobicContact CG1-CG1 4.44Å; I158-I162 WeakPolarHBondContact O-CB 3.4Å; I158-I162 WeakPolarHBondContact O-CD1 3.36Å; I158-I162 WeakPolarHBondContact O-CG1 3.45Å; I158-I162 PolarHBondContact O-N 3.08Å; I158-I162 VanDerWaalsContact O-N 3.1Å; I159-I162 PolarHBondContact O-N 3.21Å; E160-I162 VanDerWaalsContact C-N 3.33Å; E160-I162 PolarHBondContact O-N 3.08Å; I162-E164 PolarHBondContact O-N 2.83Å; I162-N165 PolarHBondContact O-N 2.94Å; I162-N165 VanDerWaalsContact O-N 3.08Å; I162-L166 HydrophobicContact CG2-CD1 3.87Å; I162-L166 HydrophobicContact CG2-CG 4.39Å; I162-L166 PolarHBondContact O-N 3.1Å; I162-V172 HydrophobicContact CG2-CG2 3.72Å
163	N	98.6	Very high	97.1	Very high	28 Å²	28	57.1 Å²	57.1	15%	0.15	28%	0.281	C	S	.	.	H	α-helix	trans	-65.9	-31.3	-177.4	-78.1	-33.1	0	0	0	114	I159 E160 N165 L166 R171 V172	I159-N163 WeakPolarHBondContact CG2-ND2 3.45Å; I159-N163 WeakPolarHBondContact O-CB 3.23Å; I159-N163 PolarHBondContact O-N 3.42Å; I159-N163 PolarHBondContact O-ND2 3.16Å; E160-N163 CarbonylContact O-C 3.56Å; E160-N163 PolarHBondContact O-N 2.87Å; N163-N165 PolarHBondContact O-N 3.05Å; N163-L166 PolarHBondContact O-N 3.34Å; N163-L166 VanDerWaalsContact O-N 3.08Å; N163-R171 WeakPolarHBondContact OD1-CA 3.35Å; N163-V172 PolarHBondContact ND2-O 3.29Å; N163-V172 PolarHBondContact OD1-N 3.3Å
164	E	98.4	Very high	97.3	Very high	150 Å²	150	53.6 Å²	53.6	70%	0.701	27%	0.268	S	S	*	.	H	α-helix	trans	-57.7	-27.5	171.5	-76.4	172	178.3	0	0	112.7	E160 I162	E160-E164 WeakPolarHBondContact O-CG 3.13Å; E160-E164 PolarHBondContact O-N 3.1Å; I162-E164 PolarHBondContact O-N 2.83Å
165	N	98.3	Very high	97.5	Very high	60 Å²	60	52.2 Å²	52.2	32%	0.321	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	3.3	-179.6	-69.4	-83.2	0	0	0	113.2	A111 K114 K161 I162 N163	A111-N165 HydrophobicContact CB-CB 3.73Å; K114-N165 HydrophobicContact CB-CB 4.31Å; K114-N165 WeakPolarHBondContact CB-OD1 3.15Å; K114-N165 HydrophobicContact CD-CB 4.49Å; K114-N165 WeakPolarHBondContact CD-OD1 3.45Å; K161-N165 PolarHBondContact O-ND2 3.4Å; I162-N165 PolarHBondContact O-N 2.94Å; I162-N165 VanDerWaalsContact O-N 3.08Å; N163-N165 PolarHBondContact O-N 3.05Å
166	L	98.4	Very high	97.6	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.058	26%	0.257	C	S	.	.	S	Bend	trans	-106.6	141.6	178.6	-73.7	173	0	0	0	111.7	D107 A111 I162 N163 I170 R171 V172	D107-L166 HydrophobicContact CB-CD2 4.04Å; A111-L166 HydrophobicContact CB-CD2 3.69Å; A111-L166 HydrophobicContact CB-CG 3.73Å; I162-L166 HydrophobicContact CG2-CD1 3.87Å; I162-L166 HydrophobicContact CG2-CG 4.39Å; I162-L166 PolarHBondContact O-N 3.1Å; N163-L166 PolarHBondContact O-N 3.34Å; N163-L166 VanDerWaalsContact O-N 3.08Å; L166-I170 HydrophobicContact CD1-CG2 4.14Å; L166-I170 HydrophobicContact CD2-CB 4.4Å; L166-I170 HydrophobicContact CD2-CG2 4.05Å; L166-R171 PolarHBondContact O-NH1 3.23Å; L166-R171 VanDerWaalsContact O-NH1 3.12Å; L166-V172 HydrophobicContact CD1-CG2 4.17Å
167	P	97.6	Very high	97.6	Very high	31 Å²	31	51.6 Å²	51.6	20%	0.201	25%	0.25	C	C	.	.			trans	-61.6	154	172.4	30	-36.3	0	0	0	110.8	D107 Q169 I170 R171	D107-P167 WeakPolarHBondContact OD2-CD 3.25Å; D107-P167 VanDerWaalsContact OD2-CG 3.32Å; D107-P167 WeakPolarHBondContact OD2-CG 3.15Å; P167-Q169 HydrophobicContact CG-CG 4.47Å; P167-Q169 PolarHBondContact O-N 2.95Å; P167-I170 HydrophobicContact CG-CB 4.32Å; P167-I170 HydrophobicContact CG-CD1 3.91Å; P167-I170 HydrophobicContact CG-CG1 4.04Å; P167-I170 PolarHBondContact O-N 3.42Å; P167-R171 PolarHBondContact O-NH1 2.84Å
168	P	96.8	Very high	97.5	Very high	83 Å²	83	47.5 Å²	47.5	54%	0.539	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-31.4	-176.4	-28.7	35.6	0	0	0	115.2	I170	P168-I170 VanDerWaalsContact C-N 3.25Å; P168-I170 PolarHBondContact O-N 3.49Å
169	Q	96.5	Very high	97.2	Very high	63 Å²	63	48.3 Å²	48.3	29%	0.294	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	6.8	-179.8	72.1	-179.4	86	0	0	115	Y84 S85 K87 Y89 P167	Y84-Q169 CarbonylContact C-O 3.58Å; Y84-Q169 WeakPolarHBondContact CA-O 3.33Å; Y84-Q169 WeakPolarHBondContact CB-O 3.28Å; S85-Q169 PolarHBondContact N-O 3Å; S85-Q169 PolarHBondContact O-NE2 3.31Å; S85-Q169 VanDerWaalsContact O-NE2 3.08Å; K87-Q169 PolarHBondContact O-NE2 3.32Å; K87-Q169 VanDerWaalsContact O-NE2 3.12Å; Y89-Q169 HydrophobicContact CE2-CG 4.4Å; Y89-Q169 VanDerWaalsContact CE2-NE2 3.27Å; P167-Q169 HydrophobicContact CG-CG 4.47Å; P167-Q169 PolarHBondContact O-N 2.95Å
170	I	98.6	Very high	96.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	127.6	172.6	-54	177.1	0	0	0	108.2	A83 Y89 I104 D107 L166 P167 P168	A83-I170 CarbonylContact O-C 3.58Å; A83-I170 WeakPolarHBondContact O-CA 3.44Å; Y89-I170 HydrophobicContact CE1-CD1 4.03Å; Y89-I170 HydrophobicContact CE2-CD1 4.43Å; I104-I170 HydrophobicContact CD1-CD1 3.83Å; I104-I170 HydrophobicContact CD1-CG1 4.23Å; I104-I170 HydrophobicContact CG2-CD1 4.41Å; I104-I170 HydrophobicContact CG2-CG2 4.48Å; D107-I170 HydrophobicContact CB-CD1 3.74Å; L166-I170 HydrophobicContact CD1-CG2 4.14Å; L166-I170 HydrophobicContact CD2-CB 4.4Å; L166-I170 HydrophobicContact CD2-CG2 4.05Å; P167-I170 HydrophobicContact CG-CB 4.32Å; P167-I170 HydrophobicContact CG-CD1 3.91Å; P167-I170 HydrophobicContact CG-CG1 4.04Å; P167-I170 PolarHBondContact O-N 3.42Å; P168-I170 VanDerWaalsContact C-N 3.25Å; P168-I170 PolarHBondContact O-N 3.49Å
171	R	98.7	Very high	96.7	Very high	64 Å²	64	49.9 Å²	49.9	24%	0.242	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.3	178.4	-68.9	-67.8	174.1	-112.3	17.7	111.9	L82 A83 N163 L166 P167 L173 F361	L82-R171 WeakPolarHBondContact CA-O 3.32Å; A83-R171 PolarHBondContact N-O 3.07Å; A83-R171 PolarHBondContact O-N 2.85Å; N163-R171 WeakPolarHBondContact OD1-CA 3.35Å; L166-R171 PolarHBondContact O-NH1 3.23Å; L166-R171 VanDerWaalsContact O-NH1 3.12Å; P167-R171 PolarHBondContact O-NH1 2.84Å; R171-L173 HydrophobicContact CB-CD2 3.81Å; R171-L173 HydrophobicContact CB-CG 4.46Å; R171-F361 HydrophobicContact CB-CD2 4.1Å; R171-F361 HydrophobicContact CB-CE2 3.96Å; R171-F361 HydrophobicContact CG-CD2 3.84Å; R171-F361 HydrophobicContact CG-CE2 3.61Å
172	V	98.7	Very high	96.5	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	118.2	157.6	179.1	0	0	0	0	106.7	L80 L81 L82 L108 I159 I162 N163 L166	L80-V172 HydrophobicContact CB-CG1 4.4Å; L80-V172 HydrophobicContact CD2-CG1 4.32Å; L81-V172 CarbonylContact O-C 3.39Å; L81-V172 WeakPolarHBondContact O-CA 3.42Å; L82-V172 HydrophobicContact CD2-CG2 3.67Å; L108-V172 HydrophobicContact CD1-CG2 4.26Å; I159-V172 HydrophobicContact CG1-CG1 4.27Å; I159-V172 HydrophobicContact CG2-CB 4.42Å; I159-V172 HydrophobicContact CG2-CG1 4.26Å; I159-V172 WeakPolarHBondContact CG2-O 3.27Å; I162-V172 HydrophobicContact CG2-CG2 3.72Å; N163-V172 PolarHBondContact ND2-O 3.29Å; N163-V172 PolarHBondContact OD1-N 3.3Å; L166-V172 HydrophobicContact CD1-CG2 4.17Å
173	L	98.4	Very high	96.4	Very high	31 Å²	31	48.2 Å²	48.2	16%	0.162	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-24.9	-177.6	-60.4	-177.9	0	0	0	112.5	L81 A83 R171 E354 A357 I358	L81-L173 HydrophobicContact CD2-CB 3.83Å; L81-L173 HydrophobicContact CG-CB 4.12Å; L81-L173 PolarHBondContact O-N 3.13Å; A83-L173 HydrophobicContact CB-CD1 3.64Å; A83-L173 HydrophobicContact CB-CG 4.18Å; R171-L173 HydrophobicContact CB-CD2 3.81Å; R171-L173 HydrophobicContact CB-CG 4.46Å; L173-E354 WeakPolarHBondContact O-CG 3.45Å; L173-A357 HydrophobicContact CD2-CB 4.41Å; L173-I358 HydrophobicContact CD1-CB 4.31Å; L173-I358 HydrophobicContact CD1-CG1 3.62Å
174	G	97.9	Very high	96.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	156.2	-176.7	0	0	0	0	0	112.5	L80 L81	L80-G174 WeakPolarHBondContact CA-O 3.42Å; L81-G174 PolarHBondContact N-O 3.08Å
175	L	97.5	Very high	96.1	Very high	40 Å²	40	44.2 Å²	44.2	21%	0.209	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	132	177.6	-178.3	154.8	0	0	0	109.5	V78 V79 L80 L154 I158 I159	V78-L175 HydrophobicContact CB-CD2 4.48Å; V78-L175 HydrophobicContact CB-CG 4.44Å; V78-L175 HydrophobicContact CG1-CD2 4.29Å; V79-L175 WeakPolarHBondContact O-CA 3.18Å; L80-L175 HydrophobicContact CD2-CB 3.92Å; L80-L175 HydrophobicContact CD2-CD1 3.51Å; L80-L175 HydrophobicContact CD2-CG 3.68Å; L154-L175 HydrophobicContact CD2-CD1 4.49Å; L154-L175 HydrophobicContact CD2-CD2 4.24Å; I158-L175 HydrophobicContact CD1-CD1 3.88Å; I158-L175 HydrophobicContact CG1-CD1 4.25Å; I158-L175 HydrophobicContact CG2-CD1 3.78Å; I159-L175 HydrophobicContact CD1-CB 3.94Å; I159-L175 HydrophobicContact CG1-CB 4.11Å
176	K	95.4	Very high	95.9	Very high	34 Å²	34	46.9 Å²	46.9	15%	0.148	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.4	173.8	-70.3	-174.2	168.6	-169.1	0	111.7	V78 V79 R348 L349 E350 W351	V78-K176 CarbonylContact C-O 3.59Å; V78-K176 VanDerWaalsContact CA-O 3.25Å; V78-K176 WeakPolarHBondContact CA-O 3.22Å; V78-K176 WeakPolarHBondContact CB-O 3.35Å; V79-K176 PolarHBondContact N-O 3.04Å; V79-K176 PolarHBondContact O-N 2.64Å; K176-R348 PolarHBondContact NZ-O 3.44Å; K176-L349 HydrophobicContact CB-CD2 4.16Å; K176-L349 HydrophobicContact CD-CD2 4.23Å; K176-E350 WeakPolarHBondContact CE-O 3.39Å; K176-E350 PolarHBondContact NZ-O 3.26Å; K176-W351 HydrophobicContact CB-CH2 4.17Å; K176-W351 HydrophobicContact CD-CE3 4.38Å; K176-W351 HydrophobicContact CD-CH2 4.02Å; K176-W351 HydrophobicContact CD-CZ3 3.89Å; K176-W351 HydrophobicContact CG-CH2 3.85Å; K176-W351 HydrophobicContact CG-CZ3 3.74Å
177	R	93.9	Very high	95.7	Very high	152 Å²	152	48.9 Å²	48.9	57%	0.574	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	145.1	171.6	-62.4	-173.6	-53.8	173.9	6.3	109.7	V78 L154	V78-R177 HydrophobicContact CG1-CG 4.47Å; L154-R177 HydrophobicContact CD1-CG 4.25Å
178	V	93.4	Very high	95.6	Very high	15 Å²	15	48 Å²	48	9%	0.091	25%	0.252	C	S	.	.			trans	-138	170.9	179.6	-67.3	0	0	0	0	110.9	K77 V79 F182 L349	K77-V178 HydrophobicContact CB-CG2 4.32Å; K77-V178 HydrophobicContact CG-CG2 3.72Å; K77-V178 PolarHBondContact O-N 3.26Å; K77-V178 VanDerWaalsContact O-N 3.11Å; V79-V178 HydrophobicContact CB-CG1 4.39Å; V79-V178 HydrophobicContact CG2-CB 4.36Å; V79-V178 HydrophobicContact CG2-CG1 3.53Å; V79-V178 HydrophobicContact CG2-CG2 3.91Å; V178-F182 HydrophobicContact CB-CB 3.87Å; V178-F182 HydrophobicContact CB-CD1 4.22Å; V178-F182 HydrophobicContact CB-CG 3.96Å; V178-F182 HydrophobicContact CG1-CD1 4.31Å; V178-F182 HydrophobicContact CG1-CG 4.3Å; V178-F182 HydrophobicContact CG2-CB 3.64Å; V178-F182 HydrophobicContact CG2-CD1 3.79Å; V178-F182 HydrophobicContact CG2-CG 3.87Å; V178-L349 HydrophobicContact CG1-CD1 4.35Å; V178-L349 HydrophobicContact CG1-CD2 3.87Å
179	T	91.5	Very high	95.5	Very high	35 Å²	35	45.3 Å²	45.3	22%	0.215	23%	0.233	C	C	.	.			trans	-57	150.9	173.4	59.2	0	0	0	0	111.5	K77 G181 F182 H346	K77-T179 WeakPolarHBondContact CG-O 3.47Å; T179-G181 PolarHBondContact O-N 2.85Å; T179-G181 VanDerWaalsContact O-N 3.16Å; T179-F182 WeakPolarHBondContact O-CB 3.37Å; T179-F182 PolarHBondContact O-N 3.35Å; T179-H346 VanDerWaalsContact CG2-CD2 3.43Å; T179-H346 WeakPolarHBondContact CG2-CD2 3.42Å; T179-H346 WeakPolarHBondContact CG2-NE2 3.21Å
180	Q	91.9	Very high	95.6	Very high	108 Å²	108	42.5 Å²	42.5	51%	0.505	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.5	-179.8	-72.1	-65.6	-25.8	0	0	113.6
181	G	92.7	Very high	95.6	Very high	70 Å²	70	43.8 Å²	43.8	72%	0.722	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.8	179.4	0	0	0	0	0	115	T179 N183	T179-G181 PolarHBondContact O-N 2.85Å; T179-G181 VanDerWaalsContact O-N 3.16Å; G181-N183 PolarHBondContact O-N 3.39Å
182	F	94.8	Very high	95.6	Very high	5 Å²	5	41.8 Å²	41.8	2%	0.022	22%	0.221	C	C	.	.			trans	-62	133.5	-177.1	-175.9	-94.5	0	0	0	111.9	K77 V79 V178 T179 N187 F333 Y336 L349	K77-F182 WeakPolarHBondContact CE-O 3.43Å; K77-F182 PolarHBondContact NZ-O 3.14Å; V79-F182 HydrophobicContact CG2-CD1 3.7Å; V79-F182 HydrophobicContact CG2-CE1 3.34Å; V79-F182 HydrophobicContact CG2-CZ 4.19Å; V178-F182 HydrophobicContact CB-CB 3.87Å; V178-F182 HydrophobicContact CB-CD1 4.22Å; V178-F182 HydrophobicContact CB-CG 3.96Å; V178-F182 HydrophobicContact CG1-CD1 4.31Å; V178-F182 HydrophobicContact CG1-CG 4.3Å; V178-F182 HydrophobicContact CG2-CB 3.64Å; V178-F182 HydrophobicContact CG2-CD1 3.79Å; V178-F182 HydrophobicContact CG2-CG 3.87Å; T179-F182 WeakPolarHBondContact O-CB 3.37Å; T179-F182 PolarHBondContact O-N 3.35Å; F182-N187 HydrophobicContact CD2-CB 4.11Å; F182-N187 HydrophobicContact CE2-CB 3.54Å; F182-N187 HydrophobicContact CZ-CB 4Å; F182-F333 HydrophobicContact CE2-CD1 4.47Å; F182-F333 HydrophobicContact CE2-CE1 4.49Å; F182-F333 HydrophobicContact CZ-CD1 4.05Å; F182-F333 AromaticContact CZ-CE1 3.69Å; F182-F333 HydrophobicContact CZ-CE1 3.69Å; F182-F333 HydrophobicContact CZ-CZ 4.3Å; F182-Y336 AromaticContact CD2-CD2 3.63Å; F182-Y336 HydrophobicContact CD2-CD2 3.63Å; F182-Y336 AromaticContact CD2-CE2 3.47Å; F182-Y336 HydrophobicContact CD2-CE2 3.47Å; F182-Y336 VanDerWaalsContact CD2-CE2 3.47Å; F182-Y336 AromaticContact CE2-CD2 3.5Å; F182-Y336 HydrophobicContact CE2-CD2 3.5Å; F182-Y336 VanDerWaalsContact CE2-CD2 3.5Å; F182-Y336 AromaticContact CE2-CE2 3.69Å; F182-Y336 HydrophobicContact CE2-CE2 3.69Å; F182-Y336 AromaticContact CE2-CG 3.98Å; F182-Y336 HydrophobicContact CE2-CG 3.98Å; F182-L349 HydrophobicContact CD2-CD1 4.45Å; F182-L349 HydrophobicContact CE1-CD1 4.09Å; F182-L349 HydrophobicContact CE2-CD1 3.46Å; F182-L349 VanDerWaalsContact CE2-CD1 3.46Å; F182-L349 HydrophobicContact CZ-CD1 3.23Å
183	N	96.3	Very high	95.6	Very high	31 Å²	31	42.6 Å²	42.6	17%	0.166	22%	0.224	C	C	.	.			trans	-130.1	108.8	173.9	-179.2	-38	0	0	0	108.9	Q132 G181 K185 N186 N187	Q132-N183 WeakPolarHBondContact CG-ND2 3.4Å; Q132-N183 PolarHBondContact OE1-ND2 3.2Å; G181-N183 PolarHBondContact O-N 3.39Å; N183-K185 PolarHBondContact O-N 3.27Å; N183-K185 VanDerWaalsContact O-N 3.1Å; N183-K185 WeakPolarHBondContact OD1-CB 3.28Å; N183-K185 PolarHBondContact OD1-N 2.91Å; N183-N186 HydrophobicContact CB-CB 4.18Å; N183-N186 PolarHBondContact O-N 2.95Å; N183-N186 PolarHBondContact OD1-N 3.02Å; N183-N187 PolarHBondContact N-OD1 3.49Å; N183-N187 WeakPolarHBondContact O-CB 3.42Å; N183-N187 PolarHBondContact O-N 3.25Å; N183-N187 PolarHBondContact O-OD1 2.92Å
184	S	95.8	Very high	95.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.3	-174.8	68.4	0	0	0	0	113.8	Q132 C134 S149 C188	Q132-S184 PolarHBondContact O-OG 2.78Å; C134-S184 WeakPolarHBondContact SG-CB 3.41Å; C134-S184 PolarHBondContact SG-O 2.78Å; S149-S184 PolarHBondContact N-OG 2.65Å; S149-S184 VanDerWaalsContact OG-CB 3.31Å; S149-S184 WeakPolarHBondContact OG-CB 3.42Å; S149-S184 PolarHBondContact OG-N 3.17Å; S149-S184 PolarHBondContact OG-OG 3.08Å; S149-S184 VanDerWaalsContact OG-OG 3.11Å; S184-C188 WeakPolarHBondContact O-CB 3.38Å; S184-C188 PolarHBondContact O-N 2.89Å
185	K	94.8	Very high	95.6	Very high	93 Å²	93	41.5 Å²	41.5	40%	0.404	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-48.8	175.6	-175	-170.7	172.9	-168.9	0	111.8	R133 N183 R191	R133-K185 WeakPolarHBondContact O-CB 3.22Å; N183-K185 PolarHBondContact O-N 3.27Å; N183-K185 VanDerWaalsContact O-N 3.1Å; N183-K185 WeakPolarHBondContact OD1-CB 3.28Å; N183-K185 PolarHBondContact OD1-N 2.91Å; K185-R191 PolarHBondContact O-NH2 3.37Å
186	N	93.5	Very high	95.7	Very high	116 Å²	116	39.8 Å²	39.8	62%	0.62	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-27.7	-171.4	-63.7	-7.5	0	0	0	112.4	N183	N183-N186 HydrophobicContact CB-CB 4.18Å; N183-N186 PolarHBondContact O-N 2.95Å; N183-N186 PolarHBondContact OD1-N 3.02Å
187	N	94.9	Very high	95.8	Very high	54 Å²	54	38.1 Å²	38.1	29%	0.289	20%	0.202	S	C	.	.	S	Bend	trans	-89.6	-3.9	178.5	-66.8	109.8	0	0	0	113.3	F182 N183 F333	F182-N187 HydrophobicContact CD2-CB 4.11Å; F182-N187 HydrophobicContact CE2-CB 3.54Å; F182-N187 HydrophobicContact CZ-CB 4Å; N183-N187 PolarHBondContact N-OD1 3.49Å; N183-N187 WeakPolarHBondContact O-CB 3.42Å; N183-N187 PolarHBondContact O-N 3.25Å; N183-N187 PolarHBondContact O-OD1 2.92Å; N187-F333 WeakPolarHBondContact O-CD1 3.48Å
188	C	95.3	Very high	96	Very high	11 Å²	11	31.3 Å²	31.3	7%	0.074	18%	0.177	C	C	.	.			trans	-82.1	127.4	176.9	170	0	0	0	0	111.4	S184 A190 R191 V331 F333	S184-C188 WeakPolarHBondContact O-CB 3.38Å; S184-C188 PolarHBondContact O-N 2.89Å; C188-A190 PolarHBondContact SG-O 2.86Å; C188-R191 PolarHBondContact O-NH1 2.95Å; C188-R191 PolarHBondContact SG-NE 3.3Å; C188-R191 PolarHBondContact SG-NH1 3.48Å; C188-R191 VanDerWaalsContact SG-NH1 3.37Å; C188-V331 HydrophobicContact CB-CG1 3.98Å; C188-V331 WeakPolarHBondContact SG-CG1 3.35Å; C188-F333 HydrophobicContact CB-CD1 4.38Å; C188-F333 HydrophobicContact CB-CE1 3.83Å; C188-F333 HydrophobicContact CB-CZ 4.32Å
189	D	95.5	Very high	96.3	Very high	27 Å²	27	30.6 Å²	30.6	14%	0.144	17%	0.173	C	C	.	.			trans	-88.4	-39.5	-174.3	-62.3	-58.9	0	0	0	113.2	Q280 H332 F333 D334 R335	D189-Q280 WeakPolarHBondContact O-CA 3.42Å; D189-H332 PolarHBondContact N-O 2.97Å; D189-F333 WeakPolarHBondContact OD2-CA 3.3Å; D189-D334 PolarHBondContact OD2-N 3.18Å; D189-R335 VanDerWaalsContact OD1-CB 3.32Å; D189-R335 WeakPolarHBondContact OD1-CB 3.16Å; D189-R335 WeakPolarHBondContact OD1-CD 3.33Å; D189-R335 WeakPolarHBondContact OD1-CG 3.48Å; D189-R335 IonicContact OD1-NE 3.45Å; D189-R335 PolarHBondContact OD2-N 3.44Å
190	A	97.8	Very high	96.5	Very high	5 Å²	5	29 Å²	29	4%	0.041	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	163.4	-176.8	0	0	0	0	0	111.2	C188 G279 H332	C188-A190 PolarHBondContact SG-O 2.86Å; A190-G279 CarbonylContact C-O 3.48Å; A190-G279 VanDerWaalsContact CA-O 3.27Å; A190-G279 WeakPolarHBondContact CA-O 3.21Å; A190-G279 WeakPolarHBondContact CB-O 3.48Å; A190-H332 HydrophobicContact CB-CB 4.1Å; A190-H332 PolarHBondContact O-CD2 3.31Å; A190-H332 PolarHBondContact O-N 3.48Å
191	R	98.4	Very high	96.8	Very high	27 Å²	27	23.9 Å²	23.9	10%	0.102	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.5	170.7	-60.8	86.2	170.9	144.4	8.1	109	C134 K185 C188 Y193 R278 G279 Q280 F282 L328 R330	C134-R191 PolarHBondContact O-NH2 3.48Å; K185-R191 PolarHBondContact O-NH2 3.37Å; C188-R191 PolarHBondContact O-NH1 2.95Å; C188-R191 PolarHBondContact SG-NE 3.3Å; C188-R191 PolarHBondContact SG-NH1 3.48Å; C188-R191 VanDerWaalsContact SG-NH1 3.37Å; R191-Y193 HydrophobicContact CB-CD2 4.14Å; R191-Y193 HydrophobicContact CB-CE2 3.64Å; R191-Y193 HydrophobicContact CG-CE2 4.41Å; R191-R278 WeakPolarHBondContact O-CA 3.36Å; R191-G279 PolarHBondContact N-O 3.43Å; R191-G279 PolarHBondContact O-N 3.37Å; R191-G279 VanDerWaalsContact O-N 3.11Å; R191-Q280 PolarHBondContact NH1-O 3.05Å; R191-F282 HydrophobicContact CB-CD2 4.44Å; R191-F282 HydrophobicContact CB-CE2 4.16Å; R191-L328 HydrophobicContact CB-CD1 4.06Å; R191-L328 HydrophobicContact CG-CD1 4.33Å; R191-R330 CarbonylContact C-O 3.58Å; R191-R330 WeakPolarHBondContact CA-O 3.48Å
192	T	98.7	Very high	97.1	Very high	22 Å²	22	20.7 Å²	20.7	14%	0.135	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.8	166.8	-61.9	0	0	0	0	108.4	T276 V277 E329 R330 H332	T192-T276 HydrophobicContact CG2-CG2 3.75Å; T192-V277 CarbonylContact C-O 3.59Å; T192-V277 VanDerWaalsContact CA-O 3.32Å; T192-V277 WeakPolarHBondContact CA-O 3.42Å; T192-E329 HydrophobicContact CG2-CB 4.28Å; T192-E329 WeakPolarHBondContact O-CB 3.37Å; T192-E329 PolarHBondContact O-N 3.23Å; T192-R330 PolarHBondContact N-O 2.8Å; T192-R330 PolarHBondContact O-N 3.39Å; T192-R330 VanDerWaalsContact O-N 3.11Å; T192-H332 PolarHBondContact OG1-NE2 3.38Å
193	Y	98.8	Very high	97.2	Very high	19 Å²	19	20.5 Å²	20.5	8%	0.075	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	147.4	171.6	-72.1	-99.8	0	0	0	109.6	R191 T276 V277 F282 I287 L326 V327 L328	R191-Y193 HydrophobicContact CB-CD2 4.14Å; R191-Y193 HydrophobicContact CB-CE2 3.64Å; R191-Y193 HydrophobicContact CG-CE2 4.41Å; Y193-T276 WeakPolarHBondContact O-CA 3.34Å; Y193-V277 PolarHBondContact N-O 3.04Å; Y193-V277 PolarHBondContact O-N 3.11Å; Y193-F282 HydrophobicContact CD2-CD2 4.09Å; Y193-F282 AromaticContact CD2-CE2 3.84Å; Y193-F282 HydrophobicContact CD2-CE2 3.84Å; Y193-F282 HydrophobicContact CD2-CZ 4.47Å; Y193-F282 AromaticContact CE2-CD2 3.75Å; Y193-F282 HydrophobicContact CE2-CD2 3.75Å; Y193-F282 AromaticContact CE2-CE2 3.92Å; Y193-F282 HydrophobicContact CE2-CE2 3.92Å; Y193-I287 HydrophobicContact CD1-CD1 4.04Å; Y193-I287 HydrophobicContact CD2-CD1 3.35Å; Y193-I287 HydrophobicContact CE1-CD1 4.44Å; Y193-I287 HydrophobicContact CE2-CD1 3.81Å; Y193-I287 HydrophobicContact CG-CD1 3.48Å; Y193-I287 VanDerWaalsContact CG-CD1 3.48Å; Y193-L326 HydrophobicContact CD1-CD1 3.91Å; Y193-L326 HydrophobicContact CD1-CD2 4.47Å; Y193-L326 HydrophobicContact CD1-CG 4.07Å; Y193-L326 HydrophobicContact CG-CD1 4.32Å; Y193-V327 CarbonylContact C-O 3.51Å; Y193-V327 VanDerWaalsContact CA-O 3.23Å; Y193-V327 WeakPolarHBondContact CA-O 3.41Å; Y193-V327 WeakPolarHBondContact CD1-O 3.44Å; Y193-L328 HydrophobicContact CD1-CB 3.99Å; Y193-L328 HydrophobicContact CD1-CD1 4.34Å; Y193-L328 HydrophobicContact CD2-CD1 4.26Å; Y193-L328 HydrophobicContact CE1-CB 3.61Å; Y193-L328 HydrophobicContact CE1-CD1 3.9Å; Y193-L328 HydrophobicContact CE1-CG 4.33Å; Y193-L328 HydrophobicContact CE2-CD1 3.82Å
194	A	98.6	Very high	97.2	Very high	5 Å²	5	22.4 Å²	22.4	4%	0.041	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	150	163.8	0	0	0	0	0	109.4	V274 I275 V327 E329	A194-V274 HydrophobicContact CB-CG1 3.85Å; A194-I275 CarbonylContact C-O 3.59Å; A194-I275 VanDerWaalsContact CA-O 3.23Å; A194-I275 WeakPolarHBondContact CA-O 3.39Å; A194-V327 PolarHBondContact N-O 2.85Å; A194-V327 PolarHBondContact O-N 3.11Å; A194-E329 HydrophobicContact CB-CG 3.53Å
195	Y	98.8	Very high	97.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.008	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	105.3	170.9	-167.6	-85.8	0	0	0	109.2	L197 I275 I291 P322 G325 L326 M380	Y195-L197 HydrophobicContact CD1-CB 4.09Å; Y195-L197 HydrophobicContact CD1-CD2 4.2Å; Y195-L197 HydrophobicContact CE1-CB 3.83Å; Y195-L197 HydrophobicContact CE1-CD1 4.43Å; Y195-I275 HydrophobicContact CD1-CD1 4.32Å; Y195-I275 PolarHBondContact N-O 2.86Å; Y195-I275 PolarHBondContact O-N 3.23Å; Y195-I291 VanDerWaalsContact CB-CD1 3.48Å; Y195-I291 HydrophobicContact CD1-CD1 3.92Å; Y195-I291 HydrophobicContact CD1-CG2 4.37Å; Y195-I291 HydrophobicContact CD2-CD1 3.75Å; Y195-I291 HydrophobicContact CE1-CG2 4.37Å; Y195-I291 HydrophobicContact CE2-CD1 4.48Å; Y195-I291 HydrophobicContact CG-CD1 3.44Å; Y195-I291 VanDerWaalsContact CG-CD1 3.44Å; Y195-P322 VanDerWaalsContact CE2-O 3.29Å; Y195-P322 WeakPolarHBondContact CE2-O 3.37Å; Y195-P322 WeakPolarHBondContact OH-CD 3.36Å; Y195-P322 PolarHBondContact OH-O 2.92Å; Y195-G325 CarbonylContact C-O 3.53Å; Y195-G325 VanDerWaalsContact CA-O 3.26Å; Y195-G325 WeakPolarHBondContact CA-O 3.43Å; Y195-L326 HydrophobicContact CD2-CB 3.71Å; Y195-L326 HydrophobicContact CD2-CD1 3.93Å; Y195-L326 HydrophobicContact CD2-CG 4.42Å; Y195-L326 HydrophobicContact CE2-CB 4.03Å; Y195-M380 HydrophobicContact CE1-CE 3.96Å
196	M	98.6	Very high	96.9	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.02	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	130.7	175.6	-178.6	179.9	-66.2	0	0	109.6	F265 F272 A273 V274 G325 Y367 I370 V371	M196-F265 HydrophobicContact CE-CZ 3.96Å; M196-F265 HydrophobicContact SD-CZ 4.4Å; M196-F272 HydrophobicContact CG-CD1 4.06Å; M196-F272 HydrophobicContact SD-CD1 4.47Å; M196-A273 WeakPolarHBondContact CA-O 3.46Å; M196-V274 HydrophobicContact CB-CG2 4.19Å; M196-V274 HydrophobicContact CE-CG2 4.06Å; M196-V274 HydrophobicContact CG-CG2 4.32Å; M196-G325 PolarHBondContact N-O 3.23Å; M196-G325 WeakPolarHBondContact O-CA 2.9Å; M196-Y367 HydrophobicContact CE-CD1 3.31Å; M196-Y367 HydrophobicContact CE-CD2 3.99Å; M196-Y367 HydrophobicContact CE-CE1 3.57Å; M196-Y367 HydrophobicContact CE-CE2 4.2Å; M196-Y367 HydrophobicContact CE-CG 3.54Å; M196-Y367 HydrophobicContact SD-CD1 4.3Å; M196-I370 HydrophobicContact CB-CD1 4.45Å; M196-I370 HydrophobicContact CB-CG2 4.29Å; M196-I370 HydrophobicContact CG-CG2 4.23Å; M196-I370 HydrophobicContact SD-CB 4.43Å; M196-I370 HydrophobicContact SD-CG2 4.07Å; M196-V371 HydrophobicContact SD-CG2 4.11Å
197	L	98.3	Very high	96.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	151.4	178.9	72.9	168.6	0	0	0	112.8	Y195 A201 F202 F272 A273 I275 I295 M380	Y195-L197 HydrophobicContact CD1-CB 4.09Å; Y195-L197 HydrophobicContact CD1-CD2 4.2Å; Y195-L197 HydrophobicContact CE1-CB 3.83Å; Y195-L197 HydrophobicContact CE1-CD1 4.43Å; L197-A201 HydrophobicContact CD1-CB 3.48Å; L197-A201 VanDerWaalsContact CD1-CB 3.48Å; L197-A201 HydrophobicContact CG-CB 4.38Å; L197-F202 HydrophobicContact CD1-CE2 4.19Å; L197-F202 HydrophobicContact CD1-CZ 4.02Å; L197-F202 HydrophobicContact CD2-CE2 4.44Å; L197-F272 VanDerWaalsContact C-CD1 3.5Å; L197-F272 CarbonylContact O-C 3.5Å; L197-F272 VanDerWaalsContact O-CA 3.23Å; L197-F272 WeakPolarHBondContact O-CA 3.49Å; L197-A273 PolarHBondContact N-O 3.13Å; L197-A273 VanDerWaalsContact N-O 3.08Å; L197-A273 PolarHBondContact O-N 3.38Å; L197-I275 HydrophobicContact CD1-CD1 4.3Å; L197-I275 HydrophobicContact CD2-CD1 3.62Å; L197-I275 HydrophobicContact CD2-CG1 3.87Å; L197-I295 HydrophobicContact CD1-CD1 4.06Å; L197-M380 HydrophobicContact CB-CE 3.91Å; L197-M380 HydrophobicContact CD1-CE 4.22Å
198	P	98.2	Very high	96.6	Very high	8 Å²	8	30 Å²	30	5%	0.052	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	133.3	164.8	-22.3	34.1	0	0	0	110.6	V200 A201 E271 F272 E374 M380	P198-V200 HydrophobicContact CB-CG1 3.99Å; P198-V200 PolarHBondContact O-N 3.16Å; P198-A201 VanDerWaalsContact O-CB 3.27Å; P198-A201 WeakPolarHBondContact O-CB 3.28Å; P198-A201 PolarHBondContact O-N 3.35Å; P198-A201 VanDerWaalsContact O-N 3.1Å; P198-E271 CarbonylContact C-O 3.58Å; P198-E271 WeakPolarHBondContact CA-O 3.28Å; P198-F272 HydrophobicContact CB-CE1 4.42Å; P198-F272 HydrophobicContact CG-CD1 4.22Å; P198-F272 HydrophobicContact CG-CE1 3.74Å; P198-F272 HydrophobicContact CG-CZ 4.4Å; P198-E374 HydrophobicContact CG-CB 3.95Å; P198-E374 HydrophobicContact CG-CG 3.89Å; P198-M380 HydrophobicContact CG-CB 4.18Å
199	T	98.4	Very high	96.1	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-68.3	-17.4	-176.1	55.2	0	0	0	0	113.7	A201 F202 F215 L217 P264 E271 A273	T199-A201 PolarHBondContact O-N 2.86Å; T199-F202 PolarHBondContact O-N 3.1Å; T199-F215 VanDerWaalsContact C-CE1 3.46Å; T199-F215 WeakPolarHBondContact O-CE1 3.5Å; T199-L217 HydrophobicContact CG2-CB 4.14Å; T199-L217 HydrophobicContact CG2-CD2 4.19Å; T199-P264 HydrophobicContact CG2-CB 3.99Å; T199-E271 WeakPolarHBondContact CB-OE2 3.19Å; T199-E271 HydrophobicContact CG2-CB 4.46Å; T199-E271 HydrophobicContact CG2-CG 3.88Å; T199-E271 WeakPolarHBondContact CG2-OE2 3.36Å; T199-E271 PolarHBondContact N-O 2.95Å; T199-E271 WeakPolarHBondContact OG1-CB 3.42Å; T199-E271 PolarHBondContact OG1-O 2.69Å; T199-E271 PolarHBondContact OG1-OE2 2.79Å; T199-A273 HydrophobicContact CG2-CB 3.86Å
200	V	97.6	Very high	95.5	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-54.8	-20	170.2	73.2	0	0	0	0	112.4	P198 F202 S203 Y207 I212 F215 R299 V381 M384	P198-V200 HydrophobicContact CB-CG1 3.99Å; P198-V200 PolarHBondContact O-N 3.16Å; V200-F202 PolarHBondContact O-N 3.42Å; V200-F202 VanDerWaalsContact O-N 3.11Å; V200-S203 WeakPolarHBondContact O-CB 3.33Å; V200-S203 PolarHBondContact O-N 2.94Å; V200-S203 PolarHBondContact O-OG 3.37Å; V200-Y207 HydrophobicContact CG2-CD1 3.95Å; V200-Y207 HydrophobicContact CG2-CE1 3.89Å; V200-I212 HydrophobicContact CB-CG2 3.86Å; V200-I212 HydrophobicContact CG1-CG2 3.51Å; V200-I212 HydrophobicContact CG2-CG2 4.24Å; V200-F215 VanDerWaalsContact CA-CD1 3.47Å; V200-F215 HydrophobicContact CB-CB 4.24Å; V200-F215 HydrophobicContact CB-CD1 4.09Å; V200-F215 HydrophobicContact CB-CG 4.16Å; V200-F215 HydrophobicContact CG2-CB 4.21Å; V200-F215 HydrophobicContact CG2-CG 4.18Å; V200-R299 PolarHBondContact O-NH1 3.21Å; V200-R299 VanDerWaalsContact O-NH1 3.14Å; V200-V381 HydrophobicContact CG1-CG2 4.22Å; V200-M384 HydrophobicContact CG1-CE 3.86Å; V200-M384 HydrophobicContact CG2-CE 4.43Å
201	A	98.1	Very high	94.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-53.1	-28.5	168.8	0	0	0	0	0	113.5	L197 P198 T199 I295 R299 M380 M384	L197-A201 HydrophobicContact CD1-CB 3.48Å; L197-A201 VanDerWaalsContact CD1-CB 3.48Å; L197-A201 HydrophobicContact CG-CB 4.38Å; P198-A201 VanDerWaalsContact O-CB 3.27Å; P198-A201 WeakPolarHBondContact O-CB 3.28Å; P198-A201 PolarHBondContact O-N 3.35Å; P198-A201 VanDerWaalsContact O-N 3.1Å; T199-A201 PolarHBondContact O-N 2.86Å; A201-I295 HydrophobicContact CB-CD1 4.16Å; A201-I295 HydrophobicContact CB-CG1 4.45Å; A201-I295 WeakPolarHBondContact O-CG2 3.43Å; A201-R299 WeakPolarHBondContact O-CD 3.49Å; A201-R299 VanDerWaalsContact O-CG 3.3Å; A201-R299 WeakPolarHBondContact O-CG 3.4Å; A201-M380 HydrophobicContact CB-CG 4.11Å; A201-M380 HydrophobicContact CB-SD 4.14Å; A201-M384 VanDerWaalsContact CA-SD 3.55Å; A201-M384 HydrophobicContact CB-SD 4.46Å
202	F	98.4	Very high	94.4	Very high	3 Å²	3	43.9 Å²	43.9	1%	0.013	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-101	11.5	178.9	-56.8	-52.6	0	0	0	113.4	L197 T199 V200 L217 T221 V225 I275 I295 I298	L197-F202 HydrophobicContact CD1-CE2 4.19Å; L197-F202 HydrophobicContact CD1-CZ 4.02Å; L197-F202 HydrophobicContact CD2-CE2 4.44Å; T199-F202 PolarHBondContact O-N 3.1Å; V200-F202 PolarHBondContact O-N 3.42Å; V200-F202 VanDerWaalsContact O-N 3.11Å; F202-L217 HydrophobicContact CB-CD1 3.76Å; F202-L217 HydrophobicContact CD2-CD1 4.23Å; F202-L217 HydrophobicContact CD2-CD2 4.14Å; F202-L217 HydrophobicContact CG-CD1 4.44Å; F202-T221 HydrophobicContact CB-CG2 4.28Å; F202-V225 HydrophobicContact CD1-CG2 3.72Å; F202-V225 HydrophobicContact CD2-CG2 4.28Å; F202-V225 HydrophobicContact CE1-CG1 4.08Å; F202-V225 HydrophobicContact CE1-CG2 3.9Å; F202-V225 HydrophobicContact CE2-CG1 4.37Å; F202-V225 HydrophobicContact CE2-CG2 4.42Å; F202-V225 HydrophobicContact CG-CG2 3.92Å; F202-V225 HydrophobicContact CZ-CG1 3.88Å; F202-V225 HydrophobicContact CZ-CG2 4.24Å; F202-I275 HydrophobicContact CZ-CD1 4.24Å; F202-I295 HydrophobicContact CD1-CG1 4.22Å; F202-I295 HydrophobicContact CE1-CG1 3.77Å; F202-I298 HydrophobicContact CB-CG2 3.84Å; F202-I298 HydrophobicContact CD1-CB 4.35Å; F202-I298 HydrophobicContact CD1-CG2 4.04Å; F202-I298 HydrophobicContact CG-CG2 4.38Å; F202-I298 WeakPolarHBondContact O-CG2 3.33Å
203	S	97.3	Very high	94	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-70.2	154.6	175.1	74.9	0	0	0	0	111.9	V200 Y207 R299	V200-S203 WeakPolarHBondContact O-CB 3.33Å; V200-S203 PolarHBondContact O-N 2.94Å; V200-S203 PolarHBondContact O-OG 3.37Å; S203-Y207 WeakPolarHBondContact OG-CB 3.24Å; S203-R299 VanDerWaalsContact O-CG 3.3Å; S203-R299 WeakPolarHBondContact O-CG 3.3Å; S203-R299 PolarHBondContact O-NH1 2.88Å; S203-R299 VanDerWaalsContact O-NH1 3.08Å; S203-R299 PolarHBondContact OG-NH1 2.87Å
204	P	95.5	Very high	93.8	Very high	71 Å²	71	46 Å²	46	46%	0.461	25%	0.248	S	C	.	.			trans	-54	151.6	169	-26.6	36.4	0	0	0	112.4	D206 Y207	P204-D206 WeakPolarHBondContact CB-OD1 3.35Å; P204-D206 PolarHBondContact O-N 2.91Å; P204-D206 VanDerWaalsContact O-N 3.14Å; P204-Y207 VanDerWaalsContact O-CB 3.23Å; P204-Y207 WeakPolarHBondContact O-CB 3.48Å; P204-Y207 PolarHBondContact O-N 3.22Å
205	K	92.9	Very high	93.7	Very high	127 Å²	127	46.8 Å²	46.8	55%	0.552	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.6	-178.4	59.2	-178.4	-179.1	-174	0	114.7	R299 F301	K205-R299 WeakPolarHBondContact CB-O 3.4Å; K205-R299 PolarHBondContact N-O 3.4Å; K205-F301 HydrophobicContact CB-CD2 4.42Å; K205-F301 HydrophobicContact CB-CE1 4.5Å; K205-F301 HydrophobicContact CB-CE2 3.78Å; K205-F301 HydrophobicContact CB-CZ 3.83Å
206	D	92.1	Very high	93.6	Very high	139 Å²	139	52 Å²	52	74%	0.743	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	1.5	-178.8	59.4	-38	0	0	0	113.4	P204 D208	P204-D206 WeakPolarHBondContact CB-OD1 3.35Å; P204-D206 PolarHBondContact O-N 2.91Å; P204-D206 VanDerWaalsContact O-N 3.14Å; D206-D208 PolarHBondContact O-N 3.16Å
207	Y	93.2	Very high	93.6	Very high	65 Å²	65	52.6 Å²	52.6	26%	0.255	27%	0.274	S	S	.	.	S	Bend	trans	-64.9	131.3	175	-175.8	-98.6	0	0	0	111.5	V200 S203 P204 T209 N211 F215	V200-Y207 HydrophobicContact CG2-CD1 3.95Å; V200-Y207 HydrophobicContact CG2-CE1 3.89Å; S203-Y207 WeakPolarHBondContact OG-CB 3.24Å; P204-Y207 VanDerWaalsContact O-CB 3.23Å; P204-Y207 WeakPolarHBondContact O-CB 3.48Å; P204-Y207 PolarHBondContact O-N 3.22Å; Y207-T209 PolarHBondContact O-N 3.44Å; Y207-T209 VanDerWaalsContact O-N 3.14Å; Y207-N211 PolarHBondContact OH-O 3.09Å; Y207-F215 HydrophobicContact CD1-CD2 4.27Å; Y207-F215 HydrophobicContact CD2-CD2 4.08Å; Y207-F215 HydrophobicContact CE1-CB 3.96Å; Y207-F215 AromaticContact CE1-CD2 3.93Å; Y207-F215 HydrophobicContact CE1-CD2 3.93Å; Y207-F215 HydrophobicContact CE1-CG 4.31Å; Y207-F215 AromaticContact CE2-CD2 3.76Å; Y207-F215 HydrophobicContact CE2-CD2 3.76Å; Y207-F215 HydrophobicContact CG-CD2 4.33Å; Y207-F215 AromaticContact CZ-CD2 3.69Å; Y207-F215 WeakPolarHBondContact OH-CA 3.06Å; Y207-F215 WeakPolarHBondContact OH-CB 3.1Å; Y207-F215 PolarHBondContact OH-N 3.15Å
208	D	88.3	Confident	93.6	Very high	93 Å²	93	54.8 Å²	54.8	50%	0.497	29%	0.291	S	S	.	.			trans	-68	107.6	175.1	178.4	12.8	0	0	0	111.4	D206 E210	D206-D208 PolarHBondContact O-N 3.16Å; D208-E210 PolarHBondContact O-N 3.23Å; D208-E210 VanDerWaalsContact OD1-CB 3.29Å; D208-E210 WeakPolarHBondContact OD1-CB 3.32Å; D208-E210 WeakPolarHBondContact OD1-CG 3.4Å; D208-E210 PolarHBondContact OD1-N 3.22Å
209	T	85.4	Confident	93.6	Very high	54 Å²	54	57 Å²	57	33%	0.331	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-80.7	6.1	179.4	56	0	0	0	0	113.7	Y207 N211 I212 M384	Y207-T209 PolarHBondContact O-N 3.44Å; Y207-T209 VanDerWaalsContact O-N 3.14Å; T209-N211 VanDerWaalsContact C-N 3.31Å; T209-I212 WeakPolarHBondContact O-CD1 3.47Å; T209-I212 WeakPolarHBondContact O-CG1 3.43Å; T209-M384 HydrophobicContact CG2-CE 4.45Å
210	E	82.6	Confident	93.6	Very high	181 Å²	181	63.3 Å²	63.3	85%	0.846	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-73.1	-25.8	170.9	-65.3	-173.3	178.8	0	0	111.8	D208	D208-E210 PolarHBondContact O-N 3.23Å; D208-E210 VanDerWaalsContact OD1-CB 3.29Å; D208-E210 WeakPolarHBondContact OD1-CB 3.32Å; D208-E210 WeakPolarHBondContact OD1-CG 3.4Å; D208-E210 PolarHBondContact OD1-N 3.22Å
211	N	84.2	Confident	93.6	Very high	89 Å²	89	65.2 Å²	65.2	48%	0.476	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-116.6	55.7	179.3	-165.5	0.4	0	0	0	113.5	Y207 T209 A213 A214	Y207-N211 PolarHBondContact OH-O 3.09Å; T209-N211 VanDerWaalsContact C-N 3.31Å; N211-A213 PolarHBondContact O-N 2.88Å; N211-A214 HydrophobicContact CB-CB 4.49Å; N211-A214 WeakPolarHBondContact ND2-CB 3.48Å; N211-A214 PolarHBondContact O-N 3.34Å; N211-A214 VanDerWaalsContact O-N 3.07Å; N211-A214 WeakPolarHBondContact OD1-CB 3.38Å; N211-A214 PolarHBondContact OD1-N 2.98Å
212	I	88.8	Confident	93.7	Very high	36 Å²	36	65.5 Å²	65.5	19%	0.185	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-56.4	-36.2	-178.8	-58.9	150.9	0	0	0	112.2	V200 T209 A214 F215 Y270 V381	V200-I212 HydrophobicContact CB-CG2 3.86Å; V200-I212 HydrophobicContact CG1-CG2 3.51Å; V200-I212 HydrophobicContact CG2-CG2 4.24Å; T209-I212 WeakPolarHBondContact O-CD1 3.47Å; T209-I212 WeakPolarHBondContact O-CG1 3.43Å; I212-A214 PolarHBondContact O-N 3.11Å; I212-F215 PolarHBondContact O-N 3.41Å; I212-F215 VanDerWaalsContact O-N 3.12Å; I212-Y270 HydrophobicContact CB-CD1 4.34Å; I212-Y270 HydrophobicContact CB-CE1 4.1Å; I212-Y270 HydrophobicContact CG2-CD1 3.89Å; I212-Y270 HydrophobicContact CG2-CE1 4.11Å; I212-V381 HydrophobicContact CD1-CB 4.23Å; I212-V381 HydrophobicContact CD1-CG1 4.25Å; I212-V381 HydrophobicContact CD1-CG2 3.36Å; I212-V381 HydrophobicContact CG1-CG2 3.95Å
213	A	90.6	Very high	93.7	Very high	30 Å²	30	71.1 Å²	71.1	25%	0.248	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-64.7	-20.7	-178.1	0	0	0	0	0	113.2	N211 R216 S269 Y270	N211-A213 PolarHBondContact O-N 2.88Å; A213-R216 PolarHBondContact O-NH1 2.86Å; A213-R216 PolarHBondContact O-NH2 2.95Å; A213-S269 VanDerWaalsContact O-O 3.13Å; A213-Y270 HydrophobicContact CB-CD1 4.17Å; A213-Y270 HydrophobicContact CB-CE1 3.96Å
214	A	93.6	Very high	93.7	Very high	56 Å²	56	74.9 Å²	74.9	46%	0.463	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-85.3	-18.9	176.1	0	0	0	0	0	113.6	N211 I212 R216	N211-A214 HydrophobicContact CB-CB 4.49Å; N211-A214 WeakPolarHBondContact ND2-CB 3.48Å; N211-A214 PolarHBondContact O-N 3.34Å; N211-A214 VanDerWaalsContact O-N 3.07Å; N211-A214 WeakPolarHBondContact OD1-CB 3.38Å; N211-A214 PolarHBondContact OD1-N 2.98Å; I212-A214 PolarHBondContact O-N 3.11Å; A214-R216 PolarHBondContact O-N 3.1Å
215	F	96.6	Very high	93.9	Very high	21 Å²	21	71.5 Å²	71.5	9%	0.092	37%	0.374	C	S	.	.			trans	-65.1	132.8	-178.8	-174.8	-94.8	0	0	0	111.2	T199 V200 Y207 I212 L217	T199-F215 VanDerWaalsContact C-CE1 3.46Å; T199-F215 WeakPolarHBondContact O-CE1 3.5Å; V200-F215 VanDerWaalsContact CA-CD1 3.47Å; V200-F215 HydrophobicContact CB-CB 4.24Å; V200-F215 HydrophobicContact CB-CD1 4.09Å; V200-F215 HydrophobicContact CB-CG 4.16Å; V200-F215 HydrophobicContact CG2-CB 4.21Å; V200-F215 HydrophobicContact CG2-CG 4.18Å; Y207-F215 HydrophobicContact CD1-CD2 4.27Å; Y207-F215 HydrophobicContact CD2-CD2 4.08Å; Y207-F215 HydrophobicContact CE1-CB 3.96Å; Y207-F215 AromaticContact CE1-CD2 3.93Å; Y207-F215 HydrophobicContact CE1-CD2 3.93Å; Y207-F215 HydrophobicContact CE1-CG 4.31Å; Y207-F215 AromaticContact CE2-CD2 3.76Å; Y207-F215 HydrophobicContact CE2-CD2 3.76Å; Y207-F215 HydrophobicContact CG-CD2 4.33Å; Y207-F215 AromaticContact CZ-CD2 3.69Å; Y207-F215 WeakPolarHBondContact OH-CA 3.06Å; Y207-F215 WeakPolarHBondContact OH-CB 3.1Å; Y207-F215 PolarHBondContact OH-N 3.15Å; I212-F215 PolarHBondContact O-N 3.41Å; I212-F215 VanDerWaalsContact O-N 3.12Å; F215-L217 HydrophobicContact CE1-CB 4.39Å; F215-L217 HydrophobicContact CE1-CD1 4.42Å
216	R	97.3	Very high	94.2	Very high	112 Å²	112	67.6 Å²	67.6	42%	0.423	36%	0.359	S	S	.	.			trans	-131	134.1	171.7	-63.9	-66.8	178.2	-84.9	-1	109.3	A213 A214 A218 S269 E271	A213-R216 PolarHBondContact O-NH1 2.86Å; A213-R216 PolarHBondContact O-NH2 2.95Å; A214-R216 PolarHBondContact O-N 3.1Å; R216-A218 PolarHBondContact O-N 2.83Å; R216-S269 PolarHBondContact NH2-O 2.93Å; R216-E271 WeakPolarHBondContact CA-OE2 3.27Å; R216-E271 WeakPolarHBondContact CD-OE1 3.35Å
217	L	98.1	Very high	94.5	Very high	17 Å²	17	66.9 Å²	66.9	9%	0.089	35%	0.351	C	S	.	.			trans	-74.5	120	-177.7	-172.9	61.5	0	0	0	109.9	T199 F202 F215 T221 L222 E271	T199-L217 HydrophobicContact CG2-CB 4.14Å; T199-L217 HydrophobicContact CG2-CD2 4.19Å; F202-L217 HydrophobicContact CB-CD1 3.76Å; F202-L217 HydrophobicContact CD2-CD1 4.23Å; F202-L217 HydrophobicContact CD2-CD2 4.14Å; F202-L217 HydrophobicContact CG-CD1 4.44Å; F215-L217 HydrophobicContact CE1-CB 4.39Å; F215-L217 HydrophobicContact CE1-CD1 4.42Å; L217-T221 HydrophobicContact CD1-CG2 3.72Å; L217-L222 HydrophobicContact CD2-CB 3.99Å; L217-L222 HydrophobicContact CD2-CD1 4.06Å; L217-L222 HydrophobicContact CD2-CG 4.49Å; L217-L222 HydrophobicContact CG-CB 4.35Å; L217-E271 WeakPolarHBondContact CB-OE2 3.36Å; L217-E271 PolarHBondContact N-OE2 3.44Å
218	A	98.1	Very high	94.7	Very high	45 Å²	45	63.9 Å²	63.9	37%	0.372	34%	0.34	S	S	.	.			trans	-68.2	144.9	172	0	0	0	0	0	110.9	R216 E220 T221 L222	R216-A218 PolarHBondContact O-N 2.83Å; A218-E220 PolarHBondContact O-N 3.25Å; A218-T221 WeakPolarHBondContact O-CB 3.47Å; A218-T221 PolarHBondContact O-N 3.12Å; A218-T221 VanDerWaalsContact O-N 3.13Å; A218-L222 PolarHBondContact O-N 2.99Å
219	A	98.3	Very high	95.2	Very high	55 Å²	55	59.5 Å²	59.5	46%	0.455	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-35.9	-179.1	0	0	0	0	0	111.8	T221 L222 Q223	A219-T221 VanDerWaalsContact C-N 3.35Å; A219-T221 PolarHBondContact O-N 3.08Å; A219-L222 PolarHBondContact O-N 2.91Å; A219-Q223 WeakPolarHBondContact O-CG 3.47Å; A219-Q223 PolarHBondContact O-N 3.33Å
220	E	98.3	Very high	95.9	Very high	133 Å²	133	59.5 Å²	59.5	62%	0.621	32%	0.322	S	S	*	.	H	α-helix	trans	-64.5	-40.2	177.4	-59.7	73.4	-160.4	0	0	111.1	A218 Q223 K224	A218-E220 PolarHBondContact O-N 3.25Å; E220-Q223 PolarHBondContact O-N 3.33Å; E220-K224 PolarHBondContact O-N 3.43Å
221	T	98.6	Very high	96.6	Very high	42 Å²	42	54.4 Å²	54.4	26%	0.258	30%	0.3	S	S	.	.	H	α-helix	trans	-66.3	-42.2	174.8	-51.8	0	0	0	0	110.8	F202 L217 A218 A219 Q223 K224 V225 I298	F202-T221 HydrophobicContact CB-CG2 4.28Å; L217-T221 HydrophobicContact CD1-CG2 3.72Å; A218-T221 WeakPolarHBondContact O-CB 3.47Å; A218-T221 PolarHBondContact O-N 3.12Å; A218-T221 VanDerWaalsContact O-N 3.13Å; A219-T221 VanDerWaalsContact C-N 3.35Å; A219-T221 PolarHBondContact O-N 3.08Å; T221-Q223 VanDerWaalsContact C-N 3.33Å; T221-Q223 PolarHBondContact O-N 3.33Å; T221-K224 PolarHBondContact O-N 2.93Å; T221-V225 VanDerWaalsContact O-CG2 3.27Å; T221-V225 WeakPolarHBondContact O-CG2 3.43Å; T221-V225 PolarHBondContact O-N 3.01Å; T221-I298 HydrophobicContact CG2-CG2 3.94Å
222	L	98.8	Very high	97.3	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-40.1	175.5	179.6	61.1	0	0	0	112.1	L217 A218 A219 V225 N226 C261	L217-L222 HydrophobicContact CD2-CB 3.99Å; L217-L222 HydrophobicContact CD2-CD1 4.06Å; L217-L222 HydrophobicContact CD2-CG 4.49Å; L217-L222 HydrophobicContact CG-CB 4.35Å; A218-L222 PolarHBondContact O-N 2.99Å; A219-L222 PolarHBondContact O-N 2.91Å; L222-V225 WeakPolarHBondContact O-CB 3.14Å; L222-V225 PolarHBondContact O-N 2.96Å; L222-N226 WeakPolarHBondContact O-CB 3.4Å; L222-N226 PolarHBondContact O-N 2.78Å; L222-N226 PolarHBondContact O-ND2 2.81Å; L222-C261 HydrophobicContact CD1-CB 3.83Å
223	Q	98.6	Very high	97.8	Very high	122 Å²	122	55 Å²	55	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-59.8	-46.3	173.8	-73.8	174.7	6.8	0	0	111.1	A219 E220 T221 N226 Q227	A219-Q223 WeakPolarHBondContact O-CG 3.47Å; A219-Q223 PolarHBondContact O-N 3.33Å; E220-Q223 PolarHBondContact O-N 3.33Å; T221-Q223 VanDerWaalsContact C-N 3.33Å; T221-Q223 PolarHBondContact O-N 3.33Å; Q223-N226 PolarHBondContact O-N 2.98Å; Q223-Q227 WeakPolarHBondContact O-CG 3.43Å; Q223-Q227 PolarHBondContact O-N 2.85Å
224	K	98.6	Very high	98.2	Very high	78 Å²	78	54.5 Å²	54.5	34%	0.339	30%	0.295	S	S	.	.	H	α-helix	trans	-61.9	-43.6	176.3	-171.2	175.8	178.7	163.6	0	112.4	E220 T221 N226 Q227 L228 I298 E304	E220-K224 PolarHBondContact O-N 3.43Å; T221-K224 PolarHBondContact O-N 2.93Å; K224-N226 VanDerWaalsContact C-N 3.29Å; K224-N226 PolarHBondContact O-N 3.36Å; K224-Q227 WeakPolarHBondContact O-CB 3.5Å; K224-Q227 PolarHBondContact O-N 3.13Å; K224-L228 WeakPolarHBondContact O-CG 3.45Å; K224-L228 PolarHBondContact O-N 2.77Å; K224-L228 VanDerWaalsContact O-N 3.08Å; K224-I298 HydrophobicContact CB-CD1 4.09Å; K224-I298 HydrophobicContact CD-CD1 3.88Å; K224-I298 HydrophobicContact CG-CD1 3.68Å; K224-E304 WeakPolarHBondContact CE-OE1 3.49Å; K224-E304 IonicContact NZ-OE1 2.72Å; K224-E304 PolarHBondContact NZ-OE1 3.05Å
225	V	98.8	Very high	98.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-55.1	-46.5	173.7	167.8	0	0	0	0	110.5	F202 T221 L222 L228 F229 C261 V294 I298	F202-V225 HydrophobicContact CD1-CG2 3.72Å; F202-V225 HydrophobicContact CD2-CG2 4.28Å; F202-V225 HydrophobicContact CE1-CG1 4.08Å; F202-V225 HydrophobicContact CE1-CG2 3.9Å; F202-V225 HydrophobicContact CE2-CG1 4.37Å; F202-V225 HydrophobicContact CE2-CG2 4.42Å; F202-V225 HydrophobicContact CG-CG2 3.92Å; F202-V225 HydrophobicContact CZ-CG1 3.88Å; F202-V225 HydrophobicContact CZ-CG2 4.24Å; T221-V225 VanDerWaalsContact O-CG2 3.27Å; T221-V225 WeakPolarHBondContact O-CG2 3.43Å; T221-V225 PolarHBondContact O-N 3.01Å; L222-V225 WeakPolarHBondContact O-CB 3.14Å; L222-V225 PolarHBondContact O-N 2.96Å; V225-L228 PolarHBondContact O-N 3.5Å; V225-F229 HydrophobicContact CG1-CD2 3.61Å; V225-F229 HydrophobicContact CG1-CE2 3.31Å; V225-F229 HydrophobicContact CG1-CZ 4.27Å; V225-F229 WeakPolarHBondContact O-CD2 3.43Å; V225-F229 PolarHBondContact O-N 2.88Å; V225-C261 HydrophobicContact CG1-CB 3.88Å; V225-V294 HydrophobicContact CG1-CG1 4.5Å; V225-I298 HydrophobicContact CG2-CD1 3.77Å; V225-I298 HydrophobicContact CG2-CG1 3.78Å; V225-I298 HydrophobicContact CG2-CG2 4.31Å
226	N	98.8	Very high	98.5	Very high	46 Å²	46	56.2 Å²	56.2	25%	0.246	30%	0.298	C	S	.	.	H	α-helix	trans	-68.1	-35.8	179.6	-85.1	-46	0	0	0	113.4	L222 Q223 K224 F229 A230 S260 C261	L222-N226 WeakPolarHBondContact O-CB 3.4Å; L222-N226 PolarHBondContact O-N 2.78Å; L222-N226 PolarHBondContact O-ND2 2.81Å; Q223-N226 PolarHBondContact O-N 2.98Å; K224-N226 VanDerWaalsContact C-N 3.29Å; K224-N226 PolarHBondContact O-N 3.36Å; N226-F229 PolarHBondContact O-N 2.84Å; N226-A230 WeakPolarHBondContact O-CB 3.1Å; N226-A230 PolarHBondContact O-N 2.78Å; N226-S260 WeakPolarHBondContact OD1-CA 3.5Å; N226-S260 WeakPolarHBondContact OD1-CB 3.47Å; N226-C261 PolarHBondContact ND2-O 3.09Å; N226-C261 PolarHBondContact OD1-N 3.04Å; N226-C261 PolarHBondContact OD1-O 3.39Å
227	Q	98.7	Very high	98.5	Very high	124 Å²	124	51.8 Å²	51.8	58%	0.579	28%	0.283	S	S	*	.	H	α-helix	trans	-59.9	-45.8	172.3	-72	168.1	-0.9	0	0	111.2	Q223 K224 A230 L231	Q223-Q227 WeakPolarHBondContact O-CG 3.43Å; Q223-Q227 PolarHBondContact O-N 2.85Å; K224-Q227 WeakPolarHBondContact O-CB 3.5Å; K224-Q227 PolarHBondContact O-N 3.13Å; Q227-A230 WeakPolarHBondContact O-CB 3.45Å; Q227-A230 PolarHBondContact O-N 2.86Å; Q227-L231 PolarHBondContact O-N 2.85Å
228	L	98.8	Very high	98.6	Very high	2 Å²	2	51 Å²	51	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-41.2	177.9	-65.9	174.1	0	0	0	112.6	K224 V225 A230 L231 V294 V297 I298 E304 M307	K224-L228 WeakPolarHBondContact O-CG 3.45Å; K224-L228 PolarHBondContact O-N 2.77Å; K224-L228 VanDerWaalsContact O-N 3.08Å; V225-L228 PolarHBondContact O-N 3.5Å; L228-A230 VanDerWaalsContact C-N 3.29Å; L228-A230 PolarHBondContact O-N 2.72Å; L228-L231 HydrophobicContact CD2-CD1 4.22Å; L228-L231 WeakPolarHBondContact O-CB 3.26Å; L228-L231 PolarHBondContact O-N 2.98Å; L228-V294 HydrophobicContact CB-CG1 4.06Å; L228-V294 HydrophobicContact CB-CG2 4.08Å; L228-V294 HydrophobicContact CD1-CG1 4.12Å; L228-V297 HydrophobicContact CD1-CB 4.15Å; L228-V297 HydrophobicContact CD1-CG1 3.65Å; L228-V297 HydrophobicContact CD2-CG1 4.37Å; L228-I298 HydrophobicContact CD1-CD1 3.67Å; L228-I298 HydrophobicContact CD1-CG1 3.83Å; L228-E304 HydrophobicContact CD2-CG 4.17Å; L228-M307 HydrophobicContact CD2-CG 4.24Å
229	F	98.7	Very high	98.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-34	175.4	-76.6	-42.3	0	0	0	112.9	V225 N226 L231 Y232 M259 C261 I275 I291 V294	V225-F229 HydrophobicContact CG1-CD2 3.61Å; V225-F229 HydrophobicContact CG1-CE2 3.31Å; V225-F229 HydrophobicContact CG1-CZ 4.27Å; V225-F229 WeakPolarHBondContact O-CD2 3.43Å; V225-F229 PolarHBondContact O-N 2.88Å; N226-F229 PolarHBondContact O-N 2.84Å; F229-L231 PolarHBondContact O-N 2.79Å; F229-Y232 HydrophobicContact CD1-CD2 4.21Å; F229-Y232 HydrophobicContact CD1-CE2 4.2Å; F229-Y232 PolarHBondContact O-N 3.49Å; F229-M259 HydrophobicContact CB-CB 4.25Å; F229-M259 HydrophobicContact CB-CG 3.99Å; F229-M259 HydrophobicContact CD1-CE 3.5Å; F229-M259 VanDerWaalsContact CD1-CE 3.5Å; F229-M259 HydrophobicContact CD1-CG 3.92Å; F229-M259 HydrophobicContact CD1-SD 3.67Å; F229-M259 HydrophobicContact CE1-CE 3.43Å; F229-M259 VanDerWaalsContact CE1-CE 3.43Å; F229-M259 HydrophobicContact CE1-SD 4.23Å; F229-M259 HydrophobicContact CG-CE 4.37Å; F229-M259 HydrophobicContact CG-CG 4.01Å; F229-M259 HydrophobicContact CG-SD 4.36Å; F229-M259 HydrophobicContact CZ-CE 4.22Å; F229-C261 HydrophobicContact CD2-CB 4.27Å; F229-C261 HydrophobicContact CE2-CB 4.11Å; F229-I275 HydrophobicContact CD2-CG2 4.4Å; F229-I275 HydrophobicContact CE1-CG2 4.48Å; F229-I275 HydrophobicContact CE2-CD1 3.96Å; F229-I275 HydrophobicContact CE2-CG1 3.91Å; F229-I275 HydrophobicContact CE2-CG2 3.93Å; F229-I275 HydrophobicContact CZ-CD1 3.67Å; F229-I275 HydrophobicContact CZ-CG1 4.12Å; F229-I275 HydrophobicContact CZ-CG2 4Å; F229-I291 HydrophobicContact CE1-CG1 4.42Å; F229-V294 HydrophobicContact CD1-CB 4.29Å; F229-V294 HydrophobicContact CD1-CG1 4.31Å; F229-V294 HydrophobicContact CD1-CG2 3.75Å; F229-V294 HydrophobicContact CE1-CB 3.69Å; F229-V294 HydrophobicContact CE1-CG1 3.84Å; F229-V294 HydrophobicContact CE1-CG2 3.59Å; F229-V294 HydrophobicContact CE2-CG1 4.29Å; F229-V294 HydrophobicContact CZ-CB 4.06Å; F229-V294 HydrophobicContact CZ-CG1 3.82Å; F229-V294 HydrophobicContact CZ-CG2 4.41Å
230	A	98.5	Very high	98.6	Very high	55 Å²	55	46.5 Å²	46.5	46%	0.455	24%	0.241	S	C	.	.	H	α-helix	trans	-61.9	-29.2	177	0	0	0	0	0	112.7	N226 Q227 L228 Y232 K233	N226-A230 WeakPolarHBondContact O-CB 3.1Å; N226-A230 PolarHBondContact O-N 2.78Å; Q227-A230 WeakPolarHBondContact O-CB 3.45Å; Q227-A230 PolarHBondContact O-N 2.86Å; L228-A230 VanDerWaalsContact C-N 3.29Å; L228-A230 PolarHBondContact O-N 2.72Å; A230-Y232 PolarHBondContact O-N 2.82Å; A230-K233 WeakPolarHBondContact O-CB 3.35Å; A230-K233 PolarHBondContact O-N 3.33Å
231	L	98.6	Very high	98.6	Very high	74 Å²	74	40.2 Å²	40.2	39%	0.387	21%	0.211	S	C	.	.	H	α-helix	trans	-62.2	-27.1	177.6	-56.7	177.8	0	0	0	112.9	Q227 L228 F229 K233 H236 M307 W311	Q227-L231 PolarHBondContact O-N 2.85Å; L228-L231 HydrophobicContact CD2-CD1 4.22Å; L228-L231 WeakPolarHBondContact O-CB 3.26Å; L228-L231 PolarHBondContact O-N 2.98Å; F229-L231 PolarHBondContact O-N 2.79Å; L231-K233 PolarHBondContact O-N 3.11Å; L231-H236 PolarHBondContact O-NE2 2.99Å; L231-M307 HydrophobicContact CD1-CB 4.21Å; L231-M307 HydrophobicContact CD1-CG 4.44Å; L231-W311 HydrophobicContact CB-CH2 3.89Å
232	Y	98.8	Very high	98.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.8	176.5	-72.5	-57.4	0	0	0	113.8	F229 A230 H236 F238 F241 I256 M259 M290 V294 M307 W311	F229-Y232 HydrophobicContact CD1-CD2 4.21Å; F229-Y232 HydrophobicContact CD1-CE2 4.2Å; F229-Y232 PolarHBondContact O-N 3.49Å; A230-Y232 PolarHBondContact O-N 2.82Å; Y232-H236 PolarHBondContact O-CD2 3.22Å; Y232-H236 VanDerWaalsContact O-CD2 3.31Å; Y232-F238 AromaticContact CD1-CE1 3.77Å; Y232-F238 HydrophobicContact CD1-CE1 3.77Å; Y232-F238 HydrophobicContact CD1-CZ 4.1Å; Y232-F238 HydrophobicContact CE1-CE1 4.18Å; Y232-F241 AromaticContact CE1-CE1 3.81Å; Y232-F241 HydrophobicContact CE1-CE1 3.81Å; Y232-F241 AromaticContact CE1-CZ 3.71Å; Y232-F241 HydrophobicContact CE1-CZ 3.71Å; Y232-F241 AromaticContact CZ-CE1 3.97Å; Y232-F241 WeakPolarHBondContact OH-CE1 3.44Å; Y232-I256 VanDerWaalsContact O-CB 3.31Å; Y232-I256 WeakPolarHBondContact O-CB 3.22Å; Y232-M259 HydrophobicContact CD2-SD 3.79Å; Y232-M259 HydrophobicContact CE2-SD 4.43Å; Y232-M290 HydrophobicContact CD1-CE 3.82Å; Y232-M290 HydrophobicContact CD1-CG 4.29Å; Y232-M290 HydrophobicContact CD2-CB 4.38Å; Y232-M290 HydrophobicContact CD2-CE 3.76Å; Y232-M290 HydrophobicContact CE1-CB 4.29Å; Y232-M290 HydrophobicContact CE1-CE 4.39Å; Y232-M290 HydrophobicContact CE1-CG 3.97Å; Y232-M290 HydrophobicContact CE2-CB 3.82Å; Y232-M290 HydrophobicContact CE2-CE 4.32Å; Y232-M290 HydrophobicContact CE2-CG 4.33Å; Y232-M290 HydrophobicContact CG-CE 3.49Å; Y232-M290 VanDerWaalsContact CG-CE 3.49Å; Y232-M290 WeakPolarHBondContact OH-CA 3.45Å; Y232-M290 PolarHBondContact OH-O 2.92Å; Y232-V294 HydrophobicContact CE2-CG2 3.79Å; Y232-M307 HydrophobicContact CD2-CE 4.44Å; Y232-M307 HydrophobicContact CE1-CE 4.05Å; Y232-M307 HydrophobicContact CE2-CE 3.73Å; Y232-M307 VanDerWaalsContact CZ-CE 3.49Å; Y232-M307 WeakPolarHBondContact OH-CE 3.47Å; Y232-W311 AromaticContact CD1-CZ2 3.61Å; Y232-W311 HydrophobicContact CD1-CZ2 3.61Å; Y232-W311 AromaticContact CE1-CZ2 3.82Å; Y232-W311 HydrophobicContact CE1-CZ2 3.82Å
233	K	98.6	Very high	98.2	Very high	136 Å²	136	41.3 Å²	41.3	59%	0.591	22%	0.221	S	C	*	.			trans	-60.6	139.8	-179.6	-175.9	176.3	176.1	-177.2	0	110.4	A230 L231 H236	A230-K233 WeakPolarHBondContact O-CB 3.35Å; A230-K233 PolarHBondContact O-N 3.33Å; L231-K233 PolarHBondContact O-N 3.11Å; K233-H236 PolarHBondContact O-NE2 2.94Å; K233-H236 VanDerWaalsContact O-NE2 3.15Å
234	G	98.5	Very high	97.9	Very high	20 Å²	20	44.8 Å²	44.8	21%	0.206	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	102.6	-164.2	-177.6	0	0	0	0	0	112.9	Y255 I256	G234-Y255 VanDerWaalsContact C-CD2 3.47Å; G234-Y255 WeakPolarHBondContact O-CA 3.5Å; G234-Y255 WeakPolarHBondContact O-CD2 3.37Å; G234-I256 PolarHBondContact N-O 2.92Å; G234-I256 PolarHBondContact O-N 3.14Å
235	T	98.5	Very high	97.7	Very high	70 Å²	70	43.9 Å²	43.9	43%	0.429	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	111.8	-179.1	-58.1	0	0	0	0	110.1	R253 R254 Y255	T235-R253 HydrophobicContact CG2-CB 4.43Å; T235-R254 WeakPolarHBondContact CA-O 3.36Å; T235-Y255 WeakPolarHBondContact OG1-CD2 3.37Å
236	H	98.5	Very high	97.5	Very high	43 Å²	43	46.1 Å²	46.1	20%	0.199	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	166.8	177.9	-58.4	-66.3	0	0	0	111.5	L231 Y232 K233 F238 R253 R254 W311	L231-H236 PolarHBondContact O-NE2 2.99Å; Y232-H236 PolarHBondContact O-CD2 3.22Å; Y232-H236 VanDerWaalsContact O-CD2 3.31Å; K233-H236 PolarHBondContact O-NE2 2.94Å; K233-H236 VanDerWaalsContact O-NE2 3.15Å; H236-F238 HydrophobicContact CB-CD2 4.09Å; H236-F238 HydrophobicContact CB-CE2 3.64Å; H236-F238 HydrophobicContact CB-CZ 4.13Å; H236-F238 WeakPolarHBondContact O-CD2 3.23Å; H236-R253 VanDerWaalsContact O-CA 3.3Å; H236-R253 WeakPolarHBondContact O-CA 3.38Å; H236-R254 PolarHBondContact N-O 2.91Å; H236-R254 VanDerWaalsContact N-O 3.15Å; H236-R254 PolarHBondContact O-N 2.92Å; H236-W311 HydrophobicContact CB-CD2 4.18Å; H236-W311 HydrophobicContact CB-CG 3.9Å
237	N	98.3	Very high	97.3	Very high	19 Å²	19	45 Å²	45	10%	0.102	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	106.5	172.1	-171.1	-11.6	0	0	0	110.2	H239 P247 A252	N237-H239 VanDerWaalsContact C-N 3.32Å; N237-H239 PolarHBondContact O-N 3.37Å; N237-H239 PolarHBondContact OD1-N 3.18Å; N237-P247 PolarHBondContact ND2-O 3.31Å; N237-A252 VanDerWaalsContact OD1-CB 3.28Å; N237-A252 WeakPolarHBondContact OD1-CB 3.26Å
238	F	98.6	Very high	97.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.253	C	S	.	.			trans	-93.6	26.6	-173.9	-76.1	-91	0	0	0	113.2	Y232 H236 N240 F241 A252 R254 I256 M283 Q286 M290	Y232-F238 AromaticContact CD1-CE1 3.77Å; Y232-F238 HydrophobicContact CD1-CE1 3.77Å; Y232-F238 HydrophobicContact CD1-CZ 4.1Å; Y232-F238 HydrophobicContact CE1-CE1 4.18Å; H236-F238 HydrophobicContact CB-CD2 4.09Å; H236-F238 HydrophobicContact CB-CE2 3.64Å; H236-F238 HydrophobicContact CB-CZ 4.13Å; H236-F238 WeakPolarHBondContact O-CD2 3.23Å; F238-N240 VanDerWaalsContact C-N 3.31Å; F238-N240 PolarHBondContact O-N 3.34Å; F238-F241 HydrophobicContact CB-CB 4.14Å; F238-F241 HydrophobicContact CB-CD2 4.19Å; F238-F241 HydrophobicContact CD1-CB 3.95Å; F238-F241 HydrophobicContact CD1-CD1 4.42Å; F238-F241 AromaticContact CD1-CD2 3.57Å; F238-F241 HydrophobicContact CD1-CD2 3.57Å; F238-F241 HydrophobicContact CD1-CE2 4.15Å; F238-F241 AromaticContact CD1-CG 3.71Å; F238-F241 HydrophobicContact CD1-CG 3.71Å; F238-F241 HydrophobicContact CE1-CD2 4.4Å; F238-F241 HydrophobicContact CG-CD2 4.25Å; F238-F241 WeakPolarHBondContact O-CA 3.37Å; F238-F241 WeakPolarHBondContact O-CB 3.35Å; F238-F241 PolarHBondContact O-N 3.4Å; F238-A252 PolarHBondContact N-O 2.83Å; F238-R254 HydrophobicContact CD2-CB 3.64Å; F238-R254 HydrophobicContact CD2-CG 4.41Å; F238-R254 HydrophobicContact CE2-CB 4.05Å; F238-R254 HydrophobicContact CG-CB 4.41Å; F238-I256 HydrophobicContact CE2-CG1 4.13Å; F238-I256 HydrophobicContact CZ-CD1 4.37Å; F238-I256 HydrophobicContact CZ-CG1 3.68Å; F238-M283 HydrophobicContact CB-CE 3.5Å; F238-M283 VanDerWaalsContact O-CE 3.28Å; F238-M283 WeakPolarHBondContact O-CE 3.49Å; F238-Q286 HydrophobicContact CB-CG 4.46Å; F238-Q286 HydrophobicContact CD1-CG 4.1Å; F238-Q286 HydrophobicContact CG-CG 4.45Å; F238-M290 HydrophobicContact CD1-CG 4.31Å; F238-M290 HydrophobicContact CD1-SD 4.29Å; F238-M290 HydrophobicContact CE1-CE 3.95Å; F238-M290 HydrophobicContact CE1-CG 3.93Å; F238-M290 HydrophobicContact CE1-SD 3.75Å; F238-M290 HydrophobicContact CZ-CE 4.31Å
239	H	98.2	Very high	97	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-60	-36.4	-175.8	76	92.9	0	0	0	113.4	N237 F241 K245 A252 G312 E314 K315	N237-H239 VanDerWaalsContact C-N 3.32Å; N237-H239 PolarHBondContact O-N 3.37Å; N237-H239 PolarHBondContact OD1-N 3.18Å; H239-F241 VanDerWaalsContact C-N 3.26Å; H239-F241 PolarHBondContact O-N 3.36Å; H239-K245 HydrophobicContact CB-CB 4.17Å; H239-A252 HydrophobicContact CB-CB 3.88Å; H239-G312 PolarHBondContact NE2-O 3.43Å; H239-E314 PolarHBondContact CE1-O 2.89Å; H239-K315 PolarHBondContact ND1-NZ 3.15Å
240	N	98.1	Very high	96.8	Very high	6 Å²	6	50.7 Å²	50.7	3%	0.032	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-71.4	-20.3	174.4	-77.7	-38.1	0	0	0	113.2	F238 T242 K289 S310 E314 K315 V316 V318	F238-N240 VanDerWaalsContact C-N 3.31Å; F238-N240 PolarHBondContact O-N 3.34Å; N240-T242 VanDerWaalsContact C-N 3.26Å; N240-T242 PolarHBondContact O-N 2.88Å; N240-K289 WeakPolarHBondContact O-CD 3.48Å; N240-K289 PolarHBondContact O-NZ 3.08Å; N240-S310 PolarHBondContact ND2-O 3.15Å; N240-E314 PolarHBondContact ND2-O 3.27Å; N240-K315 WeakPolarHBondContact OD1-CA 3.49Å; N240-K315 WeakPolarHBondContact OD1-CD 3.43Å; N240-V316 PolarHBondContact OD1-N 3.2Å; N240-V318 HydrophobicContact CB-CG2 4.1Å
241	F	98.4	Very high	96.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-88.1	10.3	-179.1	-60.8	-93.1	0	0	0	112.9	Y232 F238 H239 Q286 K289 M290 L293 S310 W311 V318	Y232-F241 AromaticContact CE1-CE1 3.81Å; Y232-F241 HydrophobicContact CE1-CE1 3.81Å; Y232-F241 AromaticContact CE1-CZ 3.71Å; Y232-F241 HydrophobicContact CE1-CZ 3.71Å; Y232-F241 AromaticContact CZ-CE1 3.97Å; Y232-F241 WeakPolarHBondContact OH-CE1 3.44Å; F238-F241 HydrophobicContact CB-CB 4.14Å; F238-F241 HydrophobicContact CB-CD2 4.19Å; F238-F241 HydrophobicContact CD1-CB 3.95Å; F238-F241 HydrophobicContact CD1-CD1 4.42Å; F238-F241 AromaticContact CD1-CD2 3.57Å; F238-F241 HydrophobicContact CD1-CD2 3.57Å; F238-F241 HydrophobicContact CD1-CE2 4.15Å; F238-F241 AromaticContact CD1-CG 3.71Å; F238-F241 HydrophobicContact CD1-CG 3.71Å; F238-F241 HydrophobicContact CE1-CD2 4.4Å; F238-F241 HydrophobicContact CG-CD2 4.25Å; F238-F241 WeakPolarHBondContact O-CA 3.37Å; F238-F241 WeakPolarHBondContact O-CB 3.35Å; F238-F241 PolarHBondContact O-N 3.4Å; H239-F241 VanDerWaalsContact C-N 3.26Å; H239-F241 PolarHBondContact O-N 3.36Å; F241-Q286 HydrophobicContact CB-CG 4.07Å; F241-Q286 WeakPolarHBondContact O-CA 3.2Å; F241-Q286 PolarHBondContact O-N 2.71Å; F241-K289 VanDerWaalsContact C-CD 3.45Å; F241-K289 HydrophobicContact CB-CB 4.2Å; F241-K289 HydrophobicContact CD1-CB 3.9Å; F241-M290 HydrophobicContact CD1-CB 4.37Å; F241-M290 HydrophobicContact CD1-CG 3.7Å; F241-M290 HydrophobicContact CE1-CG 4.07Å; F241-M290 HydrophobicContact CG-CG 4.38Å; F241-L293 HydrophobicContact CE1-CB 4.43Å; F241-L293 HydrophobicContact CE1-CD2 3.91Å; F241-L293 HydrophobicContact CZ-CD2 3.74Å; F241-S310 VanDerWaalsContact CE2-OG 3.26Å; F241-S310 WeakPolarHBondContact CE2-OG 3.25Å; F241-S310 WeakPolarHBondContact CZ-OG 3.21Å; F241-W311 AromaticContact CE2-CD1 3.87Å; F241-W311 AromaticContact CE2-NE1 3.73Å; F241-V318 HydrophobicContact CD1-CG1 4.18Å; F241-V318 HydrophobicContact CE1-CG1 4.13Å
242	T	97.1	Very high	96.6	Very high	13 Å²	13	46.8 Å²	46.8	8%	0.08	27%	0.27	C	S	.	.	S	Bend	trans	-142.4	176.1	173.3	-179.5	0	0	0	0	109.3	N240 K245 M283 L284	N240-T242 VanDerWaalsContact C-N 3.26Å; N240-T242 PolarHBondContact O-N 2.88Å; T242-K245 HydrophobicContact CG2-CB 3.72Å; T242-K245 HydrophobicContact CG2-CG 3.44Å; T242-K245 VanDerWaalsContact CG2-CG 3.44Å; T242-M283 HydrophobicContact CG2-CB 4.37Å; T242-M283 HydrophobicContact CG2-CE 3.65Å; T242-M283 HydrophobicContact CG2-SD 3.76Å; T242-L284 WeakPolarHBondContact CB-O 3.38Å; T242-L284 PolarHBondContact OG1-O 3.23Å
243	S	92.8	Very high	96.6	Very high	59 Å²	59	53.3 Å²	53.3	41%	0.413	30%	0.295	S	S	.	.	S	Bend	trans	-93.6	154.5	168.6	-56.8	0	0	0	0	109.9	K245	S243-K245 VanDerWaalsContact C-N 3.34Å; S243-K245 PolarHBondContact O-N 3.24Å
244	Q	92.2	Very high	96.6	Very high	195 Å²	195	49 Å²	49	91%	0.911	28%	0.275	S	S	*	.	S	Bend	trans	57.1	39.8	169.2	-56.5	175.3	2.2	0	0	114.6
245	K	94.3	Very high	96.6	Very high	58 Å²	58	51.8 Å²	51.8	25%	0.252	28%	0.28	S	S	.	.			trans	-125.4	129.1	171	-71	-70.3	170.5	-179.8	0	111.1	H239 T242 S243 D249 S251 A252 M283 K315	H239-K245 HydrophobicContact CB-CB 4.17Å; T242-K245 HydrophobicContact CG2-CB 3.72Å; T242-K245 HydrophobicContact CG2-CG 3.44Å; T242-K245 VanDerWaalsContact CG2-CG 3.44Å; S243-K245 VanDerWaalsContact C-N 3.34Å; S243-K245 PolarHBondContact O-N 3.24Å; K245-D249 HydrophobicContact CD-CB 4.31Å; K245-D249 WeakPolarHBondContact CD-OD2 3.15Å; K245-D249 WeakPolarHBondContact CE-OD2 3.46Å; K245-D249 IonicContact NZ-OD2 3.56Å; K245-D249 PolarHBondContact NZ-OD2 3.24Å; K245-S251 PolarHBondContact NZ-OG 3.12Å; K245-A252 HydrophobicContact CB-CB 4.45Å; K245-M283 HydrophobicContact CG-SD 4.38Å; K245-K315 PolarHBondContact O-NZ 2.86Å
246	A	94.1	Very high	96.6	Very high	47 Å²	47	48.4 Å²	48.4	39%	0.388	26%	0.26	S	S	.	.			trans	-75.9	150.8	170.9	0	0	0	0	0	109.7	S248 D249	A246-S248 PolarHBondContact O-N 3.47Å; A246-D249 WeakPolarHBondContact O-CB 3.38Å; A246-D249 PolarHBondContact O-N 2.69Å; A246-D249 VanDerWaalsContact O-N 3.1Å
247	P	94.6	Very high	96.6	Very high	24 Å²	24	48.4 Å²	48.4	16%	0.156	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.3	173	-19.1	28.5	0	0	0	113.1	N237 D249 Q313	N237-P247 PolarHBondContact ND2-O 3.31Å; P247-D249 VanDerWaalsContact C-N 3.33Å; P247-Q313 VanDerWaalsContact CB-OE1 3.28Å; P247-Q313 WeakPolarHBondContact CG-O 3.35Å
248	S	95.3	Very high	96.5	Very high	100 Å²	100	52.8 Å²	52.8	70%	0.699	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-8.3	178.6	54.4	0	0	0	0	114.4	A246 P250	A246-S248 PolarHBondContact O-N 3.47Å; S248-P250 VanDerWaalsContact O-CD 3.26Å; S248-P250 WeakPolarHBondContact O-CD 3.46Å
249	D	95.9	Very high	96.5	Very high	41 Å²	41	53.3 Å²	53.3	22%	0.219	29%	0.285	C	S	.	.			trans	-71.6	113.4	-177.2	-174.5	-22.3	0	0	0	110.1	K245 A246 P247 S251 A252	K245-D249 HydrophobicContact CD-CB 4.31Å; K245-D249 WeakPolarHBondContact CD-OD2 3.15Å; K245-D249 WeakPolarHBondContact CE-OD2 3.46Å; K245-D249 IonicContact NZ-OD2 3.56Å; K245-D249 PolarHBondContact NZ-OD2 3.24Å; A246-D249 WeakPolarHBondContact O-CB 3.38Å; A246-D249 PolarHBondContact O-N 2.69Å; A246-D249 VanDerWaalsContact O-N 3.1Å; P247-D249 VanDerWaalsContact C-N 3.33Å; D249-S251 PolarHBondContact O-N 2.7Å; D249-S251 VanDerWaalsContact O-N 3.12Å; D249-S251 WeakPolarHBondContact OD1-CA 3.43Å; D249-S251 VanDerWaalsContact OD1-CB 3.23Å; D249-S251 WeakPolarHBondContact OD1-CB 3.41Å; D249-S251 PolarHBondContact OD1-N 2.83Å; D249-S251 PolarHBondContact OD1-OG 2.86Å; D249-S251 PolarHBondContact OD2-OG 2.88Å; D249-A252 VanDerWaalsContact O-CB 3.3Å; D249-A252 WeakPolarHBondContact O-CB 3.45Å; D249-A252 PolarHBondContact O-N 2.73Å
250	P	95.1	Very high	96.6	Very high	103 Å²	103	55.1 Å²	55.1	67%	0.669	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-63.3	-24.6	-178.1	26.8	-35	0	0	0	112.1	S248 A252 R253	S248-P250 VanDerWaalsContact O-CD 3.26Å; S248-P250 WeakPolarHBondContact O-CD 3.46Å; P250-A252 PolarHBondContact O-N 2.65Å; P250-R253 WeakPolarHBondContact O-CB 3.37Å; P250-R253 PolarHBondContact O-N 2.82Å; P250-R253 VanDerWaalsContact O-N 3.16Å
251	S	96	Very high	96.6	Very high	47 Å²	47	55.1 Å²	55.1	33%	0.329	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-74.3	1.7	174.8	78.7	0	0	0	0	113.3	K245 D249 R254	K245-S251 PolarHBondContact NZ-OG 3.12Å; D249-S251 PolarHBondContact O-N 2.7Å; D249-S251 VanDerWaalsContact O-N 3.12Å; D249-S251 WeakPolarHBondContact OD1-CA 3.43Å; D249-S251 VanDerWaalsContact OD1-CB 3.23Å; D249-S251 WeakPolarHBondContact OD1-CB 3.41Å; D249-S251 PolarHBondContact OD1-N 2.83Å; D249-S251 PolarHBondContact OD1-OG 2.86Å; D249-S251 PolarHBondContact OD2-OG 2.88Å; S251-R254 PolarHBondContact O-NH1 2.89Å; S251-R254 PolarHBondContact O-NH2 2.85Å
252	A	97.1	Very high	96.6	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-87.7	-12.6	167.4	0	0	0	0	0	113	N237 F238 H239 K245 D249 P250 R254 M283	N237-A252 VanDerWaalsContact OD1-CB 3.28Å; N237-A252 WeakPolarHBondContact OD1-CB 3.26Å; F238-A252 PolarHBondContact N-O 2.83Å; H239-A252 HydrophobicContact CB-CB 3.88Å; K245-A252 HydrophobicContact CB-CB 4.45Å; D249-A252 VanDerWaalsContact O-CB 3.3Å; D249-A252 WeakPolarHBondContact O-CB 3.45Å; D249-A252 PolarHBondContact O-N 2.73Å; P250-A252 PolarHBondContact O-N 2.65Å; A252-R254 PolarHBondContact O-N 3.09Å; A252-M283 HydrophobicContact CB-CE 4.34Å; A252-M283 HydrophobicContact CB-SD 4.47Å
253	R	98.1	Very high	96.7	Very high	137 Å²	137	63.2 Å²	63.2	52%	0.517	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	124.8	176.7	-61.9	-174.8	71.7	94.7	2.1	110.8	T235 H236 P250	T235-R253 HydrophobicContact CG2-CB 4.43Å; H236-R253 VanDerWaalsContact O-CA 3.3Å; H236-R253 WeakPolarHBondContact O-CA 3.38Å; P250-R253 WeakPolarHBondContact O-CB 3.37Å; P250-R253 PolarHBondContact O-N 2.82Å; P250-R253 VanDerWaalsContact O-N 3.16Å
254	R	98.4	Very high	96.9	Very high	47 Å²	47	62.2 Å²	62.2	18%	0.177	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.3	179.7	-65.3	-68.9	-179	-83.8	-7.4	110.5	T235 H236 F238 S251 A252 S281 M283	T235-R254 WeakPolarHBondContact CA-O 3.36Å; H236-R254 PolarHBondContact N-O 2.91Å; H236-R254 VanDerWaalsContact N-O 3.15Å; H236-R254 PolarHBondContact O-N 2.92Å; F238-R254 HydrophobicContact CD2-CB 3.64Å; F238-R254 HydrophobicContact CD2-CG 4.41Å; F238-R254 HydrophobicContact CE2-CB 4.05Å; F238-R254 HydrophobicContact CG-CB 4.41Å; S251-R254 PolarHBondContact O-NH1 2.89Å; S251-R254 PolarHBondContact O-NH2 2.85Å; A252-R254 PolarHBondContact O-N 3.09Å; R254-S281 WeakPolarHBondContact CD-O 3.48Å; R254-S281 VanDerWaalsContact CD-OG 3.24Å; R254-S281 WeakPolarHBondContact CD-OG 3.5Å; R254-S281 PolarHBondContact NE-OG 2.93Å; R254-M283 HydrophobicContact CG-CE 4.26Å; R254-M283 HydrophobicContact CG-CG 4.47Å
255	Y	98.5	Very high	97.2	Very high	77 Å²	77	56 Å²	56	30%	0.302	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	116.6	179.6	-179	-109.6	0	0	0	110.6	G234 T235 T257 G279 Q280	G234-Y255 VanDerWaalsContact C-CD2 3.47Å; G234-Y255 WeakPolarHBondContact O-CA 3.5Å; G234-Y255 WeakPolarHBondContact O-CD2 3.37Å; T235-Y255 WeakPolarHBondContact OG1-CD2 3.37Å; Y255-T257 WeakPolarHBondContact CE1-OG1 3.47Å; Y255-G279 WeakPolarHBondContact O-CA 3.39Å; Y255-Q280 HydrophobicContact CD1-CG 3.85Å; Y255-Q280 PolarHBondContact O-N 3.12Å; Y255-Q280 VanDerWaalsContact O-N 3.09Å
256	I	98.8	Very high	97.4	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.1	171.6	-52.2	-57.7	0	0	0	107.6	Y232 G234 F238 M259 V277 F282 M290	Y232-I256 VanDerWaalsContact O-CB 3.31Å; Y232-I256 WeakPolarHBondContact O-CB 3.22Å; G234-I256 PolarHBondContact N-O 2.92Å; G234-I256 PolarHBondContact O-N 3.14Å; F238-I256 HydrophobicContact CE2-CG1 4.13Å; F238-I256 HydrophobicContact CZ-CD1 4.37Å; F238-I256 HydrophobicContact CZ-CG1 3.68Å; I256-M259 HydrophobicContact CG2-CB 4.38Å; I256-V277 HydrophobicContact CG2-CG2 4.11Å; I256-F282 HydrophobicContact CD1-CD1 4.31Å; I256-F282 HydrophobicContact CD1-CE1 3.62Å; I256-F282 HydrophobicContact CD1-CZ 4.36Å; I256-M290 HydrophobicContact CD1-CE 3.98Å; I256-M290 HydrophobicContact CD1-SD 4.38Å; I256-M290 HydrophobicContact CG1-CE 3.91Å
257	T	98.3	Very high	97.4	Very high	43 Å²	43	58.2 Å²	58.2	26%	0.264	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-41.9	179.2	-54.7	0	0	0	0	110.7	Y255 R278	Y255-T257 WeakPolarHBondContact CE1-OG1 3.47Å; T257-R278 PolarHBondContact N-O 3.15Å
258	E	97.6	Very high	97.3	Very high	111 Å²	111	62.5 Å²	62.5	52%	0.519	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	144.8	-176.5	-176.5	173.2	-161.2	0	0	110.1	V277 R278	E258-V277 WeakPolarHBondContact O-CA 3.43Å; E258-R278 PolarHBondContact N-O 2.89Å; E258-R278 PolarHBondContact O-N 2.75Å
259	M	98.6	Very high	97.1	Very high	10 Å²	10	61.7 Å²	61.7	5%	0.049	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	130.9	168.2	-168.4	167.5	-174.7	0	0	109.6	F229 Y232 I256 I275 T276 V277 M290 I291	F229-M259 HydrophobicContact CB-CB 4.25Å; F229-M259 HydrophobicContact CB-CG 3.99Å; F229-M259 HydrophobicContact CD1-CE 3.5Å; F229-M259 VanDerWaalsContact CD1-CE 3.5Å; F229-M259 HydrophobicContact CD1-CG 3.92Å; F229-M259 HydrophobicContact CD1-SD 3.67Å; F229-M259 HydrophobicContact CE1-CE 3.43Å; F229-M259 VanDerWaalsContact CE1-CE 3.43Å; F229-M259 HydrophobicContact CE1-SD 4.23Å; F229-M259 HydrophobicContact CG-CE 4.37Å; F229-M259 HydrophobicContact CG-CG 4.01Å; F229-M259 HydrophobicContact CG-SD 4.36Å; F229-M259 HydrophobicContact CZ-CE 4.22Å; Y232-M259 HydrophobicContact CD2-SD 3.79Å; Y232-M259 HydrophobicContact CE2-SD 4.43Å; I256-M259 HydrophobicContact CG2-CB 4.38Å; M259-I275 HydrophobicContact CE-CG2 3.77Å; M259-I275 HydrophobicContact CG-CG2 4.4Å; M259-T276 CarbonylContact C-O 3.55Å; M259-T276 VanDerWaalsContact CA-O 3.25Å; M259-T276 WeakPolarHBondContact CA-O 3.28Å; M259-V277 HydrophobicContact CB-CB 4.35Å; M259-V277 HydrophobicContact CB-CG2 4.07Å; M259-V277 HydrophobicContact CE-CB 4.34Å; M259-V277 HydrophobicContact CG-CB 3.89Å; M259-V277 HydrophobicContact CG-CG2 3.95Å; M259-V277 HydrophobicContact SD-CB 4.15Å; M259-V277 HydrophobicContact SD-CG2 3.87Å; M259-M290 HydrophobicContact CE-CB 4.4Å; M259-M290 HydrophobicContact SD-CE 3.55Å; M259-M290 VanDerWaalsContact SD-CE 3.55Å; M259-I291 HydrophobicContact CE-CD1 4.4Å; M259-I291 HydrophobicContact CE-CG1 3.64Å
260	S	98.6	Very high	97.1	Very high	40 Å²	40	62.9 Å²	62.9	28%	0.28	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	161.1	-179.1	58.1	0	0	0	0	111.4	N226 I275 T276	N226-S260 WeakPolarHBondContact OD1-CA 3.5Å; N226-S260 WeakPolarHBondContact OD1-CB 3.47Å; S260-I275 CarbonylContact O-C 3.59Å; S260-I275 VanDerWaalsContact O-CA 3.26Å; S260-I275 WeakPolarHBondContact O-CA 3.36Å; S260-I275 WeakPolarHBondContact O-CG2 3.19Å; S260-T276 PolarHBondContact N-O 3.28Å; S260-T276 PolarHBondContact O-N 2.9Å
261	C	98.8	Very high	97.2	Very high	6 Å²	6	58.9 Å²	58.9	4%	0.041	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.2	171.4	-169.4	0	0	0	0	109.2	L222 V225 N226 F229 I275	L222-C261 HydrophobicContact CD1-CB 3.83Å; V225-C261 HydrophobicContact CG1-CB 3.88Å; N226-C261 PolarHBondContact ND2-O 3.09Å; N226-C261 PolarHBondContact OD1-N 3.04Å; N226-C261 PolarHBondContact OD1-O 3.39Å; F229-C261 HydrophobicContact CD2-CB 4.27Å; F229-C261 HydrophobicContact CE2-CB 4.11Å; C261-I275 HydrophobicContact CB-CG1 4.16Å
262	G	98.5	Very high	97.4	Very high	34 Å²	34	56.7 Å²	56.7	35%	0.351	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-75.5	170.9	175.1	0	0	0	0	0	112.9	V274	G262-V274 PolarHBondContact N-O 3.08Å
263	E	98.4	Very high	97.4	Very high	148 Å²	148	56.7 Å²	56.7	69%	0.692	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-57.6	144.1	175.8	-65.7	-59	146.9	0	0	112
264	P	98.4	Very high	97.5	Very high	38 Å²	38	51.5 Å²	51.5	25%	0.247	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-70.6	154.5	179.1	30.7	-35.2	0	0	0	112.1	T199 E271 F272	T199-P264 HydrophobicContact CG2-CB 3.99Å; P264-E271 HydrophobicContact CB-CG 3.67Å; P264-F272 CarbonylContact C-O 3.46Å; P264-F272 WeakPolarHBondContact CA-O 3.34Å
265	F	98.1	Very high	97.5	Very high	64 Å²	64	49.3 Å²	49.3	28%	0.281	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154.9	174.5	61.6	-87.7	0	0	0	110.4	M196 R267 E271 F272 V274	M196-F265 HydrophobicContact CE-CZ 3.96Å; M196-F265 HydrophobicContact SD-CZ 4.4Å; F265-R267 HydrophobicContact CD2-CG 3.98Å; F265-R267 HydrophobicContact CE2-CG 3.94Å; F265-E271 WeakPolarHBondContact O-CA 3.37Å; F265-F272 HydrophobicContact CD2-CB 4.43Å; F265-F272 HydrophobicContact CE1-CB 4.17Å; F265-F272 HydrophobicContact CE2-CB 3.81Å; F265-F272 HydrophobicContact CZ-CB 3.66Å; F265-F272 PolarHBondContact N-O 3.15Å; F265-F272 PolarHBondContact O-N 2.84Å; F265-V274 HydrophobicContact CE1-CG2 3.97Å; F265-V274 HydrophobicContact CZ-CG2 4.32Å
266	V	97.4	Very high	97.5	Very high	79 Å²	79	48.4 Å²	48.4	48%	0.479	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.7	-177.2	179.5	0	0	0	0	110.9	Y270 E271	V266-Y270 CarbonylContact C-O 3.6Å; V266-Y270 WeakPolarHBondContact CA-O 3.4Å; V266-E271 HydrophobicContact CG2-CB 4.36Å; V266-E271 HydrophobicContact CG2-CG 4.4Å
267	R	95	Very high	97.5	Very high	74 Å²	74	48.5 Å²	48.5	28%	0.279	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132	167.1	-70	-167.2	-176.8	-156.4	4.3	109.4	F265 S269 Y270 F272 E363 V371	F265-R267 HydrophobicContact CD2-CG 3.98Å; F265-R267 HydrophobicContact CE2-CG 3.94Å; R267-S269 VanDerWaalsContact C-N 3.28Å; R267-S269 PolarHBondContact O-N 3.18Å; R267-Y270 PolarHBondContact N-O 2.87Å; R267-Y270 PolarHBondContact O-N 3.46Å; R267-Y270 VanDerWaalsContact O-N 3.08Å; R267-Y270 VanDerWaalsContact O-O 3.06Å; R267-F272 HydrophobicContact CB-CD2 4.35Å; R267-F272 HydrophobicContact CB-CE2 4.38Å; R267-E363 IonicContact CZ-OE2 2.86Å; R267-E363 IonicContact NH1-OE2 2.6Å; R267-E363 PolarHBondContact NH1-OE2 2.82Å; R267-E363 IonicContact NH2-OE1 2.64Å; R267-E363 PolarHBondContact NH2-OE1 2.9Å; R267-E363 IonicContact NH2-OE2 3.46Å; R267-E363 PolarHBondContact NH2-OE2 2.82Å; R267-V371 HydrophobicContact CB-CG1 4.17Å; R267-V371 HydrophobicContact CB-CG2 4.41Å
268	N	92.1	Very high	97.5	Very high	114 Å²	114	50.1 Å²	50.1	61%	0.61	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	40.5	-178.8	-61.7	-11.6	0	0	0	114	Y270	N268-Y270 WeakPolarHBondContact O-CD2 3.47Å; N268-Y270 WeakPolarHBondContact O-CE2 3.35Å; N268-Y270 PolarHBondContact O-N 2.93Å; N268-Y270 VanDerWaalsContact O-N 3.16Å
269	S	92.5	Very high	97.6	Very high	83 Å²	83	44.8 Å²	44.8	58%	0.58	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.2	-5.5	-176.7	-49.9	0	0	0	0	116.3	A213 R216 R267	A213-S269 VanDerWaalsContact O-O 3.13Å; R216-S269 PolarHBondContact NH2-O 2.93Å; R267-S269 VanDerWaalsContact C-N 3.28Å; R267-S269 PolarHBondContact O-N 3.18Å
270	Y	95.3	Very high	97.5	Very high	66 Å²	66	48.3 Å²	48.3	26%	0.259	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	143.4	173.1	-61.1	-89.7	0	0	0	110.5	I212 A213 V266 R267 N268 C375	I212-Y270 HydrophobicContact CB-CD1 4.34Å; I212-Y270 HydrophobicContact CB-CE1 4.1Å; I212-Y270 HydrophobicContact CG2-CD1 3.89Å; I212-Y270 HydrophobicContact CG2-CE1 4.11Å; A213-Y270 HydrophobicContact CB-CD1 4.17Å; A213-Y270 HydrophobicContact CB-CE1 3.96Å; V266-Y270 CarbonylContact C-O 3.6Å; V266-Y270 WeakPolarHBondContact CA-O 3.4Å; R267-Y270 PolarHBondContact N-O 2.87Å; R267-Y270 PolarHBondContact O-N 3.46Å; R267-Y270 VanDerWaalsContact O-N 3.08Å; R267-Y270 VanDerWaalsContact O-O 3.06Å; N268-Y270 WeakPolarHBondContact O-CD2 3.47Å; N268-Y270 WeakPolarHBondContact O-CE2 3.35Å; N268-Y270 PolarHBondContact O-N 2.93Å; N268-Y270 VanDerWaalsContact O-N 3.16Å; Y270-C375 HydrophobicContact CD2-CB 4.26Å; Y270-C375 WeakPolarHBondContact CD2-SG 3.37Å; Y270-C375 HydrophobicContact CE2-CB 3.9Å; Y270-C375 VanDerWaalsContact CE2-SG 3.51Å
271	E	97.7	Very high	97.3	Very high	18 Å²	18	48.6 Å²	48.6	8%	0.084	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.3	174.1	-169.5	-171.9	-108.1	0	0	110.4	P198 T199 R216 L217 P264 F265 V266	P198-E271 CarbonylContact C-O 3.58Å; P198-E271 WeakPolarHBondContact CA-O 3.28Å; T199-E271 WeakPolarHBondContact CB-OE2 3.19Å; T199-E271 HydrophobicContact CG2-CB 4.46Å; T199-E271 HydrophobicContact CG2-CG 3.88Å; T199-E271 WeakPolarHBondContact CG2-OE2 3.36Å; T199-E271 PolarHBondContact N-O 2.95Å; T199-E271 WeakPolarHBondContact OG1-CB 3.42Å; T199-E271 PolarHBondContact OG1-O 2.69Å; T199-E271 PolarHBondContact OG1-OE2 2.79Å; R216-E271 WeakPolarHBondContact CA-OE2 3.27Å; R216-E271 WeakPolarHBondContact CD-OE1 3.35Å; L217-E271 WeakPolarHBondContact CB-OE2 3.36Å; L217-E271 PolarHBondContact N-OE2 3.44Å; P264-E271 HydrophobicContact CB-CG 3.67Å; F265-E271 WeakPolarHBondContact O-CA 3.37Å; V266-E271 HydrophobicContact CG2-CB 4.36Å; V266-E271 HydrophobicContact CG2-CG 4.4Å
272	F	98.6	Very high	97.3	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	156	179.2	-68.9	-96.6	0	0	0	110.1	M196 L197 P198 P264 F265 R267 V371 E374	M196-F272 HydrophobicContact CG-CD1 4.06Å; M196-F272 HydrophobicContact SD-CD1 4.47Å; L197-F272 VanDerWaalsContact C-CD1 3.5Å; L197-F272 CarbonylContact O-C 3.5Å; L197-F272 VanDerWaalsContact O-CA 3.23Å; L197-F272 WeakPolarHBondContact O-CA 3.49Å; P198-F272 HydrophobicContact CB-CE1 4.42Å; P198-F272 HydrophobicContact CG-CD1 4.22Å; P198-F272 HydrophobicContact CG-CE1 3.74Å; P198-F272 HydrophobicContact CG-CZ 4.4Å; P264-F272 CarbonylContact C-O 3.46Å; P264-F272 WeakPolarHBondContact CA-O 3.34Å; F265-F272 HydrophobicContact CD2-CB 4.43Å; F265-F272 HydrophobicContact CE1-CB 4.17Å; F265-F272 HydrophobicContact CE2-CB 3.81Å; F265-F272 HydrophobicContact CZ-CB 3.66Å; F265-F272 PolarHBondContact N-O 3.15Å; F265-F272 PolarHBondContact O-N 2.84Å; R267-F272 HydrophobicContact CB-CD2 4.35Å; R267-F272 HydrophobicContact CB-CE2 4.38Å; F272-V371 HydrophobicContact CE1-CG2 4.39Å; F272-V371 HydrophobicContact CE2-CG1 4.09Å; F272-V371 HydrophobicContact CE2-CG2 4.22Å; F272-V371 HydrophobicContact CZ-CB 4.29Å; F272-V371 HydrophobicContact CZ-CG1 4.08Å; F272-V371 HydrophobicContact CZ-CG2 4.1Å; F272-E374 HydrophobicContact CE1-CB 4.11Å; F272-E374 HydrophobicContact CE1-CG 4.27Å; F272-E374 HydrophobicContact CZ-CB 4.26Å
273	A	98.6	Very high	97.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	165.5	165.6	0	0	0	0	0	109.9	M196 L197 T199	M196-A273 WeakPolarHBondContact CA-O 3.46Å; L197-A273 PolarHBondContact N-O 3.13Å; L197-A273 VanDerWaalsContact N-O 3.08Å; L197-A273 PolarHBondContact O-N 3.38Å; T199-A273 HydrophobicContact CG2-CB 3.86Å
274	V	98.8	Very high	97	Very high	28 Å²	28	46.9 Å²	46.9	17%	0.17	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119.4	175.9	174.7	0	0	0	0	109.5	A194 M196 G262 F265	A194-V274 HydrophobicContact CB-CG1 3.85Å; M196-V274 HydrophobicContact CB-CG2 4.19Å; M196-V274 HydrophobicContact CE-CG2 4.06Å; M196-V274 HydrophobicContact CG-CG2 4.32Å; G262-V274 PolarHBondContact N-O 3.08Å; F265-V274 HydrophobicContact CE1-CG2 3.97Å; F265-V274 HydrophobicContact CZ-CG2 4.32Å
275	I	98.9	Very high	96.8	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	129.5	170.1	-56.1	160.9	0	0	0	107.9	A194 Y195 L197 F202 F229 M259 S260 C261 I291	A194-I275 CarbonylContact C-O 3.59Å; A194-I275 VanDerWaalsContact CA-O 3.23Å; A194-I275 WeakPolarHBondContact CA-O 3.39Å; Y195-I275 HydrophobicContact CD1-CD1 4.32Å; Y195-I275 PolarHBondContact N-O 2.86Å; Y195-I275 PolarHBondContact O-N 3.23Å; L197-I275 HydrophobicContact CD1-CD1 4.3Å; L197-I275 HydrophobicContact CD2-CD1 3.62Å; L197-I275 HydrophobicContact CD2-CG1 3.87Å; F202-I275 HydrophobicContact CZ-CD1 4.24Å; F229-I275 HydrophobicContact CD2-CG2 4.4Å; F229-I275 HydrophobicContact CE1-CG2 4.48Å; F229-I275 HydrophobicContact CE2-CD1 3.96Å; F229-I275 HydrophobicContact CE2-CG1 3.91Å; F229-I275 HydrophobicContact CE2-CG2 3.93Å; F229-I275 HydrophobicContact CZ-CD1 3.67Å; F229-I275 HydrophobicContact CZ-CG1 4.12Å; F229-I275 HydrophobicContact CZ-CG2 4Å; M259-I275 HydrophobicContact CE-CG2 3.77Å; M259-I275 HydrophobicContact CG-CG2 4.4Å; S260-I275 CarbonylContact O-C 3.59Å; S260-I275 VanDerWaalsContact O-CA 3.26Å; S260-I275 WeakPolarHBondContact O-CA 3.36Å; S260-I275 WeakPolarHBondContact O-CG2 3.19Å; C261-I275 HydrophobicContact CB-CG1 4.16Å; I275-I291 HydrophobicContact CD1-CD1 4.18Å; I275-I291 HydrophobicContact CD1-CG1 4.14Å; I275-I291 HydrophobicContact CD1-CG2 3.86Å
276	T	98.8	Very high	96.8	Very high	57 Å²	57	43.8 Å²	43.8	35%	0.35	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.8	173.7	-59.4	0	0	0	0	109.4	T192 Y193 M259 S260	T192-T276 HydrophobicContact CG2-CG2 3.75Å; Y193-T276 WeakPolarHBondContact O-CA 3.34Å; M259-T276 CarbonylContact C-O 3.55Å; M259-T276 VanDerWaalsContact CA-O 3.25Å; M259-T276 WeakPolarHBondContact CA-O 3.28Å; S260-T276 PolarHBondContact N-O 3.28Å; S260-T276 PolarHBondContact O-N 2.9Å
277	V	98.8	Very high	96.9	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	130.1	174.1	63	0	0	0	0	110.8	T192 Y193 I256 E258 M259 F282 I287	T192-V277 CarbonylContact C-O 3.59Å; T192-V277 VanDerWaalsContact CA-O 3.32Å; T192-V277 WeakPolarHBondContact CA-O 3.42Å; Y193-V277 PolarHBondContact N-O 3.04Å; Y193-V277 PolarHBondContact O-N 3.11Å; I256-V277 HydrophobicContact CG2-CG2 4.11Å; E258-V277 WeakPolarHBondContact O-CA 3.43Å; M259-V277 HydrophobicContact CB-CB 4.35Å; M259-V277 HydrophobicContact CB-CG2 4.07Å; M259-V277 HydrophobicContact CE-CB 4.34Å; M259-V277 HydrophobicContact CG-CB 3.89Å; M259-V277 HydrophobicContact CG-CG2 3.95Å; M259-V277 HydrophobicContact SD-CB 4.15Å; M259-V277 HydrophobicContact SD-CG2 3.87Å; V277-F282 HydrophobicContact CG1-CZ 4.35Å; V277-F282 HydrophobicContact CG2-CE1 4Å; V277-F282 HydrophobicContact CG2-CZ 4.04Å; V277-I287 HydrophobicContact CG1-CD1 4.01Å; V277-I287 HydrophobicContact CG1-CG1 4.17Å; V277-I287 HydrophobicContact CG1-CG2 3.87Å
278	R	98.7	Very high	97	Very high	77 Å²	77	38.3 Å²	38.3	29%	0.291	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.6	172.2	-176	-179.8	-179.6	-175.6	1.8	109.7	R191 T257 E258 D334	R191-R278 WeakPolarHBondContact O-CA 3.36Å; T257-R278 PolarHBondContact N-O 3.15Å; E258-R278 PolarHBondContact N-O 2.89Å; E258-R278 PolarHBondContact O-N 2.75Å; R278-D334 IonicContact NH2-OD2 3.23Å; R278-D334 PolarHBondContact NH2-OD2 3.09Å
279	G	98.2	Very high	97.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	160.6	177.5	0	0	0	0	0	111.9	A190 R191 Y255	A190-G279 CarbonylContact C-O 3.48Å; A190-G279 VanDerWaalsContact CA-O 3.27Å; A190-G279 WeakPolarHBondContact CA-O 3.21Å; A190-G279 WeakPolarHBondContact CB-O 3.48Å; R191-G279 PolarHBondContact N-O 3.43Å; R191-G279 PolarHBondContact O-N 3.37Å; R191-G279 VanDerWaalsContact O-N 3.11Å; Y255-G279 WeakPolarHBondContact O-CA 3.39Å
280	Q	96.6	Very high	97.6	Very high	84 Å²	84	30.2 Å²	30.2	39%	0.393	15%	0.147	S	C	.	.	S	Bend	trans	-65	-48.3	-179.6	-81.5	172.6	-1.5	0	0	111.7	D189 R191 Y255	D189-Q280 WeakPolarHBondContact O-CA 3.42Å; R191-Q280 PolarHBondContact NH1-O 3.05Å; Y255-Q280 HydrophobicContact CD1-CG 3.85Å; Y255-Q280 PolarHBondContact O-N 3.12Å; Y255-Q280 VanDerWaalsContact O-N 3.09Å
281	S	95.7	Very high	97.8	Very high	45 Å²	45	27.1 Å²	27.1	32%	0.315	14%	0.135	S	C	.	.			trans	-151.5	157.4	176.7	60.6	0	0	0	0	109.8	R254	R254-S281 WeakPolarHBondContact CD-O 3.48Å; R254-S281 VanDerWaalsContact CD-OG 3.24Å; R254-S281 WeakPolarHBondContact CD-OG 3.5Å; R254-S281 PolarHBondContact NE-OG 2.93Å
282	F	97.3	Very high	97.9	Very high	40 Å²	40	26.2 Å²	26.2	18%	0.175	13%	0.131	C	C	.	.			trans	-129.3	140.9	179.6	-61.3	-84.4	0	0	0	109.6	R191 Y193 I256 V277 I287	R191-F282 HydrophobicContact CB-CD2 4.44Å; R191-F282 HydrophobicContact CB-CE2 4.16Å; Y193-F282 HydrophobicContact CD2-CD2 4.09Å; Y193-F282 AromaticContact CD2-CE2 3.84Å; Y193-F282 HydrophobicContact CD2-CE2 3.84Å; Y193-F282 HydrophobicContact CD2-CZ 4.47Å; Y193-F282 AromaticContact CE2-CD2 3.75Å; Y193-F282 HydrophobicContact CE2-CD2 3.75Å; Y193-F282 AromaticContact CE2-CE2 3.92Å; Y193-F282 HydrophobicContact CE2-CE2 3.92Å; I256-F282 HydrophobicContact CD1-CD1 4.31Å; I256-F282 HydrophobicContact CD1-CE1 3.62Å; I256-F282 HydrophobicContact CD1-CZ 4.36Å; V277-F282 HydrophobicContact CG1-CZ 4.35Å; V277-F282 HydrophobicContact CG2-CE1 4Å; V277-F282 HydrophobicContact CG2-CZ 4.04Å; F282-I287 HydrophobicContact CB-CD1 4.43Å; F282-I287 HydrophobicContact CB-CG1 4.46Å; F282-I287 HydrophobicContact CD1-CD1 3.75Å; F282-I287 HydrophobicContact CD1-CG1 3.42Å; F282-I287 VanDerWaalsContact CD1-CG1 3.42Å; F282-I287 HydrophobicContact CD2-CD1 4.07Å; F282-I287 HydrophobicContact CE1-CD1 3.89Å; F282-I287 HydrophobicContact CE1-CG1 3.66Å; F282-I287 HydrophobicContact CE2-CD1 4.21Å; F282-I287 HydrophobicContact CG-CD1 3.82Å; F282-I287 HydrophobicContact CG-CG1 3.94Å; F282-I287 HydrophobicContact CZ-CD1 4.11Å; F282-I287 HydrophobicContact CZ-CG1 4.37Å
283	M	96.6	Very high	97.9	Very high	23 Å²	23	26.2 Å²	26.2	11%	0.113	13%	0.131	C	C	.	.			trans	-81.5	168.3	170.6	-64.3	-174.6	-69.2	0	0	111	F238 T242 K245 A252 R254 H285 Q286	F238-M283 HydrophobicContact CB-CE 3.5Å; F238-M283 VanDerWaalsContact O-CE 3.28Å; F238-M283 WeakPolarHBondContact O-CE 3.49Å; T242-M283 HydrophobicContact CG2-CB 4.37Å; T242-M283 HydrophobicContact CG2-CE 3.65Å; T242-M283 HydrophobicContact CG2-SD 3.76Å; K245-M283 HydrophobicContact CG-SD 4.38Å; A252-M283 HydrophobicContact CB-CE 4.34Å; A252-M283 HydrophobicContact CB-SD 4.47Å; R254-M283 HydrophobicContact CG-CE 4.26Å; R254-M283 HydrophobicContact CG-CG 4.47Å; M283-H285 PolarHBondContact O-N 3.43Å; M283-Q286 HydrophobicContact CB-CB 4.22Å; M283-Q286 WeakPolarHBondContact O-CB 3.49Å; M283-Q286 PolarHBondContact O-N 3.34Å; M283-Q286 VanDerWaalsContact O-N 3.17Å
284	L	94.4	Very high	97.9	Very high	90 Å²	90	26.2 Å²	26.2	47%	0.471	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	131.8	172.9	-177.7	66.2	0	0	0	109.9	D138 T242 Q286	D138-L284 WeakPolarHBondContact OD1-CD1 3.5Å; T242-L284 WeakPolarHBondContact CB-O 3.38Å; T242-L284 PolarHBondContact OG1-O 3.23Å; L284-Q286 PolarHBondContact O-N 3.15Å
285	H	95.5	Very high	97.9	Very high	36 Å²	36	24.9 Å²	24.9	17%	0.167	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	-1.7	-178.7	-49	148	0	0	0	117.2	D138 M283 I287 R288 K289 K320	D138-H285 IonicContact OD2-CD2 2.74Å; D138-H285 PolarHBondContact OD2-CD2 2.63Å; M283-H285 PolarHBondContact O-N 3.43Å; H285-I287 PolarHBondContact O-N 3.24Å; H285-R288 PolarHBondContact O-N 3.19Å; H285-K289 PolarHBondContact O-N 2.99Å; H285-K320 HydrophobicContact CB-CD 3.74Å; H285-K320 HydrophobicContact CB-CG 4.31Å; H285-K320 VanDerWaalsContact CG-CD 3.49Å
286	Q	98.3	Very high	97.9	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-54.3	-54.5	-170.5	-173.2	-177.3	-18.8	0	0	113.7	F238 F241 M283 L284 R288 K289 M290	F238-Q286 HydrophobicContact CB-CG 4.46Å; F238-Q286 HydrophobicContact CD1-CG 4.1Å; F238-Q286 HydrophobicContact CG-CG 4.45Å; F241-Q286 HydrophobicContact CB-CG 4.07Å; F241-Q286 WeakPolarHBondContact O-CA 3.2Å; F241-Q286 PolarHBondContact O-N 2.71Å; M283-Q286 HydrophobicContact CB-CB 4.22Å; M283-Q286 WeakPolarHBondContact O-CB 3.49Å; M283-Q286 PolarHBondContact O-N 3.34Å; M283-Q286 VanDerWaalsContact O-N 3.17Å; L284-Q286 PolarHBondContact O-N 3.15Å; Q286-R288 VanDerWaalsContact C-N 3.31Å; Q286-R288 PolarHBondContact O-N 3.08Å; Q286-K289 PolarHBondContact O-N 2.99Å; Q286-M290 HydrophobicContact CG-CG 4.43Å; Q286-M290 HydrophobicContact CG-SD 3.86Å; Q286-M290 VanDerWaalsContact O-CG 3.25Å; Q286-M290 WeakPolarHBondContact O-CG 3.29Å; Q286-M290 PolarHBondContact O-N 2.89Å
287	I	98.4	Very high	97.8	Very high	9 Å²	9	22.4 Å²	22.4	5%	0.046	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-43.5	-177.8	-61.1	171.4	0	0	0	110.8	Y193 V277 F282 H285 K289 M290 I291 L326	Y193-I287 HydrophobicContact CD1-CD1 4.04Å; Y193-I287 HydrophobicContact CD2-CD1 3.35Å; Y193-I287 HydrophobicContact CE1-CD1 4.44Å; Y193-I287 HydrophobicContact CE2-CD1 3.81Å; Y193-I287 HydrophobicContact CG-CD1 3.48Å; Y193-I287 VanDerWaalsContact CG-CD1 3.48Å; V277-I287 HydrophobicContact CG1-CD1 4.01Å; V277-I287 HydrophobicContact CG1-CG1 4.17Å; V277-I287 HydrophobicContact CG1-CG2 3.87Å; F282-I287 HydrophobicContact CB-CD1 4.43Å; F282-I287 HydrophobicContact CB-CG1 4.46Å; F282-I287 HydrophobicContact CD1-CD1 3.75Å; F282-I287 HydrophobicContact CD1-CG1 3.42Å; F282-I287 VanDerWaalsContact CD1-CG1 3.42Å; F282-I287 HydrophobicContact CD2-CD1 4.07Å; F282-I287 HydrophobicContact CE1-CD1 3.89Å; F282-I287 HydrophobicContact CE1-CG1 3.66Å; F282-I287 HydrophobicContact CE2-CD1 4.21Å; F282-I287 HydrophobicContact CG-CD1 3.82Å; F282-I287 HydrophobicContact CG-CG1 3.94Å; F282-I287 HydrophobicContact CZ-CD1 4.11Å; F282-I287 HydrophobicContact CZ-CG1 4.37Å; H285-I287 PolarHBondContact O-N 3.24Å; I287-K289 VanDerWaalsContact C-N 3.31Å; I287-K289 PolarHBondContact O-N 3.4Å; I287-M290 WeakPolarHBondContact O-CB 3.45Å; I287-M290 PolarHBondContact O-N 3.37Å; I287-I291 HydrophobicContact CG2-CD1 3.82Å; I287-I291 HydrophobicContact CG2-CG1 4.48Å; I287-I291 WeakPolarHBondContact O-CG1 3.35Å; I287-I291 PolarHBondContact O-N 2.97Å; I287-L326 HydrophobicContact CB-CD1 4.38Å; I287-L326 HydrophobicContact CD1-CD1 4.42Å; I287-L326 HydrophobicContact CG2-CD1 3.74Å
288	R	98.3	Very high	97.8	Very high	29 Å²	29	23.4 Å²	23.4	11%	0.109	11%	0.112	C	C	.	.	H	α-helix	trans	-65.1	-35.6	-179.1	-65.6	168.8	58.4	-171.3	1.4	112	D138 H285 Q286 G292 K320 A321 P322 L326	D138-R288 IonicContact OD2-NH1 2.75Å; H285-R288 PolarHBondContact O-N 3.19Å; Q286-R288 VanDerWaalsContact C-N 3.31Å; Q286-R288 PolarHBondContact O-N 3.08Å; R288-G292 PolarHBondContact O-N 3Å; R288-K320 HydrophobicContact CB-CG 3.95Å; R288-A321 HydrophobicContact CB-CB 4.46Å; R288-A321 PolarHBondContact NE-O 2.9Å; R288-A321 PolarHBondContact NH2-O 2.63Å; R288-A321 WeakPolarHBondContact O-CB 3.41Å; R288-A321 PolarHBondContact O-N 2.9Å; R288-A321 VanDerWaalsContact O-N 3.08Å; R288-P322 PolarHBondContact NE-O 3.31Å; R288-L326 HydrophobicContact CG-CD2 4.16Å
289	K	98.6	Very high	97.7	Very high	27 Å²	27	20.4 Å²	20.4	12%	0.117	10%	0.101	C	C	.	.	H	α-helix	trans	-72.6	-39	173.4	-82.5	-167.5	160.5	-161	0	112.5	N240 F241 H285 Q286 I287 I291 G292 L293 V318 P319 K320	N240-K289 WeakPolarHBondContact O-CD 3.48Å; N240-K289 PolarHBondContact O-NZ 3.08Å; F241-K289 VanDerWaalsContact C-CD 3.45Å; F241-K289 HydrophobicContact CB-CB 4.2Å; F241-K289 HydrophobicContact CD1-CB 3.9Å; H285-K289 PolarHBondContact O-N 2.99Å; Q286-K289 PolarHBondContact O-N 2.99Å; I287-K289 VanDerWaalsContact C-N 3.31Å; I287-K289 PolarHBondContact O-N 3.4Å; K289-I291 VanDerWaalsContact C-N 3.32Å; K289-I291 PolarHBondContact O-N 3.35Å; K289-G292 PolarHBondContact O-N 3.46Å; K289-L293 PolarHBondContact O-N 2.81Å; K289-V318 HydrophobicContact CB-CB 4.47Å; K289-V318 HydrophobicContact CB-CG1 3.66Å; K289-V318 HydrophobicContact CD-CB 4.15Å; K289-V318 HydrophobicContact CD-CG1 4.23Å; K289-V318 VanDerWaalsContact CE-O 3.26Å; K289-V318 WeakPolarHBondContact CE-O 3.46Å; K289-V318 HydrophobicContact CG-CB 4.43Å; K289-V318 HydrophobicContact CG-CG1 4.01Å; K289-V318 VanDerWaalsContact O-CG1 3.23Å; K289-V318 WeakPolarHBondContact O-CG1 3.32Å; K289-P319 WeakPolarHBondContact CA-O 3.31Å; K289-K320 HydrophobicContact CG-CB 4.05Å; K289-K320 HydrophobicContact CG-CG 4.33Å
290	M	98.8	Very high	97.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.5	-45.3	175.1	-70	165.5	70.3	0	0	111.4	Y232 F238 F241 I256 M259 Q286 I287 V294	Y232-M290 HydrophobicContact CD1-CE 3.82Å; Y232-M290 HydrophobicContact CD1-CG 4.29Å; Y232-M290 HydrophobicContact CD2-CB 4.38Å; Y232-M290 HydrophobicContact CD2-CE 3.76Å; Y232-M290 HydrophobicContact CE1-CB 4.29Å; Y232-M290 HydrophobicContact CE1-CE 4.39Å; Y232-M290 HydrophobicContact CE1-CG 3.97Å; Y232-M290 HydrophobicContact CE2-CB 3.82Å; Y232-M290 HydrophobicContact CE2-CE 4.32Å; Y232-M290 HydrophobicContact CE2-CG 4.33Å; Y232-M290 HydrophobicContact CG-CE 3.49Å; Y232-M290 VanDerWaalsContact CG-CE 3.49Å; Y232-M290 WeakPolarHBondContact OH-CA 3.45Å; Y232-M290 PolarHBondContact OH-O 2.92Å; F238-M290 HydrophobicContact CD1-CG 4.31Å; F238-M290 HydrophobicContact CD1-SD 4.29Å; F238-M290 HydrophobicContact CE1-CE 3.95Å; F238-M290 HydrophobicContact CE1-CG 3.93Å; F238-M290 HydrophobicContact CE1-SD 3.75Å; F238-M290 HydrophobicContact CZ-CE 4.31Å; F241-M290 HydrophobicContact CD1-CB 4.37Å; F241-M290 HydrophobicContact CD1-CG 3.7Å; F241-M290 HydrophobicContact CE1-CG 4.07Å; F241-M290 HydrophobicContact CG-CG 4.38Å; I256-M290 HydrophobicContact CD1-CE 3.98Å; I256-M290 HydrophobicContact CD1-SD 4.38Å; I256-M290 HydrophobicContact CG1-CE 3.91Å; M259-M290 HydrophobicContact CE-CB 4.4Å; M259-M290 HydrophobicContact SD-CE 3.55Å; M259-M290 VanDerWaalsContact SD-CE 3.55Å; Q286-M290 HydrophobicContact CG-CG 4.43Å; Q286-M290 HydrophobicContact CG-SD 3.86Å; Q286-M290 VanDerWaalsContact O-CG 3.25Å; Q286-M290 WeakPolarHBondContact O-CG 3.29Å; Q286-M290 PolarHBondContact O-N 2.89Å; I287-M290 WeakPolarHBondContact O-CB 3.45Å; I287-M290 PolarHBondContact O-N 3.37Å; M290-V294 PolarHBondContact O-N 2.86Å
291	I	98.8	Very high	97.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.9	-45.7	176.2	-66	170.5	0	0	0	110.8	Y195 F229 M259 I275 I287 K289 L293 V294 I295 A321	Y195-I291 VanDerWaalsContact CB-CD1 3.48Å; Y195-I291 HydrophobicContact CD1-CD1 3.92Å; Y195-I291 HydrophobicContact CD1-CG2 4.37Å; Y195-I291 HydrophobicContact CD2-CD1 3.75Å; Y195-I291 HydrophobicContact CE1-CG2 4.37Å; Y195-I291 HydrophobicContact CE2-CD1 4.48Å; Y195-I291 HydrophobicContact CG-CD1 3.44Å; Y195-I291 VanDerWaalsContact CG-CD1 3.44Å; F229-I291 HydrophobicContact CE1-CG1 4.42Å; M259-I291 HydrophobicContact CE-CD1 4.4Å; M259-I291 HydrophobicContact CE-CG1 3.64Å; I275-I291 HydrophobicContact CD1-CD1 4.18Å; I275-I291 HydrophobicContact CD1-CG1 4.14Å; I275-I291 HydrophobicContact CD1-CG2 3.86Å; I287-I291 HydrophobicContact CG2-CD1 3.82Å; I287-I291 HydrophobicContact CG2-CG1 4.48Å; I287-I291 WeakPolarHBondContact O-CG1 3.35Å; I287-I291 PolarHBondContact O-N 2.97Å; K289-I291 VanDerWaalsContact C-N 3.32Å; K289-I291 PolarHBondContact O-N 3.35Å; I291-L293 VanDerWaalsContact C-N 3.33Å; I291-L293 PolarHBondContact O-N 2.96Å; I291-V294 PolarHBondContact O-N 2.77Å; I291-I295 HydrophobicContact CG2-CD1 3.71Å; I291-I295 HydrophobicContact CG2-CG1 4.38Å; I291-I295 WeakPolarHBondContact O-CG1 3.26Å; I291-I295 PolarHBondContact O-N 2.85Å; I291-A321 HydrophobicContact CG2-CB 4.22Å
292	G	98.6	Very high	97.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-39.3	-179.5	0	0	0	0	0	113.5	R288 K289 I295 A296	R288-G292 PolarHBondContact O-N 3Å; K289-G292 PolarHBondContact O-N 3.46Å; G292-I295 PolarHBondContact O-N 3.08Å; G292-A296 PolarHBondContact O-N 2.95Å
293	L	98.7	Very high	97.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.8	-45.4	176.3	-167	58.2	0	0	0	112.1	F241 K289 I291 I295 A296 V297 V306 M307 V318 F392	F241-L293 HydrophobicContact CE1-CB 4.43Å; F241-L293 HydrophobicContact CE1-CD2 3.91Å; F241-L293 HydrophobicContact CZ-CD2 3.74Å; K289-L293 PolarHBondContact O-N 2.81Å; I291-L293 VanDerWaalsContact C-N 3.33Å; I291-L293 PolarHBondContact O-N 2.96Å; L293-I295 VanDerWaalsContact C-N 3.32Å; L293-I295 PolarHBondContact O-N 3.48Å; L293-A296 PolarHBondContact O-N 3.31Å; L293-V297 WeakPolarHBondContact O-CG2 3.36Å; L293-V297 PolarHBondContact O-N 2.97Å; L293-V306 HydrophobicContact CD1-CG1 3.76Å; L293-V306 HydrophobicContact CD1-CG2 4.26Å; L293-V306 HydrophobicContact CD2-CG1 4.43Å; L293-V306 HydrophobicContact CG-CG1 4.16Å; L293-M307 HydrophobicContact CB-SD 4.49Å; L293-M307 HydrophobicContact CD2-SD 3.7Å; L293-M307 HydrophobicContact CG-SD 3.79Å; L293-V318 HydrophobicContact CB-CG1 3.94Å; L293-V318 HydrophobicContact CD1-CG1 4.46Å; L293-V318 HydrophobicContact CD2-CG2 4.49Å; L293-F392 HydrophobicContact CD1-CD1 4.47Å; L293-F392 HydrophobicContact CD1-CE1 4.11Å
294	V	98.8	Very high	97.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-40.8	178.3	171.9	0	0	0	0	110.9	V225 L228 F229 Y232 M290 I291 A296 V297 I298 M307	V225-V294 HydrophobicContact CG1-CG1 4.5Å; L228-V294 HydrophobicContact CB-CG1 4.06Å; L228-V294 HydrophobicContact CB-CG2 4.08Å; L228-V294 HydrophobicContact CD1-CG1 4.12Å; F229-V294 HydrophobicContact CD1-CB 4.29Å; F229-V294 HydrophobicContact CD1-CG1 4.31Å; F229-V294 HydrophobicContact CD1-CG2 3.75Å; F229-V294 HydrophobicContact CE1-CB 3.69Å; F229-V294 HydrophobicContact CE1-CG1 3.84Å; F229-V294 HydrophobicContact CE1-CG2 3.59Å; F229-V294 HydrophobicContact CE2-CG1 4.29Å; F229-V294 HydrophobicContact CZ-CB 4.06Å; F229-V294 HydrophobicContact CZ-CG1 3.82Å; F229-V294 HydrophobicContact CZ-CG2 4.41Å; Y232-V294 HydrophobicContact CE2-CG2 3.79Å; M290-V294 PolarHBondContact O-N 2.86Å; I291-V294 PolarHBondContact O-N 2.77Å; V294-A296 PolarHBondContact O-N 3.42Å; V294-V297 PolarHBondContact O-N 3.22Å; V294-I298 HydrophobicContact CG1-CG1 4.18Å; V294-I298 WeakPolarHBondContact O-CB 3.42Å; V294-I298 VanDerWaalsContact O-CG1 3.27Å; V294-I298 WeakPolarHBondContact O-CG1 3.33Å; V294-I298 PolarHBondContact O-N 3.31Å; V294-M307 HydrophobicContact CG2-CE 3.85Å; V294-M307 HydrophobicContact CG2-SD 4.26Å
295	I	98.8	Very high	97.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.8	-48.2	173	-71.1	168.5	0	0	0	110.6	L197 A201 F202 I291 G292 L293 V297 I298 R299 W383 L387	L197-I295 HydrophobicContact CD1-CD1 4.06Å; A201-I295 HydrophobicContact CB-CD1 4.16Å; A201-I295 HydrophobicContact CB-CG1 4.45Å; A201-I295 WeakPolarHBondContact O-CG2 3.43Å; F202-I295 HydrophobicContact CD1-CG1 4.22Å; F202-I295 HydrophobicContact CE1-CG1 3.77Å; I291-I295 HydrophobicContact CG2-CD1 3.71Å; I291-I295 HydrophobicContact CG2-CG1 4.38Å; I291-I295 WeakPolarHBondContact O-CG1 3.26Å; I291-I295 PolarHBondContact O-N 2.85Å; G292-I295 PolarHBondContact O-N 3.08Å; L293-I295 VanDerWaalsContact C-N 3.32Å; L293-I295 PolarHBondContact O-N 3.48Å; I295-V297 VanDerWaalsContact C-N 3.29Å; I295-V297 PolarHBondContact O-N 2.9Å; I295-I298 PolarHBondContact O-N 2.96Å; I295-R299 HydrophobicContact CG2-CG 4.07Å; I295-R299 WeakPolarHBondContact O-CB 3.4Å; I295-R299 WeakPolarHBondContact O-CG 3.35Å; I295-R299 PolarHBondContact O-N 3.37Å; I295-W383 HydrophobicContact CB-CH2 4.2Å; I295-W383 HydrophobicContact CB-CZ3 4.45Å; I295-W383 HydrophobicContact CD1-CH2 4.02Å; I295-W383 HydrophobicContact CD1-CZ3 3.88Å; I295-W383 HydrophobicContact CG2-CH2 3.95Å; I295-W383 HydrophobicContact CG2-CZ3 3.87Å; I295-L387 HydrophobicContact CG2-CD1 4.1Å
296	A	98.5	Very high	97.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-39.3	179.5	0	0	0	0	0	112.9	G292 L293 V294 G300 F301 A302 P319 L387 F392	G292-A296 PolarHBondContact O-N 2.95Å; L293-A296 PolarHBondContact O-N 3.31Å; V294-A296 PolarHBondContact O-N 3.42Å; A296-G300 PolarHBondContact O-N 2.97Å; A296-F301 HydrophobicContact CB-CB 4.44Å; A296-F301 PolarHBondContact O-N 3.32Å; A296-A302 HydrophobicContact CB-CB 4.47Å; A296-A302 PolarHBondContact O-N 3.45Å; A296-P319 HydrophobicContact CB-CG 4.22Å; A296-L387 HydrophobicContact CB-CD2 4.48Å; A296-F392 HydrophobicContact CB-CE1 4.07Å; A296-F392 HydrophobicContact CB-CE2 4.34Å; A296-F392 HydrophobicContact CB-CZ 3.57Å
297	V	98.4	Very high	97.7	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-67.4	-49.1	176.2	173.6	0	0	0	0	111.5	L228 L293 V294 I295 R299 G300 A302 E304 V306 M307	L228-V297 HydrophobicContact CD1-CB 4.15Å; L228-V297 HydrophobicContact CD1-CG1 3.65Å; L228-V297 HydrophobicContact CD2-CG1 4.37Å; L293-V297 WeakPolarHBondContact O-CG2 3.36Å; L293-V297 PolarHBondContact O-N 2.97Å; V294-V297 PolarHBondContact O-N 3.22Å; I295-V297 VanDerWaalsContact C-N 3.29Å; I295-V297 PolarHBondContact O-N 2.9Å; V297-R299 VanDerWaalsContact C-N 3.32Å; V297-R299 PolarHBondContact O-N 2.87Å; V297-G300 PolarHBondContact O-N 3.11Å; V297-A302 WeakPolarHBondContact CA-O 3.23Å; V297-A302 HydrophobicContact CG2-CB 4.06Å; V297-E304 HydrophobicContact CG1-CB 4.37Å; V297-E304 HydrophobicContact CG1-CG 3.57Å; V297-V306 HydrophobicContact CG2-CG1 3.62Å; V297-M307 HydrophobicContact CG2-SD 4.4Å
298	I	98.4	Very high	97.5	Very high	23 Å²	23	33.5 Å²	33.5	12%	0.118	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-38.7	-178.4	-69.1	-70.7	0	0	0	111.9	F202 T221 K224 V225 L228 V294 I295 G300	F202-I298 HydrophobicContact CB-CG2 3.84Å; F202-I298 HydrophobicContact CD1-CB 4.35Å; F202-I298 HydrophobicContact CD1-CG2 4.04Å; F202-I298 HydrophobicContact CG-CG2 4.38Å; F202-I298 WeakPolarHBondContact O-CG2 3.33Å; T221-I298 HydrophobicContact CG2-CG2 3.94Å; K224-I298 HydrophobicContact CB-CD1 4.09Å; K224-I298 HydrophobicContact CD-CD1 3.88Å; K224-I298 HydrophobicContact CG-CD1 3.68Å; V225-I298 HydrophobicContact CG2-CD1 3.77Å; V225-I298 HydrophobicContact CG2-CG1 3.78Å; V225-I298 HydrophobicContact CG2-CG2 4.31Å; L228-I298 HydrophobicContact CD1-CD1 3.67Å; L228-I298 HydrophobicContact CD1-CG1 3.83Å; V294-I298 HydrophobicContact CG1-CG1 4.18Å; V294-I298 WeakPolarHBondContact O-CB 3.42Å; V294-I298 VanDerWaalsContact O-CG1 3.27Å; V294-I298 WeakPolarHBondContact O-CG1 3.33Å; V294-I298 PolarHBondContact O-N 3.31Å; I295-I298 PolarHBondContact O-N 2.96Å; I298-G300 PolarHBondContact O-N 2.94Å
299	R	96.8	Very high	97.4	Very high	14 Å²	14	34.5 Å²	34.5	5%	0.053	17%	0.168	C	C	.	.	H	α-helix	trans	-71.2	-16.1	175.7	-63.9	-175.1	65.3	67.9	7	112.8	V200 A201 S203 K205 I295 V297 F301 M384	V200-R299 PolarHBondContact O-NH1 3.21Å; V200-R299 VanDerWaalsContact O-NH1 3.14Å; A201-R299 WeakPolarHBondContact O-CD 3.49Å; A201-R299 VanDerWaalsContact O-CG 3.3Å; A201-R299 WeakPolarHBondContact O-CG 3.4Å; S203-R299 VanDerWaalsContact O-CG 3.3Å; S203-R299 WeakPolarHBondContact O-CG 3.3Å; S203-R299 PolarHBondContact O-NH1 2.88Å; S203-R299 VanDerWaalsContact O-NH1 3.08Å; S203-R299 PolarHBondContact OG-NH1 2.87Å; K205-R299 WeakPolarHBondContact CB-O 3.4Å; K205-R299 PolarHBondContact N-O 3.4Å; I295-R299 HydrophobicContact CG2-CG 4.07Å; I295-R299 WeakPolarHBondContact O-CB 3.4Å; I295-R299 WeakPolarHBondContact O-CG 3.35Å; I295-R299 PolarHBondContact O-N 3.37Å; V297-R299 VanDerWaalsContact C-N 3.32Å; V297-R299 PolarHBondContact O-N 2.87Å; R299-F301 HydrophobicContact CB-CD2 3.75Å; R299-F301 HydrophobicContact CB-CE2 4.04Å; R299-M384 VanDerWaalsContact CZ-SD 3.59Å; R299-M384 PolarHBondContact NH1-SD 3.34Å; R299-M384 VanDerWaalsContact NH1-SD 3.35Å
300	G	96.8	Very high	97.3	Very high	39 Å²	39	33.2 Å²	33.2	40%	0.402	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	25.4	-179.4	0	0	0	0	0	114.8	A296 V297 I298	A296-G300 PolarHBondContact O-N 2.97Å; V297-G300 PolarHBondContact O-N 3.11Å; I298-G300 PolarHBondContact O-N 2.94Å
301	F	96.4	Very high	97.3	Very high	62 Å²	62	35 Å²	35	27%	0.272	17%	0.17	S	C	.	.	S	Bend	trans	-85.5	-25.8	169.5	-74.3	-75.8	0	0	0	112.8	K205 A296 R299 L387 P388 F392	K205-F301 HydrophobicContact CB-CD2 4.42Å; K205-F301 HydrophobicContact CB-CE1 4.5Å; K205-F301 HydrophobicContact CB-CE2 3.78Å; K205-F301 HydrophobicContact CB-CZ 3.83Å; A296-F301 HydrophobicContact CB-CB 4.44Å; A296-F301 PolarHBondContact O-N 3.32Å; R299-F301 HydrophobicContact CB-CD2 3.75Å; R299-F301 HydrophobicContact CB-CE2 4.04Å; F301-L387 HydrophobicContact CD2-CB 3.92Å; F301-L387 HydrophobicContact CD2-CD1 4.13Å; F301-L387 HydrophobicContact CE2-CB 3.98Å; F301-L387 HydrophobicContact CE2-CD1 4.22Å; F301-L387 HydrophobicContact CG-CB 4.24Å; F301-L387 HydrophobicContact CZ-CB 4.34Å; F301-P388 HydrophobicContact CE1-CB 4.17Å; F301-P388 HydrophobicContact CE1-CG 3.7Å; F301-P388 HydrophobicContact CZ-CG 3.99Å; F301-F392 HydrophobicContact CB-CE2 4.06Å; F301-F392 WeakPolarHBondContact O-CD2 3.34Å
302	A	96.4	Very high	97.1	Very high	10 Å²	10	36.4 Å²	36.4	8%	0.083	18%	0.184	C	C	.	.	S	Bend	trans	-130.4	152.6	175	0	0	0	0	0	109.9	A296 V297 V306 F392	A296-A302 HydrophobicContact CB-CB 4.47Å; A296-A302 PolarHBondContact O-N 3.45Å; V297-A302 WeakPolarHBondContact CA-O 3.23Å; V297-A302 HydrophobicContact CG2-CB 4.06Å; A302-V306 HydrophobicContact CB-CB 4.46Å; A302-V306 HydrophobicContact CB-CG1 3.96Å; A302-F392 HydrophobicContact CB-CB 4.18Å; A302-F392 HydrophobicContact CB-CD1 3.76Å; A302-F392 HydrophobicContact CB-CD2 3.93Å; A302-F392 HydrophobicContact CB-CE1 4.05Å; A302-F392 HydrophobicContact CB-CE2 4.25Å; A302-F392 HydrophobicContact CB-CG 3.68Å; A302-F392 HydrophobicContact CB-CZ 4.3Å
303	K	96.1	Very high	96.9	Very high	138 Å²	138	42.9 Å²	42.9	60%	0.6	21%	0.214	S	C	*	.			trans	-83.5	158	172.9	-51.4	177.3	179.2	168.1	0	110.8	E305 V306	K303-E305 WeakPolarHBondContact CB-OE2 3.33Å; K303-E305 PolarHBondContact O-N 2.94Å; K303-V306 WeakPolarHBondContact O-CB 3.26Å; K303-V306 WeakPolarHBondContact O-CG1 3.45Å; K303-V306 PolarHBondContact O-N 3.45Å; K303-V306 VanDerWaalsContact O-N 3.13Å
304	E	96.4	Very high	96.6	Very high	88 Å²	88	46.1 Å²	46.1	41%	0.411	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.6	-175.9	-68.3	-177.7	-147.5	0	0	113.1	K224 L228 V297 V306 M307	K224-E304 WeakPolarHBondContact CE-OE1 3.49Å; K224-E304 IonicContact NZ-OE1 2.72Å; K224-E304 PolarHBondContact NZ-OE1 3.05Å; L228-E304 HydrophobicContact CD2-CG 4.17Å; V297-E304 HydrophobicContact CG1-CB 4.37Å; V297-E304 HydrophobicContact CG1-CG 3.57Å; E304-V306 PolarHBondContact O-N 2.64Å; E304-V306 VanDerWaalsContact O-N 3.11Å; E304-M307 VanDerWaalsContact O-CB 3.3Å; E304-M307 WeakPolarHBondContact O-CB 3.49Å; E304-M307 VanDerWaalsContact O-CG 3.28Å; E304-M307 WeakPolarHBondContact O-CG 3.25Å; E304-M307 PolarHBondContact O-N 2.94Å
305	E	95.8	Very high	96.3	Very high	122 Å²	122	50.8 Å²	50.8	57%	0.57	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21	179	-55.8	82	-178.4	0	0	112.6	K303 M307 E308 R309	K303-E305 WeakPolarHBondContact CB-OE2 3.33Å; K303-E305 PolarHBondContact O-N 2.94Å; E305-M307 PolarHBondContact O-N 3.23Å; E305-E308 PolarHBondContact O-N 3.37Å; E305-R309 WeakPolarHBondContact O-CD 3.43Å; E305-R309 PolarHBondContact O-N 2.84Å; E305-R309 VanDerWaalsContact O-N 3.15Å
306	V	96.7	Very high	96.2	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.024	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-28.2	174.4	81.9	0	0	0	0	111.8	L293 V297 A302 K303 E304 S310 V316 F392	L293-V306 HydrophobicContact CD1-CG1 3.76Å; L293-V306 HydrophobicContact CD1-CG2 4.26Å; L293-V306 HydrophobicContact CD2-CG1 4.43Å; L293-V306 HydrophobicContact CG-CG1 4.16Å; V297-V306 HydrophobicContact CG2-CG1 3.62Å; A302-V306 HydrophobicContact CB-CB 4.46Å; A302-V306 HydrophobicContact CB-CG1 3.96Å; K303-V306 WeakPolarHBondContact O-CB 3.26Å; K303-V306 WeakPolarHBondContact O-CG1 3.45Å; K303-V306 PolarHBondContact O-N 3.45Å; K303-V306 VanDerWaalsContact O-N 3.13Å; E304-V306 PolarHBondContact O-N 2.64Å; E304-V306 VanDerWaalsContact O-N 3.11Å; V306-S310 VanDerWaalsContact O-CB 3.27Å; V306-S310 WeakPolarHBondContact O-CB 3.34Å; V306-S310 PolarHBondContact O-N 3.11Å; V306-V316 HydrophobicContact CG2-CG1 3.79Å; V306-F392 HydrophobicContact CG2-CD1 4.33Å
307	M	96.4	Very high	96	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-53.8	179.9	-64	-65.7	-67	0	0	110.3	L228 L231 Y232 L293 V294 V297 E304 E305 S310	L228-M307 HydrophobicContact CD2-CG 4.24Å; L231-M307 HydrophobicContact CD1-CB 4.21Å; L231-M307 HydrophobicContact CD1-CG 4.44Å; Y232-M307 HydrophobicContact CD2-CE 4.44Å; Y232-M307 HydrophobicContact CE1-CE 4.05Å; Y232-M307 HydrophobicContact CE2-CE 3.73Å; Y232-M307 VanDerWaalsContact CZ-CE 3.49Å; Y232-M307 WeakPolarHBondContact OH-CE 3.47Å; L293-M307 HydrophobicContact CB-SD 4.49Å; L293-M307 HydrophobicContact CD2-SD 3.7Å; L293-M307 HydrophobicContact CG-SD 3.79Å; V294-M307 HydrophobicContact CG2-CE 3.85Å; V294-M307 HydrophobicContact CG2-SD 4.26Å; V297-M307 HydrophobicContact CG2-SD 4.4Å; E304-M307 VanDerWaalsContact O-CB 3.3Å; E304-M307 WeakPolarHBondContact O-CB 3.49Å; E304-M307 VanDerWaalsContact O-CG 3.28Å; E304-M307 WeakPolarHBondContact O-CG 3.25Å; E304-M307 PolarHBondContact O-N 2.94Å; E305-M307 PolarHBondContact O-N 3.23Å; M307-S310 PolarHBondContact O-N 2.83Å; M307-S310 PolarHBondContact O-OG 3.32Å
308	E	95.6	Very high	96	Very high	141 Å²	141	54.7 Å²	54.7	66%	0.659	27%	0.271	S	S	*	.	H	α-helix	trans	-68.8	-42.9	179.7	-66.6	-170.5	168.2	0	0	112.3	E305 S310 W311	E305-E308 PolarHBondContact O-N 3.37Å; E308-S310 PolarHBondContact O-N 3.2Å; E308-W311 HydrophobicContact CB-CZ3 4.45Å; E308-W311 HydrophobicContact CG-CZ3 4.07Å; E308-W311 PolarHBondContact O-N 3.31Å; E308-W311 VanDerWaalsContact O-N 3.14Å
309	R	95.8	Very high	95.9	Very high	49 Å²	49	53.6 Å²	53.6	19%	0.185	27%	0.266	C	S	.	.	H	α-helix	trans	-54.4	-38.3	174.7	-82.1	154.4	39.7	86.4	-17.7	112.5	E305 W311 G312 E314 F392 E393 V396	E305-R309 WeakPolarHBondContact O-CD 3.43Å; E305-R309 PolarHBondContact O-N 2.84Å; E305-R309 VanDerWaalsContact O-N 3.15Å; R309-W311 PolarHBondContact O-N 2.81Å; R309-W311 VanDerWaalsContact O-N 3.12Å; R309-G312 WeakPolarHBondContact O-CA 3.27Å; R309-G312 PolarHBondContact O-N 2.97Å; R309-E314 IonicContact CZ-OE2 3.97Å; R309-E314 IonicContact NH1-OE2 3.51Å; R309-E314 PolarHBondContact NH1-OE2 3.29Å; R309-F392 PolarHBondContact NH2-O 3.45Å; R309-E393 IonicContact NH2-OE2 3.37Å; R309-E393 PolarHBondContact NH2-OE2 3.24Å; R309-V396 VanDerWaalsContact CZ-CG2 3.42Å
310	S	97.1	Very high	96	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.1	-177.6	77.8	0	0	0	0	114.2	N240 F241 V306 M307 E308	N240-S310 PolarHBondContact ND2-O 3.15Å; F241-S310 VanDerWaalsContact CE2-OG 3.26Å; F241-S310 WeakPolarHBondContact CE2-OG 3.25Å; F241-S310 WeakPolarHBondContact CZ-OG 3.21Å; V306-S310 VanDerWaalsContact O-CB 3.27Å; V306-S310 WeakPolarHBondContact O-CB 3.34Å; V306-S310 PolarHBondContact O-N 3.11Å; M307-S310 PolarHBondContact O-N 2.83Å; M307-S310 PolarHBondContact O-OG 3.32Å; E308-S310 PolarHBondContact O-N 3.2Å
311	W	97.6	Very high	96	Very high	38 Å²	38	54.8 Å²	54.8	14%	0.144	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-11.2	173.6	-55.4	-46.2	0	0	0	113.6	L231 Y232 H236 F241 E308 R309	L231-W311 HydrophobicContact CB-CH2 3.89Å; Y232-W311 AromaticContact CD1-CZ2 3.61Å; Y232-W311 HydrophobicContact CD1-CZ2 3.61Å; Y232-W311 AromaticContact CE1-CZ2 3.82Å; Y232-W311 HydrophobicContact CE1-CZ2 3.82Å; H236-W311 HydrophobicContact CB-CD2 4.18Å; H236-W311 HydrophobicContact CB-CG 3.9Å; F241-W311 AromaticContact CE2-CD1 3.87Å; F241-W311 AromaticContact CE2-NE1 3.73Å; E308-W311 HydrophobicContact CB-CZ3 4.45Å; E308-W311 HydrophobicContact CG-CZ3 4.07Å; E308-W311 PolarHBondContact O-N 3.31Å; E308-W311 VanDerWaalsContact O-N 3.14Å; R309-W311 PolarHBondContact O-N 2.81Å; R309-W311 VanDerWaalsContact O-N 3.12Å
312	G	95.8	Very high	96	Very high	30 Å²	30	52.6 Å²	52.6	31%	0.309	25%	0.252	S	S	.	.	S	Bend	trans	-70.9	-168.8	175.1	0	0	0	0	0	113.3	H239 R309 E314	H239-G312 PolarHBondContact NE2-O 3.43Å; R309-G312 WeakPolarHBondContact O-CA 3.27Å; R309-G312 PolarHBondContact O-N 2.97Å; G312-E314 VanDerWaalsContact C-N 3.33Å
313	Q	93.6	Very high	95.8	Very high	135 Å²	135	52.6 Å²	52.6	63%	0.631	25%	0.253	S	S	*	.	S	Bend	trans	-77.2	-22.6	179	-64.4	-62.9	-50.7	0	0	112.8	P247	P247-Q313 VanDerWaalsContact CB-OE1 3.28Å; P247-Q313 WeakPolarHBondContact CG-O 3.35Å
314	E	92.4	Very high	95.7	Very high	69 Å²	69	47.1 Å²	47.1	32%	0.322	23%	0.23	S	C	.	.	S	Bend	trans	-62.1	146.6	-178.6	-69.6	170.9	-153.9	0	0	111.9	H239 N240 R309 G312	H239-E314 PolarHBondContact CE1-O 2.89Å; N240-E314 PolarHBondContact ND2-O 3.27Å; R309-E314 IonicContact CZ-OE2 3.97Å; R309-E314 IonicContact NH1-OE2 3.51Å; R309-E314 PolarHBondContact NH1-OE2 3.29Å; G312-E314 VanDerWaalsContact C-N 3.33Å
315	K	93.1	Very high	95.7	Very high	97 Å²	97	43 Å²	43	42%	0.422	21%	0.211	S	C	.	.			trans	-84	128.9	168.3	-73.7	-56.9	-170.7	-174.3	0	109.6	H239 N240 K245 T395	H239-K315 PolarHBondContact ND1-NZ 3.15Å; N240-K315 WeakPolarHBondContact OD1-CA 3.49Å; N240-K315 WeakPolarHBondContact OD1-CD 3.43Å; K245-K315 PolarHBondContact O-NZ 2.86Å; K315-T395 HydrophobicContact CB-CG2 4.19Å; K315-T395 WeakPolarHBondContact O-CB 3.43Å; K315-T395 WeakPolarHBondContact O-CG2 3.34Å; K315-T395 PolarHBondContact O-OG1 3.07Å
316	V	95.5	Very high	95.9	Very high	9 Å²	9	37.6 Å²	37.6	6%	0.055	19%	0.186	C	C	.	.			trans	-120.4	128.7	175.8	-179.4	0	0	0	0	107.5	N240 V306 V318	N240-V316 PolarHBondContact OD1-N 3.2Å; V306-V316 HydrophobicContact CG2-CG1 3.79Å; V316-V318 VanDerWaalsContact C-N 3.25Å; V316-V318 HydrophobicContact CB-CG2 4.14Å; V316-V318 HydrophobicContact CG1-CG2 3.9Å; V316-V318 PolarHBondContact O-N 3.16Å
317	D	95.1	Very high	96	Very high	79 Å²	79	37.5 Å²	37.5	42%	0.422	19%	0.185	S	C	.	.			trans	-76.7	79.7	174.9	-175.3	26.3	0	0	0	110.7	P319 H390	D317-P319 WeakPolarHBondContact O-CD 3.31Å; D317-H390 VanDerWaalsContact CG-ND1 3.3Å; D317-H390 PolarHBondContact O-ND1 2.89Å; D317-H390 IonicContact OD1-CE1 3.92Å; D317-H390 IonicContact OD1-ND1 2.92Å; D317-H390 IonicContact OD2-CE1 3.96Å; D317-H390 IonicContact OD2-CG 3.29Å; D317-H390 IonicContact OD2-ND1 3.87Å; D317-H390 PolarHBondContact OD2-ND1 2.89Å
318	V	97.9	Very high	96.1	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	19%	0.185	C	C	.	.			trans	-74.7	120.7	-176.2	-179.9	0	0	0	0	111	N240 F241 K289 L293 V316	N240-V318 HydrophobicContact CB-CG2 4.1Å; F241-V318 HydrophobicContact CD1-CG1 4.18Å; F241-V318 HydrophobicContact CE1-CG1 4.13Å; K289-V318 HydrophobicContact CB-CB 4.47Å; K289-V318 HydrophobicContact CB-CG1 3.66Å; K289-V318 HydrophobicContact CD-CB 4.15Å; K289-V318 HydrophobicContact CD-CG1 4.23Å; K289-V318 VanDerWaalsContact CE-O 3.26Å; K289-V318 WeakPolarHBondContact CE-O 3.46Å; K289-V318 HydrophobicContact CG-CB 4.43Å; K289-V318 HydrophobicContact CG-CG1 4.01Å; K289-V318 VanDerWaalsContact O-CG1 3.23Å; K289-V318 WeakPolarHBondContact O-CG1 3.32Å; L293-V318 HydrophobicContact CB-CG1 3.94Å; L293-V318 HydrophobicContact CD1-CG1 4.46Å; L293-V318 HydrophobicContact CD2-CG2 4.49Å; V316-V318 VanDerWaalsContact C-N 3.25Å; V316-V318 HydrophobicContact CB-CG2 4.14Å; V316-V318 HydrophobicContact CG1-CG2 3.9Å; V316-V318 PolarHBondContact O-N 3.16Å
319	P	97.8	Very high	96.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.161	C	C	.	.			trans	-60.2	140.8	177	-22.3	31.6	0	0	0	111.9	K289 A296 D317 W383 L387 H390 F392	K289-P319 WeakPolarHBondContact CA-O 3.31Å; A296-P319 HydrophobicContact CB-CG 4.22Å; D317-P319 WeakPolarHBondContact O-CD 3.31Å; P319-W383 HydrophobicContact CB-CZ2 3.88Å; P319-L387 HydrophobicContact CB-CD2 3.81Å; P319-L387 HydrophobicContact CG-CD2 3.93Å; P319-H390 HydrophobicContact CG-CB 4.4Å; P319-F392 HydrophobicContact CG-CE1 3.86Å; P319-F392 HydrophobicContact CG-CZ 3.58Å
320	K	97.4	Very high	96.3	Very high	78 Å²	78	34.7 Å²	34.7	34%	0.339	17%	0.17	S	C	.	.			trans	-106.9	103.8	179.5	-176.5	-178.3	67.4	-177.7	0	110.2	H285 R288 K289 W383	H285-K320 HydrophobicContact CB-CD 3.74Å; H285-K320 HydrophobicContact CB-CG 4.31Å; H285-K320 VanDerWaalsContact CG-CD 3.49Å; R288-K320 HydrophobicContact CB-CG 3.95Å; K289-K320 HydrophobicContact CG-CB 4.05Å; K289-K320 HydrophobicContact CG-CG 4.33Å; K320-W383 PolarHBondContact O-NE1 3.08Å
321	A	97.5	Very high	96.4	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.			trans	-53.6	157.8	176.3	0	0	0	0	0	112.4	R288 I291 W383	R288-A321 HydrophobicContact CB-CB 4.46Å; R288-A321 PolarHBondContact NE-O 2.9Å; R288-A321 PolarHBondContact NH2-O 2.63Å; R288-A321 WeakPolarHBondContact O-CB 3.41Å; R288-A321 PolarHBondContact O-N 2.9Å; R288-A321 VanDerWaalsContact O-N 3.08Å; I291-A321 HydrophobicContact CG2-CB 4.22Å; A321-W383 HydrophobicContact CB-CH2 4.36Å; A321-W383 HydrophobicContact CB-CZ2 4.26Å
322	P	95.7	Very high	96.4	Very high	15 Å²	15	34 Å²	34	10%	0.097	17%	0.168	C	C	.	.			trans	-55.3	160.3	176.7	-28.1	37	0	0	0	114	Y195 R288 M380 W383	Y195-P322 VanDerWaalsContact CE2-O 3.29Å; Y195-P322 WeakPolarHBondContact CE2-O 3.37Å; Y195-P322 WeakPolarHBondContact OH-CD 3.36Å; Y195-P322 PolarHBondContact OH-O 2.92Å; R288-P322 PolarHBondContact NE-O 3.31Å; P322-M380 HydrophobicContact CG-CE 4.47Å; P322-W383 HydrophobicContact CG-CB 3.66Å; P322-W383 HydrophobicContact CG-CD2 4.3Å; P322-W383 HydrophobicContact CG-CG 3.84Å
323	G	93.4	Very high	96.4	Very high	10 Å²	10	32.6 Å²	32.6	10%	0.103	15%	0.154	C	C	.	.	S	Bend	trans	-84.2	-20.5	175.5	0	0	0	0	0	113.6	G325 L326	G323-G325 PolarHBondContact O-N 3.38Å; G323-L326 WeakPolarHBondContact O-CB 3.03Å; G323-L326 PolarHBondContact O-N 3.23Å; G323-L326 VanDerWaalsContact O-N 3.13Å
324	L	93.9	Very high	96.4	Very high	24 Å²	24	30 Å²	30	13%	0.126	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-47.7	-170.4	176.3	65.1	0	0	0	113	L326 I370 T373 E374	L324-L326 VanDerWaalsContact C-N 3.26Å; L324-L326 PolarHBondContact O-N 3.04Å; L324-I370 HydrophobicContact CD1-CG1 4.49Å; L324-I370 HydrophobicContact CG-CG2 4.48Å; L324-I370 WeakPolarHBondContact O-CG1 3.48Å; L324-T373 HydrophobicContact CD1-CG2 3.94Å; L324-T373 HydrophobicContact CD2-CG2 3.43Å; L324-T373 VanDerWaalsContact CD2-CG2 3.43Å; L324-T373 HydrophobicContact CG-CG2 4.34Å; L324-E374 HydrophobicContact CD2-CG 3.96Å
325	G	96.6	Very high	96.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.3	-177.5	0	0	0	0	0	114.7	Y195 M196 G323	Y195-G325 CarbonylContact C-O 3.53Å; Y195-G325 VanDerWaalsContact CA-O 3.26Å; Y195-G325 WeakPolarHBondContact CA-O 3.43Å; M196-G325 PolarHBondContact N-O 3.23Å; M196-G325 WeakPolarHBondContact O-CA 2.9Å; G323-G325 PolarHBondContact O-N 3.38Å
326	L	98.4	Very high	96.2	Very high	10 Å²	10	31.1 Å²	31.1	5%	0.052	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	126.8	-171.2	-170.9	66.4	0	0	0	111.6	V141 S142 Y193 Y195 I287 R288 G323 L324	V141-L326 HydrophobicContact CG1-CB 4.11Å; V141-L326 HydrophobicContact CG1-CD2 3.94Å; V141-L326 HydrophobicContact CG1-CG 3.96Å; V141-L326 WeakPolarHBondContact CG1-O 3.49Å; V141-L326 HydrophobicContact CG2-CB 4.26Å; V141-L326 HydrophobicContact CG2-CD2 4.03Å; S142-L326 PolarHBondContact N-O 3.11Å; Y193-L326 HydrophobicContact CD1-CD1 3.91Å; Y193-L326 HydrophobicContact CD1-CD2 4.47Å; Y193-L326 HydrophobicContact CD1-CG 4.07Å; Y193-L326 HydrophobicContact CG-CD1 4.32Å; Y195-L326 HydrophobicContact CD2-CB 3.71Å; Y195-L326 HydrophobicContact CD2-CD1 3.93Å; Y195-L326 HydrophobicContact CD2-CG 4.42Å; Y195-L326 HydrophobicContact CE2-CB 4.03Å; I287-L326 HydrophobicContact CB-CD1 4.38Å; I287-L326 HydrophobicContact CD1-CD1 4.42Å; I287-L326 HydrophobicContact CG2-CD1 3.74Å; R288-L326 HydrophobicContact CG-CD2 4.16Å; G323-L326 WeakPolarHBondContact O-CB 3.03Å; G323-L326 PolarHBondContact O-N 3.23Å; G323-L326 VanDerWaalsContact O-N 3.13Å; L324-L326 VanDerWaalsContact C-N 3.26Å; L324-L326 PolarHBondContact O-N 3.04Å
327	V	98.7	Very high	96	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.5	179.4	-171.1	0	0	0	0	109.6	S142 A144 Y193 A194 E329 I366 I370	S142-V327 WeakPolarHBondContact O-CA 3.43Å; A144-V327 HydrophobicContact CB-CG1 4.23Å; Y193-V327 CarbonylContact C-O 3.51Å; Y193-V327 VanDerWaalsContact CA-O 3.23Å; Y193-V327 WeakPolarHBondContact CA-O 3.41Å; Y193-V327 WeakPolarHBondContact CD1-O 3.44Å; A194-V327 PolarHBondContact N-O 2.85Å; A194-V327 PolarHBondContact O-N 3.11Å; V327-E329 PolarHBondContact O-N 3.12Å; V327-I366 HydrophobicContact CG1-CD1 4.15Å; V327-I366 HydrophobicContact CG1-CG2 4.25Å; V327-I366 HydrophobicContact CG2-CG2 3.68Å; V327-I370 HydrophobicContact CG2-CD1 3.95Å
328	L	98.8	Very high	95.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	105.9	165	172.2	66.8	0	0	0	109.2	A135 T137 S142 A143 A144 G145 Q146 R191 Y193 V331	A135-L328 HydrophobicContact CB-CD2 3.52Å; T137-L328 HydrophobicContact CG2-CB 4.48Å; S142-L328 PolarHBondContact O-N 2.85Å; A143-L328 CarbonylContact C-O 3.54Å; A143-L328 WeakPolarHBondContact CA-O 3.06Å; A143-L328 HydrophobicContact CB-CB 3.81Å; A143-L328 HydrophobicContact CB-CD2 4.27Å; A143-L328 HydrophobicContact CB-CG 4.44Å; A144-L328 PolarHBondContact N-O 3.24Å; G145-L328 PolarHBondContact N-O 3.15Å; Q146-L328 HydrophobicContact CB-CD2 4.14Å; R191-L328 HydrophobicContact CB-CD1 4.06Å; R191-L328 HydrophobicContact CG-CD1 4.33Å; Y193-L328 HydrophobicContact CD1-CB 3.99Å; Y193-L328 HydrophobicContact CD1-CD1 4.34Å; Y193-L328 HydrophobicContact CD2-CD1 4.26Å; Y193-L328 HydrophobicContact CE1-CB 3.61Å; Y193-L328 HydrophobicContact CE1-CD1 3.9Å; Y193-L328 HydrophobicContact CE1-CG 4.33Å; Y193-L328 HydrophobicContact CE2-CD1 3.82Å; L328-V331 HydrophobicContact CD1-CG2 4.29Å; L328-V331 HydrophobicContact CD2-CG2 4.14Å
329	E	98.3	Very high	95.3	Very high	32 Å²	32	45.7 Å²	45.7	15%	0.15	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	-52.5	-179.2	-75.8	-68.2	157.1	0	0	111.6	G145 T192 A194 V327 K362	G145-E329 WeakPolarHBondContact CA-O 3.34Å; G145-E329 PolarHBondContact N-O 2.55Å; T192-E329 HydrophobicContact CG2-CB 4.28Å; T192-E329 WeakPolarHBondContact O-CB 3.37Å; T192-E329 PolarHBondContact O-N 3.23Å; A194-E329 HydrophobicContact CB-CG 3.53Å; V327-E329 PolarHBondContact O-N 3.12Å; E329-K362 WeakPolarHBondContact OE1-CD 3.09Å; E329-K362 IonicContact OE1-NZ 2.68Å; E329-K362 IonicContact OE2-NZ 2.96Å; E329-K362 PolarHBondContact OE2-NZ 3.26Å
330	R	98.3	Very high	94.6	Very high	100 Å²	100	47.6 Å²	47.6	38%	0.377	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	142.9	-170.7	-170.3	167.4	177.1	159.4	3.1	112.9	R191 T192	R191-R330 CarbonylContact C-O 3.58Å; R191-R330 WeakPolarHBondContact CA-O 3.48Å; T192-R330 PolarHBondContact N-O 2.8Å; T192-R330 PolarHBondContact O-N 3.39Å; T192-R330 VanDerWaalsContact O-N 3.11Å
331	V	98.1	Very high	93.7	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.03	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.6	169	178	0	0	0	0	108	C134 G145 V147 C188 L328 F333	C134-V331 HydrophobicContact CB-CB 4.46Å; C134-V331 HydrophobicContact CB-CG1 3.73Å; C134-V331 HydrophobicContact CB-CG2 3.85Å; G145-V331 WeakPolarHBondContact O-CG2 3.43Å; V147-V331 HydrophobicContact CB-CB 4.29Å; V147-V331 HydrophobicContact CB-CG1 4.34Å; V147-V331 HydrophobicContact CB-CG2 4.3Å; V147-V331 HydrophobicContact CG2-CB 3.94Å; V147-V331 HydrophobicContact CG2-CG1 4.42Å; V147-V331 HydrophobicContact CG2-CG2 4.17Å; C188-V331 HydrophobicContact CB-CG1 3.98Å; C188-V331 WeakPolarHBondContact SG-CG1 3.35Å; L328-V331 HydrophobicContact CD1-CG2 4.29Å; L328-V331 HydrophobicContact CD2-CG2 4.14Å; V331-F333 HydrophobicContact CB-CE2 4.15Å; V331-F333 HydrophobicContact CG1-CD2 4.22Å; V331-F333 HydrophobicContact CG1-CE1 4.33Å; V331-F333 HydrophobicContact CG1-CE2 3.43Å; V331-F333 VanDerWaalsContact CG1-CE2 3.43Å; V331-F333 HydrophobicContact CG1-CZ 3.51Å
332	H	97.6	Very high	92.8	Very high	17 Å²	17	48.1 Å²	48.1	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.6	-174.9	-57.2	-89.5	0	0	0	111.3	D189 A190 T192	D189-H332 PolarHBondContact N-O 2.97Å; A190-H332 HydrophobicContact CB-CB 4.1Å; A190-H332 PolarHBondContact O-CD2 3.31Å; A190-H332 PolarHBondContact O-N 3.48Å; T192-H332 PolarHBondContact OG1-NE2 3.38Å
333	F	96.5	Very high	92.2	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.009	25%	0.245	C	C	.	.			trans	-131	30.4	-176.3	-68	-75.6	0	0	0	111.9	V147 F182 N187 C188 D189 V331 R335 Y336 N337 L349	V147-F333 HydrophobicContact CB-CE2 4.27Å; V147-F333 HydrophobicContact CB-CZ 4.32Å; V147-F333 HydrophobicContact CG1-CE2 3.9Å; V147-F333 HydrophobicContact CG1-CZ 3.81Å; V147-F333 HydrophobicContact CG2-CE2 4.22Å; F182-F333 HydrophobicContact CE2-CD1 4.47Å; F182-F333 HydrophobicContact CE2-CE1 4.49Å; F182-F333 HydrophobicContact CZ-CD1 4.05Å; F182-F333 AromaticContact CZ-CE1 3.69Å; F182-F333 HydrophobicContact CZ-CE1 3.69Å; F182-F333 HydrophobicContact CZ-CZ 4.3Å; N187-F333 WeakPolarHBondContact O-CD1 3.48Å; C188-F333 HydrophobicContact CB-CD1 4.38Å; C188-F333 HydrophobicContact CB-CE1 3.83Å; C188-F333 HydrophobicContact CB-CZ 4.32Å; D189-F333 WeakPolarHBondContact OD2-CA 3.3Å; V331-F333 HydrophobicContact CB-CE2 4.15Å; V331-F333 HydrophobicContact CG1-CD2 4.22Å; V331-F333 HydrophobicContact CG1-CE1 4.33Å; V331-F333 HydrophobicContact CG1-CE2 3.43Å; V331-F333 VanDerWaalsContact CG1-CE2 3.43Å; V331-F333 HydrophobicContact CG1-CZ 3.51Å; F333-R335 VanDerWaalsContact C-N 3.27Å; F333-R335 PolarHBondContact O-N 2.89Å; F333-Y336 WeakPolarHBondContact O-CA 3.48Å; F333-Y336 WeakPolarHBondContact O-CB 3.24Å; F333-Y336 PolarHBondContact O-N 3.08Å; F333-N337 PolarHBondContact O-N 3.27Å; F333-L349 HydrophobicContact CB-CB 3.96Å; F333-L349 HydrophobicContact CB-CD1 4.38Å; F333-L349 HydrophobicContact CD1-CD1 4.12Å; F333-L349 HydrophobicContact CD2-CB 3.86Å; F333-L349 HydrophobicContact CD2-CD1 4.23Å; F333-L349 HydrophobicContact CE1-CD1 4.47Å; F333-L349 HydrophobicContact CG-CB 4.04Å; F333-L349 HydrophobicContact CG-CD1 4Å
334	D	93.4	Very high	91.4	Very high	79 Å²	79	54 Å²	54	42%	0.422	28%	0.28	S	S	.	.	H	α-helix	trans	-49.2	-43.3	-175.7	-54	-24.4	0	0	0	112.8	D189 R278 N337 K338	D189-D334 PolarHBondContact OD2-N 3.18Å; R278-D334 IonicContact NH2-OD2 3.23Å; R278-D334 PolarHBondContact NH2-OD2 3.09Å; D334-N337 PolarHBondContact O-N 2.9Å; D334-K338 WeakPolarHBondContact O-CB 3.2Å; D334-K338 PolarHBondContact O-N 3.44Å
335	R	91.1	Very high	90.6	Very high	184 Å²	184	59.6 Å²	59.6	69%	0.694	31%	0.309	S	S	*	.	H	α-helix	trans	-70	-38.4	178.7	-67.6	-174.2	-170.8	165.6	-2.4	112.1	D189 F333 R339	D189-R335 VanDerWaalsContact OD1-CB 3.32Å; D189-R335 WeakPolarHBondContact OD1-CB 3.16Å; D189-R335 WeakPolarHBondContact OD1-CD 3.33Å; D189-R335 WeakPolarHBondContact OD1-CG 3.48Å; D189-R335 IonicContact OD1-NE 3.45Å; D189-R335 PolarHBondContact OD2-N 3.44Å; F333-R335 VanDerWaalsContact C-N 3.27Å; F333-R335 PolarHBondContact O-N 2.89Å; R335-R339 WeakPolarHBondContact O-CB 2.96Å; R335-R339 PolarHBondContact O-N 2.89Å; R335-R339 VanDerWaalsContact O-N 3.11Å
336	Y	90.4	Very high	89.9	Confident	7 Å²	7	62.2 Å²	62.2	3%	0.027	32%	0.321	C	S	.	.	H	α-helix	trans	-64.2	-47	174.6	171.5	-86.1	0	0	0	110.4	F182 F333 K338 R339 F340 L349	F182-Y336 AromaticContact CD2-CD2 3.63Å; F182-Y336 HydrophobicContact CD2-CD2 3.63Å; F182-Y336 AromaticContact CD2-CE2 3.47Å; F182-Y336 HydrophobicContact CD2-CE2 3.47Å; F182-Y336 VanDerWaalsContact CD2-CE2 3.47Å; F182-Y336 AromaticContact CE2-CD2 3.5Å; F182-Y336 HydrophobicContact CE2-CD2 3.5Å; F182-Y336 VanDerWaalsContact CE2-CD2 3.5Å; F182-Y336 AromaticContact CE2-CE2 3.69Å; F182-Y336 HydrophobicContact CE2-CE2 3.69Å; F182-Y336 AromaticContact CE2-CG 3.98Å; F182-Y336 HydrophobicContact CE2-CG 3.98Å; F333-Y336 WeakPolarHBondContact O-CA 3.48Å; F333-Y336 WeakPolarHBondContact O-CB 3.24Å; F333-Y336 PolarHBondContact O-N 3.08Å; Y336-K338 VanDerWaalsContact C-N 3.33Å; Y336-K338 PolarHBondContact O-N 3.2Å; Y336-R339 PolarHBondContact O-N 3.3Å; Y336-R339 VanDerWaalsContact O-N 3.1Å; Y336-F340 AromaticContact CD2-CD2 3.49Å; Y336-F340 HydrophobicContact CD2-CD2 3.49Å; Y336-F340 VanDerWaalsContact CD2-CD2 3.49Å; Y336-F340 AromaticContact CD2-CE2 3.99Å; Y336-F340 HydrophobicContact CD2-CE2 3.99Å; Y336-F340 HydrophobicContact CD2-CG 4.45Å; Y336-F340 HydrophobicContact CE1-CB 4.45Å; Y336-F340 HydrophobicContact CE2-CB 4.3Å; Y336-F340 AromaticContact CE2-CD2 3.53Å; Y336-F340 HydrophobicContact CE2-CD2 3.53Å; Y336-F340 HydrophobicContact CE2-CE2 4.13Å; Y336-F340 HydrophobicContact CE2-CG 4.14Å; Y336-F340 HydrophobicContact CG-CD2 4.18Å; Y336-F340 PolarHBondContact O-N 3.15Å; Y336-L349 HydrophobicContact CD1-CB 4.27Å; Y336-L349 HydrophobicContact CD1-CD1 3.64Å; Y336-L349 HydrophobicContact CD1-CG 3.79Å; Y336-L349 HydrophobicContact CE1-CB 4.39Å; Y336-L349 HydrophobicContact CE1-CD1 3.65Å; Y336-L349 HydrophobicContact CE1-CG 3.54Å; Y336-L349 HydrophobicContact CG-CD1 4.16Å
337	N	92	Very high	89.2	Confident	10 Å²	10	66.4 Å²	66.4	5%	0.053	34%	0.341	C	S	.	.	H	α-helix	trans	-63	-39.6	179.7	-69.3	-6	0	0	0	111.6	F333 D334 R339 G341 R348 L349 E350	F333-N337 PolarHBondContact O-N 3.27Å; D334-N337 PolarHBondContact O-N 2.9Å; N337-R339 VanDerWaalsContact C-N 3.31Å; N337-R339 PolarHBondContact O-N 3.35Å; N337-G341 WeakPolarHBondContact O-CA 3.37Å; N337-G341 PolarHBondContact O-N 3.08Å; N337-R348 HydrophobicContact CB-CG 4.25Å; N337-L349 PolarHBondContact OD1-N 2.88Å; N337-E350 WeakPolarHBondContact ND2-CG 3.32Å; N337-E350 PolarHBondContact ND2-OE1 2.91Å
338	K	90.3	Very high	88.9	Confident	193 Å²	193	72.3 Å²	72.3	84%	0.839	36%	0.363	S	S	*	.	H	α-helix	trans	-63.7	-36.3	174.4	-174.1	174.4	-179.1	176.7	0	112.6	D334 Y336	D334-K338 WeakPolarHBondContact O-CB 3.2Å; D334-K338 PolarHBondContact O-N 3.44Å; Y336-K338 VanDerWaalsContact C-N 3.33Å; Y336-K338 PolarHBondContact O-N 3.2Å
339	R	86.6	Confident	88.6	Confident	192 Å²	192	72.6 Å²	72.6	73%	0.725	36%	0.364	S	S	*	.	H	α-helix	trans	-81	-40.8	-176.6	-177.6	172.9	175.8	178.4	1.5	113.5	R335 Y336 N337	R335-R339 WeakPolarHBondContact O-CB 2.96Å; R335-R339 PolarHBondContact O-N 2.89Å; R335-R339 VanDerWaalsContact O-N 3.11Å; Y336-R339 PolarHBondContact O-N 3.3Å; Y336-R339 VanDerWaalsContact O-N 3.1Å; N337-R339 VanDerWaalsContact C-N 3.31Å; N337-R339 PolarHBondContact O-N 3.35Å
340	F	82.9	Confident	88.4	Confident	41 Å²	41	73.5 Å²	73.5	18%	0.18	37%	0.369	C	S	.	.	H	α-helix	trans	-118.2	-21.8	-170	-63	-73.4	0	0	0	113.4	Y336 G342 D343 H346	Y336-F340 AromaticContact CD2-CD2 3.49Å; Y336-F340 HydrophobicContact CD2-CD2 3.49Å; Y336-F340 VanDerWaalsContact CD2-CD2 3.49Å; Y336-F340 AromaticContact CD2-CE2 3.99Å; Y336-F340 HydrophobicContact CD2-CE2 3.99Å; Y336-F340 HydrophobicContact CD2-CG 4.45Å; Y336-F340 HydrophobicContact CE1-CB 4.45Å; Y336-F340 HydrophobicContact CE2-CB 4.3Å; Y336-F340 AromaticContact CE2-CD2 3.53Å; Y336-F340 HydrophobicContact CE2-CD2 3.53Å; Y336-F340 HydrophobicContact CE2-CE2 4.13Å; Y336-F340 HydrophobicContact CE2-CG 4.14Å; Y336-F340 HydrophobicContact CG-CD2 4.18Å; Y336-F340 PolarHBondContact O-N 3.15Å; F340-G342 PolarHBondContact O-N 2.95Å; F340-D343 PolarHBondContact O-N 3.08Å; F340-D343 VanDerWaalsContact O-OD1 3.1Å; F340-H346 HydrophobicContact CB-CB 3.95Å
341	G	78.8	Confident	88.2	Confident	15 Å²	15	69.4 Å²	69.4	16%	0.155	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	11.6	-172	0	0	0	0	0	116.4	N337 R348	N337-G341 WeakPolarHBondContact O-CA 3.37Å; N337-G341 PolarHBondContact O-N 3.08Å; G341-R348 PolarHBondContact O-NE 3.45Å; G341-R348 VanDerWaalsContact O-NE 3.15Å
342	G	79.8	Confident	88.1	Confident	74 Å²	74	74.2 Å²	74.2	76%	0.763	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137	9.4	178.4	0	0	0	0	0	113.6	F340 G344	F340-G342 PolarHBondContact O-N 2.95Å; G342-G344 VanDerWaalsContact C-N 3.35Å
343	D	81.7	Confident	88	Confident	67 Å²	67	84.5 Å²	84.5	36%	0.358	42%	0.417	S	S	.	.	S	Bend	trans	-87.7	-2.3	-177.3	66.9	16.3	0	0	0	114.1	F340 L345 H346	F340-D343 PolarHBondContact O-N 3.08Å; F340-D343 VanDerWaalsContact O-OD1 3.1Å; D343-L345 VanDerWaalsContact O-CD1 3.32Å; D343-L345 WeakPolarHBondContact O-CD1 3.35Å; D343-L345 PolarHBondContact O-N 2.92Å; D343-L345 WeakPolarHBondContact OD1-CA 3.27Å; D343-L345 PolarHBondContact OD1-N 3.23Å; D343-H346 VanDerWaalsContact CG-ND1 3.33Å; D343-H346 IonicContact OD1-CG 3.49Å; D343-H346 PolarHBondContact OD1-N 2.96Å; D343-H346 IonicContact OD1-ND1 3.04Å; D343-H346 PolarHBondContact OD1-ND1 3.41Å; D343-H346 IonicContact OD2-CE1 2.81Å; D343-H346 IonicContact OD2-CG 3.66Å; D343-H346 IonicContact OD2-ND1 2.64Å; D343-H346 PolarHBondContact OD2-ND1 3.31Å
344	G	77.2	Confident	88	Confident	81 Å²	81	86.1 Å²	86.1	84%	0.835	43%	0.425	S	S	*	.	S	Bend	trans	75.8	-4.9	-179.3	0	0	0	0	0	114.8	G342	G342-G344 VanDerWaalsContact C-N 3.35Å
345	L	77.4	Confident	88.2	Confident	141 Å²	141	86.4 Å²	86.4	74%	0.738	42%	0.423	S	S	*	.	S	Bend	trans	-109	-32.8	178.5	-76.7	92.8	0	0	0	112.8	D343	D343-L345 VanDerWaalsContact O-CD1 3.32Å; D343-L345 WeakPolarHBondContact O-CD1 3.35Å; D343-L345 PolarHBondContact O-N 2.92Å; D343-L345 WeakPolarHBondContact OD1-CA 3.27Å; D343-L345 PolarHBondContact OD1-N 3.23Å
346	H	81.3	Confident	88.5	Confident	55 Å²	55	84 Å²	84	26%	0.255	42%	0.42	S	S	.	.	S	Bend	trans	-111.4	134.2	-175.1	-56.4	95.2	0	0	0	112.1	T179 F340 D343	T179-H346 VanDerWaalsContact CG2-CD2 3.43Å; T179-H346 WeakPolarHBondContact CG2-CD2 3.42Å; T179-H346 WeakPolarHBondContact CG2-NE2 3.21Å; F340-H346 HydrophobicContact CB-CB 3.95Å; D343-H346 VanDerWaalsContact CG-ND1 3.33Å; D343-H346 IonicContact OD1-CG 3.49Å; D343-H346 PolarHBondContact OD1-N 2.96Å; D343-H346 IonicContact OD1-ND1 3.04Å; D343-H346 PolarHBondContact OD1-ND1 3.41Å; D343-H346 IonicContact OD2-CE1 2.81Å; D343-H346 IonicContact OD2-CG 3.66Å; D343-H346 IonicContact OD2-ND1 2.64Å; D343-H346 PolarHBondContact OD2-ND1 3.31Å
347	E	84.8	Confident	88.9	Confident	99 Å²	99	85.8 Å²	85.8	46%	0.463	44%	0.436	S	S	.	.			trans	-75.8	144.6	173.5	-68.8	175	-156.7	0	0	111.1
348	R	91.3	Very high	89.2	Confident	125 Å²	125	85.9 Å²	85.9	47%	0.472	44%	0.436	S	S	.	.			trans	-64.2	140.5	166.8	-70.1	-178.1	177.9	-158.2	1	110.4	K176 N337 G341 E350	K176-R348 PolarHBondContact NZ-O 3.44Å; N337-R348 HydrophobicContact CB-CG 4.25Å; G341-R348 PolarHBondContact O-NE 3.45Å; G341-R348 VanDerWaalsContact O-NE 3.15Å; R348-E350 VanDerWaalsContact CD-OE2 3.31Å; R348-E350 WeakPolarHBondContact CD-OE2 3.45Å; R348-E350 IonicContact NH1-OE1 3.06Å; R348-E350 IonicContact NH1-OE2 2.91Å; R348-E350 PolarHBondContact O-N 3.27Å; R348-E350 VanDerWaalsContact O-N 3.08Å
349	L	93.2	Very high	89.6	Confident	5 Å²	5	82 Å²	82	3%	0.026	42%	0.419	C	S	.	.			trans	-87	57.6	172.9	-65	178	0	0	0	110.6	V79 K176 V178 F182 F333 Y336 N337	V79-L349 HydrophobicContact CB-CD2 4.31Å; V79-L349 HydrophobicContact CG1-CD2 4.49Å; V79-L349 HydrophobicContact CG2-CD2 4.26Å; K176-L349 HydrophobicContact CB-CD2 4.16Å; K176-L349 HydrophobicContact CD-CD2 4.23Å; V178-L349 HydrophobicContact CG1-CD1 4.35Å; V178-L349 HydrophobicContact CG1-CD2 3.87Å; F182-L349 HydrophobicContact CD2-CD1 4.45Å; F182-L349 HydrophobicContact CE1-CD1 4.09Å; F182-L349 HydrophobicContact CE2-CD1 3.46Å; F182-L349 VanDerWaalsContact CE2-CD1 3.46Å; F182-L349 HydrophobicContact CZ-CD1 3.23Å; F333-L349 HydrophobicContact CB-CB 3.96Å; F333-L349 HydrophobicContact CB-CD1 4.38Å; F333-L349 HydrophobicContact CD1-CD1 4.12Å; F333-L349 HydrophobicContact CD2-CB 3.86Å; F333-L349 HydrophobicContact CD2-CD1 4.23Å; F333-L349 HydrophobicContact CE1-CD1 4.47Å; F333-L349 HydrophobicContact CG-CB 4.04Å; F333-L349 HydrophobicContact CG-CD1 4Å; Y336-L349 HydrophobicContact CD1-CB 4.27Å; Y336-L349 HydrophobicContact CD1-CD1 3.64Å; Y336-L349 HydrophobicContact CD1-CG 3.79Å; Y336-L349 HydrophobicContact CE1-CB 4.39Å; Y336-L349 HydrophobicContact CE1-CD1 3.65Å; Y336-L349 HydrophobicContact CE1-CG 3.54Å; Y336-L349 HydrophobicContact CG-CD1 4.16Å; N337-L349 PolarHBondContact OD1-N 2.88Å
350	E	93.2	Very high	90.1	Very high	51 Å²	51	75.7 Å²	75.7	24%	0.238	41%	0.408	C	S	.	.			trans	-107.4	153.3	168.1	-77.3	148.8	-162.2	0	0	108.8	K176 N337 R348	K176-E350 WeakPolarHBondContact CE-O 3.39Å; K176-E350 PolarHBondContact NZ-O 3.26Å; N337-E350 WeakPolarHBondContact ND2-CG 3.32Å; N337-E350 PolarHBondContact ND2-OE1 2.91Å; R348-E350 VanDerWaalsContact CD-OE2 3.31Å; R348-E350 WeakPolarHBondContact CD-OE2 3.45Å; R348-E350 IonicContact NH1-OE1 3.06Å; R348-E350 IonicContact NH1-OE2 2.91Å; R348-E350 PolarHBondContact O-N 3.27Å; R348-E350 VanDerWaalsContact O-N 3.08Å
351	W	95.6	Very high	90.9	Very high	14 Å²	14	74.2 Å²	74.2	5%	0.053	40%	0.402	C	S	.	.			trans	-125.4	34	-173.3	-57.1	106.8	0	0	0	111.7	V79 L81 K176 R353 E354 E355	V79-W351 HydrophobicContact CG1-CH2 4.31Å; V79-W351 HydrophobicContact CG1-CZ2 3.91Å; L81-W351 HydrophobicContact CB-CD2 3.93Å; L81-W351 HydrophobicContact CB-CE3 3.93Å; L81-W351 HydrophobicContact CB-CH2 3.94Å; L81-W351 HydrophobicContact CB-CZ2 3.94Å; L81-W351 HydrophobicContact CB-CZ3 3.94Å; L81-W351 HydrophobicContact CD1-CD2 4.35Å; L81-W351 HydrophobicContact CD1-CG 4.25Å; L81-W351 HydrophobicContact CD2-CB 3.96Å; L81-W351 HydrophobicContact CD2-CD2 3.82Å; L81-W351 HydrophobicContact CD2-CE3 3.96Å; L81-W351 HydrophobicContact CD2-CG 3.83Å; L81-W351 HydrophobicContact CG-CD2 4.25Å; L81-W351 HydrophobicContact CG-CG 4.46Å; K176-W351 HydrophobicContact CB-CH2 4.17Å; K176-W351 HydrophobicContact CD-CE3 4.38Å; K176-W351 HydrophobicContact CD-CH2 4.02Å; K176-W351 HydrophobicContact CD-CZ3 3.89Å; K176-W351 HydrophobicContact CG-CH2 3.85Å; K176-W351 HydrophobicContact CG-CZ3 3.74Å; W351-R353 PolarHBondContact O-N 3.5Å; W351-E354 VanDerWaalsContact C-OE2 3.31Å; W351-E354 VanDerWaalsContact CA-OE2 3.26Å; W351-E354 WeakPolarHBondContact CA-OE2 3.47Å; W351-E354 HydrophobicContact CB-CB 4.35Å; W351-E354 HydrophobicContact CE3-CG 4.44Å; W351-E354 CarbonylContact O-C 3.58Å; W351-E354 WeakPolarHBondContact O-CA 3.49Å; W351-E354 PolarHBondContact O-N 3.18Å; W351-E355 PolarHBondContact O-N 3.29Å
352	D	94.7	Very high	91.8	Very high	106 Å²	106	74.8 Å²	74.8	57%	0.567	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-28	-171.8	-48.7	-45.7	0	0	0	112.1	E354	D352-E354 VanDerWaalsContact C-N 3.3Å
353	R	95.9	Very high	92.6	Very high	234 Å²	234	75 Å²	75	88%	0.883	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-26.5	175	-64.5	-178.2	-177.2	179	0.3	112.3	W351	W351-R353 PolarHBondContact O-N 3.5Å
354	E	97.6	Very high	93.4	Very high	36 Å²	36	74.7 Å²	74.7	17%	0.168	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-4	-177.5	-62.9	73.1	-156.4	0	0	112.7	L81 L173 W351 D352 E356 A357 I358	L81-E354 HydrophobicContact CD2-CB 3.82Å; L81-E354 HydrophobicContact CD2-CG 4.19Å; L173-E354 WeakPolarHBondContact O-CG 3.45Å; W351-E354 VanDerWaalsContact C-OE2 3.31Å; W351-E354 VanDerWaalsContact CA-OE2 3.26Å; W351-E354 WeakPolarHBondContact CA-OE2 3.47Å; W351-E354 HydrophobicContact CB-CB 4.35Å; W351-E354 HydrophobicContact CE3-CG 4.44Å; W351-E354 CarbonylContact O-C 3.58Å; W351-E354 WeakPolarHBondContact O-CA 3.49Å; W351-E354 PolarHBondContact O-N 3.18Å; D352-E354 VanDerWaalsContact C-N 3.3Å; E354-E356 PolarHBondContact O-N 2.93Å; E354-A357 CarbonylContact O-C 3.46Å; E354-A357 WeakPolarHBondContact O-CA 3.45Å; E354-A357 WeakPolarHBondContact O-CB 3.44Å; E354-A357 PolarHBondContact O-N 3.32Å; E354-I358 WeakPolarHBondContact O-CG1 3.39Å; E354-I358 PolarHBondContact O-N 2.7Å
355	E	96.7	Very high	94.3	Very high	85 Å²	85	73.7 Å²	73.7	40%	0.397	36%	0.361	S	S	.	.	H	α-helix	trans	-56.7	-44.2	-175	-169.9	63.9	-146.9	0	0	112.9	W351 A357 I358 K359	W351-E355 PolarHBondContact O-N 3.29Å; E355-A357 VanDerWaalsContact C-N 3.31Å; E355-A357 PolarHBondContact O-N 2.89Å; E355-I358 PolarHBondContact O-N 2.87Å; E355-K359 WeakPolarHBondContact O-CB 3.27Å; E355-K359 PolarHBondContact O-N 3.45Å
356	E	97.8	Very high	95.3	Very high	134 Å²	134	67 Å²	67	63%	0.626	33%	0.326	S	S	*	.	H	α-helix	trans	-65.1	-35.5	175.7	-70.1	-56.6	137.8	0	0	112	E354 K359 A360	E354-E356 PolarHBondContact O-N 2.93Å; E356-K359 PolarHBondContact O-N 2.91Å; E356-A360 VanDerWaalsContact O-CB 3.27Å; E356-A360 WeakPolarHBondContact O-CB 3.45Å; E356-A360 PolarHBondContact O-N 3.42Å
357	A	98.1	Very high	96.1	Very high	44 Å²	44	65.7 Å²	65.7	36%	0.364	32%	0.319	S	S	.	.	H	α-helix	trans	-69.6	-39.7	176.5	0	0	0	0	0	111.5	L173 E354 E355 A360 F361	L173-A357 HydrophobicContact CD2-CB 4.41Å; E354-A357 CarbonylContact O-C 3.46Å; E354-A357 WeakPolarHBondContact O-CA 3.45Å; E354-A357 WeakPolarHBondContact O-CB 3.44Å; E354-A357 PolarHBondContact O-N 3.32Å; E355-A357 VanDerWaalsContact C-N 3.31Å; E355-A357 PolarHBondContact O-N 2.89Å; A357-A360 PolarHBondContact O-N 2.73Å; A357-F361 WeakPolarHBondContact O-CB 3.46Å; A357-F361 PolarHBondContact O-N 2.97Å
358	I	98.4	Very high	96.6	Very high	11 Å²	11	63.6 Å²	63.6	6%	0.056	31%	0.314	C	S	.	.	H	α-helix	trans	-60	-49.1	173.3	-66	166.5	0	0	0	109.6	L81 A144 L173 E354 E355 F361 K362	L81-I358 HydrophobicContact CD2-CD1 3.9Å; L81-I358 HydrophobicContact CD2-CG1 4.15Å; A144-I358 HydrophobicContact CB-CG2 3.88Å; L173-I358 HydrophobicContact CD1-CB 4.31Å; L173-I358 HydrophobicContact CD1-CG1 3.62Å; E354-I358 WeakPolarHBondContact O-CG1 3.39Å; E354-I358 PolarHBondContact O-N 2.7Å; E355-I358 PolarHBondContact O-N 2.87Å; I358-F361 PolarHBondContact O-N 3.33Å; I358-K362 WeakPolarHBondContact O-CG 3.26Å; I358-K362 PolarHBondContact O-N 2.97Å
359	K	98.1	Very high	96.8	Very high	112 Å²	112	59.4 Å²	59.4	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-61.3	-47.7	178.5	-176.7	-178.1	175.7	-172.9	0	111.9	E355 E356 F361 K362 E363	E355-K359 WeakPolarHBondContact O-CB 3.27Å; E355-K359 PolarHBondContact O-N 3.45Å; E356-K359 PolarHBondContact O-N 2.91Å; K359-F361 VanDerWaalsContact C-N 3.3Å; K359-F361 PolarHBondContact O-N 2.99Å; K359-K362 PolarHBondContact O-N 2.92Å; K359-E363 PolarHBondContact O-N 2.78Å; K359-E363 VanDerWaalsContact O-N 3.08Å
360	A	98.3	Very high	97	Very high	59 Å²	59	59.2 Å²	59.2	49%	0.488	30%	0.302	S	S	.	.	H	α-helix	trans	-58.7	-43	176.7	0	0	0	0	0	111.5	E356 A357 E363 A364	E356-A360 VanDerWaalsContact O-CB 3.27Å; E356-A360 WeakPolarHBondContact O-CB 3.45Å; E356-A360 PolarHBondContact O-N 3.42Å; A357-A360 PolarHBondContact O-N 2.73Å; A360-E363 PolarHBondContact O-N 3.18Å; A360-A364 VanDerWaalsContact O-CB 3.24Å; A360-A364 WeakPolarHBondContact O-CB 3.23Å; A360-A364 PolarHBondContact O-N 3.13Å
361	F	98.5	Very high	97.1	Very high	10 Å²	10	57 Å²	57	4%	0.044	29%	0.292	C	S	.	.	H	α-helix	trans	-64.1	-42.2	177.1	-172.9	-86.7	0	0	0	112.4	A83 R171 A357 I358 K359 A364 H365 I366	A83-F361 HydrophobicContact CB-CB 4.47Å; A83-F361 HydrophobicContact CB-CD1 3.41Å; A83-F361 VanDerWaalsContact CB-CD1 3.41Å; A83-F361 HydrophobicContact CB-CD2 4.35Å; A83-F361 HydrophobicContact CB-CE1 3.62Å; A83-F361 HydrophobicContact CB-CG 3.81Å; A83-F361 HydrophobicContact CB-CZ 4.2Å; R171-F361 HydrophobicContact CB-CD2 4.1Å; R171-F361 HydrophobicContact CB-CE2 3.96Å; R171-F361 HydrophobicContact CG-CD2 3.84Å; R171-F361 HydrophobicContact CG-CE2 3.61Å; A357-F361 WeakPolarHBondContact O-CB 3.46Å; A357-F361 PolarHBondContact O-N 2.97Å; I358-F361 PolarHBondContact O-N 3.33Å; K359-F361 VanDerWaalsContact C-N 3.3Å; K359-F361 PolarHBondContact O-N 2.99Å; F361-A364 PolarHBondContact O-N 3.45Å; F361-H365 HydrophobicContact CD1-CB 4.44Å; F361-H365 AromaticContact CD2-CD2 3.52Å; F361-H365 HydrophobicContact CE1-CB 4.04Å; F361-H365 HydrophobicContact CE2-CB 4.17Å; F361-H365 AromaticContact CE2-CD2 3.5Å; F361-H365 VanDerWaalsContact CE2-CD2 3.5Å; F361-H365 WeakPolarHBondContact CE2-CD2 3.1Å; F361-H365 AromaticContact CE2-CG 3.99Å; F361-H365 HydrophobicContact CZ-CB 3.88Å; F361-H365 WeakPolarHBondContact O-CB 2.91Å; F361-H365 PolarHBondContact O-N 3.11Å; F361-I366 HydrophobicContact CD1-CD1 4.01Å; F361-I366 HydrophobicContact CD1-CG1 4.09Å; F361-I366 HydrophobicContact CE1-CD1 3.93Å; F361-I366 HydrophobicContact CE1-CG1 3.83Å
362	K	98.3	Very high	97.2	Very high	27 Å²	27	61.7 Å²	61.7	12%	0.117	31%	0.313	C	S	.	.	I	π-helix	trans	-58	-49.7	176.3	-76.9	-168.6	-67.9	-172.6	0	111.8	A144 E329 I358 K359 A364 I366 Y367	A144-K362 HydrophobicContact CB-CD 3.6Å; A144-K362 HydrophobicContact CB-CG 3.6Å; E329-K362 WeakPolarHBondContact OE1-CD 3.09Å; E329-K362 IonicContact OE1-NZ 2.68Å; E329-K362 IonicContact OE2-NZ 2.96Å; E329-K362 PolarHBondContact OE2-NZ 3.26Å; I358-K362 WeakPolarHBondContact O-CG 3.26Å; I358-K362 PolarHBondContact O-N 2.97Å; K359-K362 PolarHBondContact O-N 2.92Å; K362-A364 VanDerWaalsContact C-N 3.35Å; K362-I366 HydrophobicContact CG-CD1 4.22Å; K362-I366 PolarHBondContact O-N 3.21Å; K362-I366 VanDerWaalsContact O-N 3.08Å; K362-Y367 HydrophobicContact CB-CD2 4.46Å; K362-Y367 HydrophobicContact CB-CE2 4.21Å; K362-Y367 HydrophobicContact CD-CE1 4.45Å; K362-Y367 PolarHBondContact O-N 3.03Å
363	E	97.3	Very high	97.1	Very high	79 Å²	79	57 Å²	57	37%	0.369	29%	0.287	S	S	.	.	I	π-helix	trans	-70.4	-28.7	-178.9	-70	-63.5	167.1	0	0	113.2	R267 K359 A360 P368	R267-E363 IonicContact CZ-OE2 2.86Å; R267-E363 IonicContact NH1-OE2 2.6Å; R267-E363 PolarHBondContact NH1-OE2 2.82Å; R267-E363 IonicContact NH2-OE1 2.64Å; R267-E363 PolarHBondContact NH2-OE1 2.9Å; R267-E363 IonicContact NH2-OE2 3.46Å; R267-E363 PolarHBondContact NH2-OE2 2.82Å; K359-E363 PolarHBondContact O-N 2.78Å; K359-E363 VanDerWaalsContact O-N 3.08Å; A360-E363 PolarHBondContact O-N 3.18Å; E363-P368 WeakPolarHBondContact O-CD 3.21Å; E363-P368 WeakPolarHBondContact O-CG 3.25Å
364	A	97.3	Very high	97.1	Very high	61 Å²	61	46.3 Å²	46.3	50%	0.504	25%	0.248	S	C	.	.	I	π-helix	trans	-85	-35.2	179.6	0	0	0	0	0	113.7	A360 F361 K362	A360-A364 VanDerWaalsContact O-CB 3.24Å; A360-A364 WeakPolarHBondContact O-CB 3.23Å; A360-A364 PolarHBondContact O-N 3.13Å; F361-A364 PolarHBondContact O-N 3.45Å; K362-A364 VanDerWaalsContact C-N 3.35Å
365	H	97.3	Very high	96.8	Very high	59 Å²	59	46.2 Å²	46.2	27%	0.273	25%	0.25	S	S	.	.	I	π-helix	trans	-127.1	-32.5	-165.9	-62.1	-66.8	0	0	0	115.2	F361 T369	F361-H365 HydrophobicContact CD1-CB 4.44Å; F361-H365 AromaticContact CD2-CD2 3.52Å; F361-H365 HydrophobicContact CE1-CB 4.04Å; F361-H365 HydrophobicContact CE2-CB 4.17Å; F361-H365 AromaticContact CE2-CD2 3.5Å; F361-H365 VanDerWaalsContact CE2-CD2 3.5Å; F361-H365 WeakPolarHBondContact CE2-CD2 3.1Å; F361-H365 AromaticContact CE2-CG 3.99Å; F361-H365 HydrophobicContact CZ-CB 3.88Å; F361-H365 WeakPolarHBondContact O-CB 2.91Å; F361-H365 PolarHBondContact O-N 3.11Å; H365-T369 WeakPolarHBondContact O-CB 3.38Å; H365-T369 PolarHBondContact O-OG1 3.26Å
366	I	97.9	Very high	96.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-90.7	-62.7	-175.1	-59.6	-176.7	0	0	0	110.5	A143 A144 V327 F361 K362 T369 I370	A143-I366 WeakPolarHBondContact O-CD1 3.28Å; A144-I366 HydrophobicContact CB-CD1 4.31Å; V327-I366 HydrophobicContact CG1-CD1 4.15Å; V327-I366 HydrophobicContact CG1-CG2 4.25Å; V327-I366 HydrophobicContact CG2-CG2 3.68Å; F361-I366 HydrophobicContact CD1-CD1 4.01Å; F361-I366 HydrophobicContact CD1-CG1 4.09Å; F361-I366 HydrophobicContact CE1-CD1 3.93Å; F361-I366 HydrophobicContact CE1-CG1 3.83Å; K362-I366 HydrophobicContact CG-CD1 4.22Å; K362-I366 PolarHBondContact O-N 3.21Å; K362-I366 VanDerWaalsContact O-N 3.08Å; I366-T369 WeakPolarHBondContact O-CB 3.22Å; I366-T369 PolarHBondContact O-N 3.17Å; I366-T369 VanDerWaalsContact O-N 3.15Å; I366-I370 HydrophobicContact CG2-CD1 3.91Å; I366-I370 WeakPolarHBondContact O-CG1 3.48Å; I366-I370 PolarHBondContact O-N 2.99Å; I366-I370 VanDerWaalsContact O-N 3.08Å
367	Y	97.3	Very high	96.5	Very high	29 Å²	29	47.4 Å²	47.4	11%	0.114	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-42.4	-174.7	-61.5	-21	0	0	0	113.5	M196 K362 T369 I370 V371	M196-Y367 HydrophobicContact CE-CD1 3.31Å; M196-Y367 HydrophobicContact CE-CD2 3.99Å; M196-Y367 HydrophobicContact CE-CE1 3.57Å; M196-Y367 HydrophobicContact CE-CE2 4.2Å; M196-Y367 HydrophobicContact CE-CG 3.54Å; M196-Y367 HydrophobicContact SD-CD1 4.3Å; K362-Y367 HydrophobicContact CB-CD2 4.46Å; K362-Y367 HydrophobicContact CB-CE2 4.21Å; K362-Y367 HydrophobicContact CD-CE1 4.45Å; K362-Y367 PolarHBondContact O-N 3.03Å; Y367-T369 PolarHBondContact O-N 3.43Å; Y367-I370 PolarHBondContact O-N 3.03Å; Y367-V371 WeakPolarHBondContact O-CB 3.3Å; Y367-V371 WeakPolarHBondContact O-CG2 3.42Å; Y367-V371 PolarHBondContact O-N 3.32Å
368	P	96.7	Very high	96.2	Very high	55 Å²	55	46.1 Å²	46.1	36%	0.357	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-36.9	175.3	-24.6	35.2	0	0	0	112.6	E363 K372	E363-P368 WeakPolarHBondContact O-CD 3.21Å; E363-P368 WeakPolarHBondContact O-CG 3.25Å; P368-K372 WeakPolarHBondContact O-CB 3.47Å; P368-K372 PolarHBondContact O-N 3.07Å
369	T	95.4	Very high	96.1	Very high	37 Å²	37	47 Å²	47	23%	0.227	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-44.9	177.3	-59.9	0	0	0	0	111	K87 H365 I366 Y367 T373	K87-T369 HydrophobicContact CB-CG2 3.74Å; K87-T369 HydrophobicContact CD-CG2 3.56Å; K87-T369 HydrophobicContact CG-CG2 4.25Å; H365-T369 WeakPolarHBondContact O-CB 3.38Å; H365-T369 PolarHBondContact O-OG1 3.26Å; I366-T369 WeakPolarHBondContact O-CB 3.22Å; I366-T369 PolarHBondContact O-N 3.17Å; I366-T369 VanDerWaalsContact O-N 3.15Å; Y367-T369 PolarHBondContact O-N 3.43Å; T369-T373 WeakPolarHBondContact O-CB 3.04Å; T369-T373 PolarHBondContact O-N 3.17Å; T369-T373 PolarHBondContact O-OG1 3.12Å
370	I	96.3	Very high	96	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-55.3	177.7	-64.1	171.3	0	0	0	109.9	M196 L324 V327 I366 Y367 K372 T373 E374	M196-I370 HydrophobicContact CB-CD1 4.45Å; M196-I370 HydrophobicContact CB-CG2 4.29Å; M196-I370 HydrophobicContact CG-CG2 4.23Å; M196-I370 HydrophobicContact SD-CB 4.43Å; M196-I370 HydrophobicContact SD-CG2 4.07Å; L324-I370 HydrophobicContact CD1-CG1 4.49Å; L324-I370 HydrophobicContact CG-CG2 4.48Å; L324-I370 WeakPolarHBondContact O-CG1 3.48Å; V327-I370 HydrophobicContact CG2-CD1 3.95Å; I366-I370 HydrophobicContact CG2-CD1 3.91Å; I366-I370 WeakPolarHBondContact O-CG1 3.48Å; I366-I370 PolarHBondContact O-N 2.99Å; I366-I370 VanDerWaalsContact O-N 3.08Å; Y367-I370 PolarHBondContact O-N 3.03Å; I370-K372 PolarHBondContact O-N 3.24Å; I370-T373 PolarHBondContact O-N 3.28Å; I370-E374 HydrophobicContact CG2-CG 4.49Å; I370-E374 WeakPolarHBondContact O-CG 3.24Å; I370-E374 PolarHBondContact O-N 3.44Å
371	V	96.8	Very high	95.8	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.03	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-51.3	-177.8	172	0	0	0	0	110.7	M196 R267 F272 Y367 T373 E374 C375	M196-V371 HydrophobicContact SD-CG2 4.11Å; R267-V371 HydrophobicContact CB-CG1 4.17Å; R267-V371 HydrophobicContact CB-CG2 4.41Å; F272-V371 HydrophobicContact CE1-CG2 4.39Å; F272-V371 HydrophobicContact CE2-CG1 4.09Å; F272-V371 HydrophobicContact CE2-CG2 4.22Å; F272-V371 HydrophobicContact CZ-CB 4.29Å; F272-V371 HydrophobicContact CZ-CG1 4.08Å; F272-V371 HydrophobicContact CZ-CG2 4.1Å; Y367-V371 WeakPolarHBondContact O-CB 3.3Å; Y367-V371 WeakPolarHBondContact O-CG2 3.42Å; Y367-V371 PolarHBondContact O-N 3.32Å; V371-T373 VanDerWaalsContact C-N 3.33Å; V371-T373 PolarHBondContact O-N 3.48Å; V371-E374 PolarHBondContact O-N 3Å; V371-C375 WeakPolarHBondContact O-CB 3.32Å; V371-C375 PolarHBondContact O-N 2.84Å; V371-C375 PolarHBondContact O-SG 3.14Å
372	K	95.8	Very high	95.7	Very high	112 Å²	112	43.3 Å²	43.3	49%	0.487	24%	0.239	S	C	.	.	H	α-helix	trans	-58.6	-45.3	179.6	-176.2	-179.8	179.2	-177.7	0	111.8	P368 I370 C375 E376	P368-K372 WeakPolarHBondContact O-CB 3.47Å; P368-K372 PolarHBondContact O-N 3.07Å; I370-K372 PolarHBondContact O-N 3.24Å; K372-C375 PolarHBondContact O-N 3.08Å; K372-E376 WeakPolarHBondContact CE-OE1 3.27Å; K372-E376 WeakPolarHBondContact CE-OE2 3.18Å; K372-E376 VanDerWaalsContact CG-CD 3.5Å; K372-E376 HydrophobicContact CG-CG 4.26Å; K372-E376 WeakPolarHBondContact CG-OE1 3.33Å; K372-E376 IonicContact NZ-OE1 2.85Å; K372-E376 WeakPolarHBondContact O-CB 3.46Å; K372-E376 WeakPolarHBondContact O-CG 3.3Å; K372-E376 PolarHBondContact O-N 2.99Å
373	T	94.1	Very high	95.7	Very high	6 Å²	6	43.5 Å²	43.5	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-39.4	-179	-55.4	0	0	0	0	111.3	K87 L324 T369 I370 V371 E377	K87-T373 PolarHBondContact NZ-OG1 2.98Å; L324-T373 HydrophobicContact CD1-CG2 3.94Å; L324-T373 HydrophobicContact CD2-CG2 3.43Å; L324-T373 VanDerWaalsContact CD2-CG2 3.43Å; L324-T373 HydrophobicContact CG-CG2 4.34Å; T369-T373 WeakPolarHBondContact O-CB 3.04Å; T369-T373 PolarHBondContact O-N 3.17Å; T369-T373 PolarHBondContact O-OG1 3.12Å; I370-T373 PolarHBondContact O-N 3.28Å; V371-T373 VanDerWaalsContact C-N 3.33Å; V371-T373 PolarHBondContact O-N 3.48Å; T373-E377 HydrophobicContact CG2-CB 4.3Å; T373-E377 HydrophobicContact CG2-CG 4.28Å; T373-E377 WeakPolarHBondContact O-CA 3.23Å; T373-E377 VanDerWaalsContact O-CB 3.28Å; T373-E377 WeakPolarHBondContact O-CB 3.36Å; T373-E377 PolarHBondContact O-N 2.98Å
374	E	95.3	Very high	95.6	Very high	11 Å²	11	40 Å²	40	5%	0.051	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-41.3	174	-70.9	-65.7	174.1	0	0	112.2	P198 F272 L324 I370 V371 G378 S379 M380	P198-E374 HydrophobicContact CG-CB 3.95Å; P198-E374 HydrophobicContact CG-CG 3.89Å; F272-E374 HydrophobicContact CE1-CB 4.11Å; F272-E374 HydrophobicContact CE1-CG 4.27Å; F272-E374 HydrophobicContact CZ-CB 4.26Å; L324-E374 HydrophobicContact CD2-CG 3.96Å; I370-E374 HydrophobicContact CG2-CG 4.49Å; I370-E374 WeakPolarHBondContact O-CG 3.24Å; I370-E374 PolarHBondContact O-N 3.44Å; V371-E374 PolarHBondContact O-N 3Å; E374-G378 WeakPolarHBondContact O-CA 3.3Å; E374-G378 PolarHBondContact O-N 3.1Å; E374-G378 VanDerWaalsContact O-N 3.16Å; E374-S379 PolarHBondContact OE1-OG 2.84Å; E374-S379 PolarHBondContact OE2-N 3.2Å; E374-M380 PolarHBondContact OE1-N 2.89Å; E374-M380 VanDerWaalsContact OE2-CB 3.3Å; E374-M380 WeakPolarHBondContact OE2-CB 3.2Å; E374-M380 PolarHBondContact OE2-N 2.97Å
375	C	92.1	Very high	95.5	Very high	33 Å²	33	40.9 Å²	40.9	22%	0.223	23%	0.23	C	C	.	.	H	α-helix	trans	-69.7	-36.3	179.5	-62.7	0	0	0	0	113.8	Y270 V371 K372	Y270-C375 HydrophobicContact CD2-CB 4.26Å; Y270-C375 WeakPolarHBondContact CD2-SG 3.37Å; Y270-C375 HydrophobicContact CE2-CB 3.9Å; Y270-C375 VanDerWaalsContact CE2-SG 3.51Å; V371-C375 WeakPolarHBondContact O-CB 3.32Å; V371-C375 PolarHBondContact O-N 2.84Å; V371-C375 PolarHBondContact O-SG 3.14Å; K372-C375 PolarHBondContact O-N 3.08Å
376	E	93.5	Very high	95.5	Very high	131 Å²	131	40.9 Å²	40.9	61%	0.612	23%	0.234	S	C	*	.	H	α-helix	trans	-95.6	-37.7	-173.9	-67.7	177.3	177.9	0	0	113.1	K372	K372-E376 WeakPolarHBondContact CE-OE1 3.27Å; K372-E376 WeakPolarHBondContact CE-OE2 3.18Å; K372-E376 VanDerWaalsContact CG-CD 3.5Å; K372-E376 HydrophobicContact CG-CG 4.26Å; K372-E376 WeakPolarHBondContact CG-OE1 3.33Å; K372-E376 IonicContact NZ-OE1 2.85Å; K372-E376 WeakPolarHBondContact O-CB 3.46Å; K372-E376 WeakPolarHBondContact O-CG 3.3Å; K372-E376 PolarHBondContact O-N 2.99Å
377	E	93.3	Very high	95.3	Very high	113 Å²	113	40.9 Å²	40.9	53%	0.528	23%	0.234	S	C	.	.	H	α-helix	trans	-106	-10.8	-173.1	-54.3	174.5	-149.6	0	0	112.3	K87 T373 S379	K87-E377 IonicContact NZ-OE1 2.7Å; K87-E377 PolarHBondContact NZ-OE1 2.99Å; T373-E377 HydrophobicContact CG2-CB 4.3Å; T373-E377 HydrophobicContact CG2-CG 4.28Å; T373-E377 WeakPolarHBondContact O-CA 3.23Å; T373-E377 VanDerWaalsContact O-CB 3.28Å; T373-E377 WeakPolarHBondContact O-CB 3.36Å; T373-E377 PolarHBondContact O-N 2.98Å; E377-S379 VanDerWaalsContact C-N 3.29Å; E377-S379 PolarHBondContact O-N 3.11Å
378	G	93.3	Very high	95.2	Very high	18 Å²	18	43.8 Å²	43.8	19%	0.186	26%	0.257	C	S	.	.			trans	58.7	37.4	177.1	0	0	0	0	0	113.7	E374 M380 V381 S382	E374-G378 WeakPolarHBondContact O-CA 3.3Å; E374-G378 PolarHBondContact O-N 3.1Å; E374-G378 VanDerWaalsContact O-N 3.16Å; G378-M380 PolarHBondContact O-N 2.91Å; G378-V381 PolarHBondContact O-N 2.85Å; G378-S382 WeakPolarHBondContact O-CB 3.49Å; G378-S382 PolarHBondContact O-N 3.01Å; G378-S382 PolarHBondContact O-OG 3.39Å
379	S	94.8	Very high	95.1	Very high	29 Å²	29	45.7 Å²	45.7	20%	0.203	27%	0.271	C	S	.	.	H	α-helix	trans	-53.6	-50.2	-173.1	152.6	0	0	0	0	113.1	E374 E377 W383	E374-S379 PolarHBondContact OE1-OG 2.84Å; E374-S379 PolarHBondContact OE2-N 3.2Å; E377-S379 VanDerWaalsContact C-N 3.29Å; E377-S379 PolarHBondContact O-N 3.11Å; S379-W383 PolarHBondContact O-N 2.9Å; S379-W383 VanDerWaalsContact O-N 3.15Å
380	M	96.6	Very high	95	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.5	-44.6	179	180	55.4	70.5	0	0	111.6	Y195 L197 P198 A201 P322 E374 G378 W383 M384	Y195-M380 HydrophobicContact CE1-CE 3.96Å; L197-M380 HydrophobicContact CB-CE 3.91Å; L197-M380 HydrophobicContact CD1-CE 4.22Å; P198-M380 HydrophobicContact CG-CB 4.18Å; A201-M380 HydrophobicContact CB-CG 4.11Å; A201-M380 HydrophobicContact CB-SD 4.14Å; P322-M380 HydrophobicContact CG-CE 4.47Å; E374-M380 PolarHBondContact OE1-N 2.89Å; E374-M380 VanDerWaalsContact OE2-CB 3.3Å; E374-M380 WeakPolarHBondContact OE2-CB 3.2Å; E374-M380 PolarHBondContact OE2-N 2.97Å; G378-M380 PolarHBondContact O-N 2.91Å; M380-W383 PolarHBondContact O-N 3.02Å; M380-W383 HydrophobicContact SD-CE3 3.44Å; M380-W383 HydrophobicContact SD-CZ3 3.71Å; M380-M384 HydrophobicContact CG-CG 4.46Å; M380-M384 WeakPolarHBondContact O-CG 3.5Å; M380-M384 PolarHBondContact O-N 3.06Å; M380-M384 HydrophobicContact SD-CG 4.31Å
381	V	95	Very high	94.7	Very high	27 Å²	27	50 Å²	50	16%	0.164	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-43.4	-178.3	177.1	0	0	0	0	111.6	V200 I212 G378 W383 M384 A385	V200-V381 HydrophobicContact CG1-CG2 4.22Å; I212-V381 HydrophobicContact CD1-CB 4.23Å; I212-V381 HydrophobicContact CD1-CG1 4.25Å; I212-V381 HydrophobicContact CD1-CG2 3.36Å; I212-V381 HydrophobicContact CG1-CG2 3.95Å; G378-V381 PolarHBondContact O-N 2.85Å; V381-W383 VanDerWaalsContact C-N 3.26Å; V381-W383 PolarHBondContact O-N 3.4Å; V381-M384 HydrophobicContact CB-CE 4.18Å; V381-M384 HydrophobicContact CG1-CE 4.45Å; V381-M384 HydrophobicContact CG2-CE 3.78Å; V381-M384 WeakPolarHBondContact O-CB 3.27Å; V381-M384 PolarHBondContact O-N 3.36Å; V381-M384 VanDerWaalsContact O-N 3.12Å; V381-A385 PolarHBondContact O-N 3.24Å; V381-A385 VanDerWaalsContact O-N 3.11Å
382	S	95.8	Very high	94.3	Very high	77 Å²	77	50.3 Å²	50.3	54%	0.538	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-40	174.5	-60.4	0	0	0	0	111.8	G378	G378-S382 WeakPolarHBondContact O-CB 3.49Å; G378-S382 PolarHBondContact O-N 3.01Å; G378-S382 PolarHBondContact O-OG 3.39Å
383	W	96.9	Very high	93.5	Very high	30 Å²	30	48.4 Å²	48.4	11%	0.114	29%	0.286	C	S	.	.	H	α-helix	trans	-69.7	-40.8	174.2	170.1	77.5	0	0	0	112.5	I295 P319 K320 A321 P322 S379 M380 V381 A385 T386 L387	I295-W383 HydrophobicContact CB-CH2 4.2Å; I295-W383 HydrophobicContact CB-CZ3 4.45Å; I295-W383 HydrophobicContact CD1-CH2 4.02Å; I295-W383 HydrophobicContact CD1-CZ3 3.88Å; I295-W383 HydrophobicContact CG2-CH2 3.95Å; I295-W383 HydrophobicContact CG2-CZ3 3.87Å; P319-W383 HydrophobicContact CB-CZ2 3.88Å; K320-W383 PolarHBondContact O-NE1 3.08Å; A321-W383 HydrophobicContact CB-CH2 4.36Å; A321-W383 HydrophobicContact CB-CZ2 4.26Å; P322-W383 HydrophobicContact CG-CB 3.66Å; P322-W383 HydrophobicContact CG-CD2 4.3Å; P322-W383 HydrophobicContact CG-CG 3.84Å; S379-W383 PolarHBondContact O-N 2.9Å; S379-W383 VanDerWaalsContact O-N 3.15Å; M380-W383 PolarHBondContact O-N 3.02Å; M380-W383 HydrophobicContact SD-CE3 3.44Å; M380-W383 HydrophobicContact SD-CZ3 3.71Å; V381-W383 VanDerWaalsContact C-N 3.26Å; V381-W383 PolarHBondContact O-N 3.4Å; W383-A385 PolarHBondContact O-N 3.38Å; W383-T386 WeakPolarHBondContact O-CB 3.5Å; W383-T386 PolarHBondContact O-N 3.43Å; W383-T386 PolarHBondContact O-OG1 2.92Å; W383-L387 HydrophobicContact CH2-CD1 4.48Å; W383-L387 HydrophobicContact CH2-CD2 3.87Å; W383-L387 HydrophobicContact CZ2-CD2 3.84Å; W383-L387 HydrophobicContact CZ3-CD1 4.44Å; W383-L387 HydrophobicContact CZ3-CD2 4.5Å
384	M	95.9	Very high	92.4	Very high	7 Å²	7	50.3 Å²	50.3	3%	0.034	30%	0.302	C	S	.	.	H	α-helix	trans	-58.4	-34	177.8	-74.4	-165.8	-66.1	0	0	112.7	V200 A201 T209 R299 M380 V381 T386 L387	V200-M384 HydrophobicContact CG1-CE 3.86Å; V200-M384 HydrophobicContact CG2-CE 4.43Å; A201-M384 VanDerWaalsContact CA-SD 3.55Å; A201-M384 HydrophobicContact CB-SD 4.46Å; T209-M384 HydrophobicContact CG2-CE 4.45Å; R299-M384 VanDerWaalsContact CZ-SD 3.59Å; R299-M384 PolarHBondContact NH1-SD 3.34Å; R299-M384 VanDerWaalsContact NH1-SD 3.35Å; M380-M384 HydrophobicContact CG-CG 4.46Å; M380-M384 WeakPolarHBondContact O-CG 3.5Å; M380-M384 PolarHBondContact O-N 3.06Å; M380-M384 HydrophobicContact SD-CG 4.31Å; V381-M384 HydrophobicContact CB-CE 4.18Å; V381-M384 HydrophobicContact CG1-CE 4.45Å; V381-M384 HydrophobicContact CG2-CE 3.78Å; V381-M384 WeakPolarHBondContact O-CB 3.27Å; V381-M384 PolarHBondContact O-N 3.36Å; V381-M384 VanDerWaalsContact O-N 3.12Å; M384-T386 PolarHBondContact O-N 2.98Å; M384-T386 VanDerWaalsContact O-N 3.09Å; M384-L387 HydrophobicContact CB-CD1 4.37Å; M384-L387 HydrophobicContact CG-CD1 4.41Å; M384-L387 VanDerWaalsContact O-CB 3.32Å; M384-L387 WeakPolarHBondContact O-CB 3.5Å; M384-L387 WeakPolarHBondContact O-CG 3.4Å; M384-L387 PolarHBondContact O-N 2.96Å
385	A	95.2	Very high	90.9	Very high	78 Å²	78	51.7 Å²	51.7	65%	0.645	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.7	175.5	0	0	0	0	0	113.5	V381 W383 P388	V381-A385 PolarHBondContact O-N 3.24Å; V381-A385 VanDerWaalsContact O-N 3.11Å; W383-A385 PolarHBondContact O-N 3.38Å; A385-P388 WeakPolarHBondContact O-CD 2.86Å
386	T	96.6	Very high	89.3	Confident	60 Å²	60	52 Å²	52	37%	0.368	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-11	175.4	73	0	0	0	0	113.5	W383 M384 P388 S389	W383-T386 WeakPolarHBondContact O-CB 3.5Å; W383-T386 PolarHBondContact O-N 3.43Å; W383-T386 PolarHBondContact O-OG1 2.92Å; M384-T386 PolarHBondContact O-N 2.98Å; M384-T386 VanDerWaalsContact O-N 3.09Å; T386-P388 VanDerWaalsContact C-N 3.34Å; T386-S389 PolarHBondContact O-N 3.21Å; T386-S389 VanDerWaalsContact O-N 3.08Å; T386-S389 PolarHBondContact O-OG 3.32Å
387	L	95.7	Very high	87.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-56.9	-37	-180	-67.8	174.5	0	0	0	114.7	I295 A296 F301 P319 W383 M384 S389 H390	I295-L387 HydrophobicContact CG2-CD1 4.1Å; A296-L387 HydrophobicContact CB-CD2 4.48Å; F301-L387 HydrophobicContact CD2-CB 3.92Å; F301-L387 HydrophobicContact CD2-CD1 4.13Å; F301-L387 HydrophobicContact CE2-CB 3.98Å; F301-L387 HydrophobicContact CE2-CD1 4.22Å; F301-L387 HydrophobicContact CG-CB 4.24Å; F301-L387 HydrophobicContact CZ-CB 4.34Å; P319-L387 HydrophobicContact CB-CD2 3.81Å; P319-L387 HydrophobicContact CG-CD2 3.93Å; W383-L387 HydrophobicContact CH2-CD1 4.48Å; W383-L387 HydrophobicContact CH2-CD2 3.87Å; W383-L387 HydrophobicContact CZ2-CD2 3.84Å; W383-L387 HydrophobicContact CZ3-CD1 4.44Å; W383-L387 HydrophobicContact CZ3-CD2 4.5Å; M384-L387 HydrophobicContact CB-CD1 4.37Å; M384-L387 HydrophobicContact CG-CD1 4.41Å; M384-L387 VanDerWaalsContact O-CB 3.32Å; M384-L387 WeakPolarHBondContact O-CB 3.5Å; M384-L387 WeakPolarHBondContact O-CG 3.4Å; M384-L387 PolarHBondContact O-N 2.96Å; L387-S389 PolarHBondContact O-N 2.74Å; L387-H390 PolarHBondContact O-N 3.27Å
388	P	94.6	Very high	85.8	Confident	89 Å²	89	45.5 Å²	45.5	58%	0.578	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-62.7	-19.4	176.6	-21.6	31.9	0	0	0	114.9	F301 A385 T386 H390	F301-P388 HydrophobicContact CE1-CB 4.17Å; F301-P388 HydrophobicContact CE1-CG 3.7Å; F301-P388 HydrophobicContact CZ-CG 3.99Å; A385-P388 WeakPolarHBondContact O-CD 2.86Å; T386-P388 VanDerWaalsContact C-N 3.34Å; P388-H390 VanDerWaalsContact C-N 3.29Å
389	S	93.5	Very high	83.9	Confident	96 Å²	96	47.5 Å²	47.5	67%	0.671	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-82	-7.1	179.8	65.2	0	0	0	0	114.1	T386 L387	T386-S389 PolarHBondContact O-N 3.21Å; T386-S389 VanDerWaalsContact O-N 3.08Å; T386-S389 PolarHBondContact O-OG 3.32Å; L387-S389 PolarHBondContact O-N 2.74Å
390	H	94.1	Very high	82	Confident	37 Å²	37	51.2 Å²	51.2	17%	0.171	32%	0.318	C	S	.	.			trans	-84.6	128.2	178	-73.6	-77.8	0	0	0	110.6	D317 P319 L387 P388 F392	D317-H390 VanDerWaalsContact CG-ND1 3.3Å; D317-H390 PolarHBondContact O-ND1 2.89Å; D317-H390 IonicContact OD1-CE1 3.92Å; D317-H390 IonicContact OD1-ND1 2.92Å; D317-H390 IonicContact OD2-CE1 3.96Å; D317-H390 IonicContact OD2-CG 3.29Å; D317-H390 IonicContact OD2-ND1 3.87Å; D317-H390 PolarHBondContact OD2-ND1 2.89Å; P319-H390 HydrophobicContact CG-CB 4.4Å; L387-H390 PolarHBondContact O-N 3.27Å; P388-H390 VanDerWaalsContact C-N 3.29Å; H390-F392 HydrophobicContact CB-CD2 4.35Å; H390-F392 HydrophobicContact CB-CE1 4.39Å; H390-F392 HydrophobicContact CB-CE2 3.65Å; H390-F392 HydrophobicContact CB-CZ 3.67Å
391	D	90.6	Very high	79.8	Confident	90 Å²	90	55.6 Å²	55.6	48%	0.481	34%	0.341	S	S	.	.			trans	-96.5	104.2	173.9	-171.7	-9.8	0	0	0	110.2	E393 A394	D391-E393 VanDerWaalsContact C-N 3.33Å; D391-E393 PolarHBondContact OD1-N 3.35Å; D391-A394 HydrophobicContact CB-CB 4.08Å; D391-A394 VanDerWaalsContact CG-CB 3.4Å; D391-A394 PolarHBondContact OD1-N 3.16Å; D391-A394 WeakPolarHBondContact OD2-CA 3.39Å; D391-A394 WeakPolarHBondContact OD2-CB 3.46Å
392	F	87.4	Confident	77.7	Confident	12 Å²	12	59.2 Å²	59.2	5%	0.053	36%	0.359	C	S	.	.	S	Bend	trans	-84.5	-6.9	179.8	-61.5	-79.7	0	0	0	113.5	L293 A296 F301 A302 V306 R309 P319 H390	L293-F392 HydrophobicContact CD1-CD1 4.47Å; L293-F392 HydrophobicContact CD1-CE1 4.11Å; A296-F392 HydrophobicContact CB-CE1 4.07Å; A296-F392 HydrophobicContact CB-CE2 4.34Å; A296-F392 HydrophobicContact CB-CZ 3.57Å; F301-F392 HydrophobicContact CB-CE2 4.06Å; F301-F392 WeakPolarHBondContact O-CD2 3.34Å; A302-F392 HydrophobicContact CB-CB 4.18Å; A302-F392 HydrophobicContact CB-CD1 3.76Å; A302-F392 HydrophobicContact CB-CD2 3.93Å; A302-F392 HydrophobicContact CB-CE1 4.05Å; A302-F392 HydrophobicContact CB-CE2 4.25Å; A302-F392 HydrophobicContact CB-CG 3.68Å; A302-F392 HydrophobicContact CB-CZ 4.3Å; V306-F392 HydrophobicContact CG2-CD1 4.33Å; R309-F392 PolarHBondContact NH2-O 3.45Å; P319-F392 HydrophobicContact CG-CE1 3.86Å; P319-F392 HydrophobicContact CG-CZ 3.58Å; H390-F392 HydrophobicContact CB-CD2 4.35Å; H390-F392 HydrophobicContact CB-CE1 4.39Å; H390-F392 HydrophobicContact CB-CE2 3.65Å; H390-F392 HydrophobicContact CB-CZ 3.67Å
393	E	79.8	Confident	75.6	Confident	73 Å²	73	61.7 Å²	61.7	34%	0.341	36%	0.361	S	S	.	.	S	Bend	trans	-119.7	-9.1	-174.3	-59.5	-61.8	169.1	0	0	113.8	R309 D391 T395 V396 T397	R309-E393 IonicContact NH2-OE2 3.37Å; R309-E393 PolarHBondContact NH2-OE2 3.24Å; D391-E393 VanDerWaalsContact C-N 3.33Å; D391-E393 PolarHBondContact OD1-N 3.35Å; E393-T395 PolarHBondContact O-N 3.12Å; E393-V396 WeakPolarHBondContact O-CA 3.46Å; E393-V396 WeakPolarHBondContact O-CB 3.29Å; E393-V396 PolarHBondContact O-N 3.14Å; E393-V396 VanDerWaalsContact OE2-CG2 3.25Å; E393-V396 WeakPolarHBondContact OE2-CG2 3.18Å; E393-T397 PolarHBondContact O-N 3.31Å
394	A	69.6	Low	73.5	Confident	45 Å²	45	63.9 Å²	63.9	37%	0.372	37%	0.374	S	S	.	.	H	α-helix	trans	-46.4	-38.1	-176.5	0	0	0	0	0	115	D391 T397 G398	D391-A394 HydrophobicContact CB-CB 4.08Å; D391-A394 VanDerWaalsContact CG-CB 3.4Å; D391-A394 PolarHBondContact OD1-N 3.16Å; D391-A394 WeakPolarHBondContact OD2-CA 3.39Å; D391-A394 WeakPolarHBondContact OD2-CB 3.46Å; A394-T397 PolarHBondContact O-OG1 2.89Å; A394-T397 VanDerWaalsContact O-OG1 3.11Å; A394-G398 PolarHBondContact O-N 3.18Å
395	T	63.8	Low	71.4	Confident	40 Å²	40	68.6 Å²	68.6	25%	0.245	40%	0.397	C	S	.	.	H	α-helix	trans	-83.6	-17.7	-178.5	28.4	0	0	0	0	113.5	K315 E393 T399	K315-T395 HydrophobicContact CB-CG2 4.19Å; K315-T395 WeakPolarHBondContact O-CB 3.43Å; K315-T395 WeakPolarHBondContact O-CG2 3.34Å; K315-T395 PolarHBondContact O-OG1 3.07Å; E393-T395 PolarHBondContact O-N 3.12Å; T395-T399 WeakPolarHBondContact O-CB 3.46Å; T395-T399 PolarHBondContact O-N 3.48Å; T395-T399 PolarHBondContact O-OG1 3.21Å
396	V	59.2	Low	69.3	Low	40 Å²	40	72.9 Å²	72.9	24%	0.242	40%	0.4	C	S	.	.	H	α-helix	trans	-76.1	-50.8	176	-167.6	0	0	0	0	109.9	R309 E393 G398 T399 Q400	R309-V396 VanDerWaalsContact CZ-CG2 3.42Å; E393-V396 WeakPolarHBondContact O-CA 3.46Å; E393-V396 WeakPolarHBondContact O-CB 3.29Å; E393-V396 PolarHBondContact O-N 3.14Å; E393-V396 VanDerWaalsContact OE2-CG2 3.25Å; E393-V396 WeakPolarHBondContact OE2-CG2 3.18Å; V396-G398 PolarHBondContact O-N 3.08Å; V396-T399 PolarHBondContact O-N 3.29Å; V396-T399 VanDerWaalsContact O-N 3.12Å; V396-Q400 WeakPolarHBondContact O-CB 3.43Å; V396-Q400 PolarHBondContact O-N 3.14Å
397	T	56.6	Low	67.1	Low	78 Å²	78	76.5 Å²	76.5	48%	0.479	41%	0.413	S	S	.	.	H	α-helix	trans	-59.4	-47.7	179.3	49.2	0	0	0	0	110.6	E393 A394 T399 Q400 D401	E393-T397 PolarHBondContact O-N 3.31Å; A394-T397 PolarHBondContact O-OG1 2.89Å; A394-T397 VanDerWaalsContact O-OG1 3.11Å; T397-T399 VanDerWaalsContact C-N 3.28Å; T397-T399 PolarHBondContact O-N 3.04Å; T397-Q400 PolarHBondContact O-N 2.61Å; T397-D401 WeakPolarHBondContact O-CB 3.33Å; T397-D401 PolarHBondContact O-N 3.35Å
398	G	56	Low	64.9	Low	30 Å²	30	83 Å²	83	31%	0.309	44%	0.443	S	S	.	.	H	α-helix	trans	-66.5	-21.8	176.6	0	0	0	0	0	115.5	A394 V396 N402	A394-G398 PolarHBondContact O-N 3.18Å; V396-G398 PolarHBondContact O-N 3.08Å; G398-N402 WeakPolarHBondContact O-CB 3.23Å; G398-N402 PolarHBondContact O-N 2.72Å; G398-N402 PolarHBondContact O-ND2 2.68Å
399	T	54.9	Low	62.8	Low	59 Å²	59	84.2 Å²	84.2	36%	0.362	45%	0.445	S	S	.	.	H	α-helix	trans	-86.8	-33.9	174.9	-55.6	0	0	0	0	111.5	T395 V396 T397 K403	T395-T399 WeakPolarHBondContact O-CB 3.46Å; T395-T399 PolarHBondContact O-N 3.48Å; T395-T399 PolarHBondContact O-OG1 3.21Å; V396-T399 PolarHBondContact O-N 3.29Å; V396-T399 VanDerWaalsContact O-N 3.12Å; T397-T399 VanDerWaalsContact C-N 3.28Å; T397-T399 PolarHBondContact O-N 3.04Å; T399-K403 WeakPolarHBondContact O-CB 3.21Å; T399-K403 WeakPolarHBondContact O-CG 3.48Å; T399-K403 PolarHBondContact O-N 2.87Å; T399-K403 VanDerWaalsContact O-N 3.1Å
400	Q	53.4	Low	60.8	Low	107 Å²	107	82.9 Å²	82.9	50%	0.5	44%	0.44	S	S	.	.	H	α-helix	trans	-67.1	-50.5	174	-154.3	90.8	-0.6	0	0	110	V396 T397 N402 K403 D404	V396-Q400 WeakPolarHBondContact O-CB 3.43Å; V396-Q400 PolarHBondContact O-N 3.14Å; T397-Q400 PolarHBondContact O-N 2.61Å; Q400-N402 VanDerWaalsContact C-N 3.28Å; Q400-N402 PolarHBondContact O-N 2.83Å; Q400-K403 CarbonylContact O-C 3.58Å; Q400-K403 WeakPolarHBondContact O-CA 3.47Å; Q400-K403 WeakPolarHBondContact O-CB 3.49Å; Q400-K403 PolarHBondContact O-N 3.36Å; Q400-D404 PolarHBondContact O-N 3.46Å
401	D	51.5	Low	58.7	Low	93 Å²	93	87.7 Å²	87.7	50%	0.497	47%	0.467	S	S	.	.	H	α-helix	trans	-58.4	-38.9	177.6	-66.1	-21	0	0	0	111.9	T397 Q405	T397-D401 WeakPolarHBondContact O-CB 3.33Å; T397-D401 PolarHBondContact O-N 3.35Å; D401-Q405 VanDerWaalsContact O-CB 3.28Å; D401-Q405 WeakPolarHBondContact O-CB 3.42Å; D401-Q405 WeakPolarHBondContact O-CG 3.41Å; D401-Q405 PolarHBondContact O-N 2.8Å
402	N	51.5	Low	56.8	Low	102 Å²	102	91.2 Å²	91.2	55%	0.545	48%	0.481	S	S	.	.	H	α-helix	trans	-71.2	-28.8	175.4	-90.9	-51.3	0	0	0	113.6	G398 Q400 K406	G398-N402 WeakPolarHBondContact O-CB 3.23Å; G398-N402 PolarHBondContact O-N 2.72Å; G398-N402 PolarHBondContact O-ND2 2.68Å; Q400-N402 VanDerWaalsContact C-N 3.28Å; Q400-N402 PolarHBondContact O-N 2.83Å; N402-K406 WeakPolarHBondContact O-CB 3.36Å; N402-K406 WeakPolarHBondContact O-CG 3.41Å; N402-K406 PolarHBondContact O-N 3.31Å
403	K	51.7	Low	54.9	Low	130 Å²	130	93.7 Å²	93.7	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-77	-43.9	174.8	-82.7	-179.4	178.3	178.1	0	110.6	T399 Q400 K406 Q407	T399-K403 WeakPolarHBondContact O-CB 3.21Å; T399-K403 WeakPolarHBondContact O-CG 3.48Å; T399-K403 PolarHBondContact O-N 2.87Å; T399-K403 VanDerWaalsContact O-N 3.1Å; Q400-K403 CarbonylContact O-C 3.58Å; Q400-K403 WeakPolarHBondContact O-CA 3.47Å; Q400-K403 WeakPolarHBondContact O-CB 3.49Å; Q400-K403 PolarHBondContact O-N 3.36Å; K403-K406 WeakPolarHBondContact O-CB 3.49Å; K403-K406 PolarHBondContact O-N 3.27Å; K403-K406 VanDerWaalsContact O-N 3.13Å; K403-Q407 WeakPolarHBondContact O-CB 3.36Å; K403-Q407 PolarHBondContact O-N 3.23Å
404	D	52.6	Low	53.3	Low	75 Å²	75	97.6 Å²	97.6	40%	0.401	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-43	178.2	-64.6	-23.1	0	0	0	110.3	Q400 K406 Q407 E408	Q400-D404 PolarHBondContact O-N 3.46Å; D404-K406 VanDerWaalsContact C-N 3.34Å; D404-K406 PolarHBondContact O-N 3.05Å; D404-Q407 PolarHBondContact O-N 2.97Å; D404-Q407 VanDerWaalsContact O-N 3.09Å; D404-E408 PolarHBondContact O-N 3.46Å
405	Q	50.3	Low	52.3	Low	107 Å²	107	98.8 Å²	98.8	50%	0.5	55%	0.55	S	S	.	.	H	α-helix	trans	-62.7	-35.4	171.3	-76.1	176.6	12.1	0	0	113.4	D401 Q407 N409	D401-Q405 VanDerWaalsContact O-CB 3.28Å; D401-Q405 WeakPolarHBondContact O-CB 3.42Å; D401-Q405 WeakPolarHBondContact O-CG 3.41Å; D401-Q405 PolarHBondContact O-N 2.8Å; Q405-Q407 VanDerWaalsContact C-N 3.29Å; Q405-N409 WeakPolarHBondContact O-CB 3.06Å; Q405-N409 VanDerWaalsContact O-CG 3.3Å; Q405-N409 PolarHBondContact O-N 3.34Å; Q405-N409 VanDerWaalsContact O-N 3.11Å; Q405-N409 PolarHBondContact O-ND2 2.75Å
406	K	51.7	Low	51.4	Low	167 Å²	167	102.2 Å²	102.2	73%	0.726	58%	0.575	S	S	*	*	H	α-helix	trans	-71	-27.5	174.6	-92.1	-176.9	174.3	-179.4	0	112.8	N402 K403 D404 A410	N402-K406 WeakPolarHBondContact O-CB 3.36Å; N402-K406 WeakPolarHBondContact O-CG 3.41Å; N402-K406 PolarHBondContact O-N 3.31Å; K403-K406 WeakPolarHBondContact O-CB 3.49Å; K403-K406 PolarHBondContact O-N 3.27Å; K403-K406 VanDerWaalsContact O-N 3.13Å; D404-K406 VanDerWaalsContact C-N 3.34Å; D404-K406 PolarHBondContact O-N 3.05Å; K406-A410 WeakPolarHBondContact O-CB 3.34Å; K406-A410 PolarHBondContact O-N 3.42Å
407	Q	50.7	Low	50.4	Low	137 Å²	137	112.1 Å²	112.1	64%	0.64	63%	0.627	S	S	*	*	H	α-helix	trans	-83.3	-38	-178.9	-151.8	151.3	-5.5	0	0	110.8	K403 D404 Q405 A410 D411	K403-Q407 WeakPolarHBondContact O-CB 3.36Å; K403-Q407 PolarHBondContact O-N 3.23Å; D404-Q407 PolarHBondContact O-N 2.97Å; D404-Q407 VanDerWaalsContact O-N 3.09Å; Q405-Q407 VanDerWaalsContact C-N 3.29Å; Q407-A410 PolarHBondContact O-N 3.5Å; Q407-D411 PolarHBondContact O-N 3.13Å; Q407-D411 VanDerWaalsContact O-N 3.16Å
408	E	49.7	Very low	50.1	Low	135 Å²	135	113.9 Å²	113.9	63%	0.631	63%	0.634	S	S	*	*	H	α-helix	trans	-62.8	-44.2	169.2	-75.2	-179.6	161	0	0	112.2	D404 A410 D411 E412	D404-E408 PolarHBondContact O-N 3.46Å; E408-A410 PolarHBondContact O-N 3.43Å; E408-D411 PolarHBondContact O-N 3.03Å; E408-D411 VanDerWaalsContact O-N 3.15Å; E408-E412 PolarHBondContact O-N 3.31Å; E408-E412 VanDerWaalsContact O-N 3.09Å
409	N	50.7	Low	49.8	Very low	116 Å²	116	118.3 Å²	118.3	62%	0.62	65%	0.651	S	S	*	*	H	α-helix	trans	-66.2	-19.5	175.6	-77.1	-53.7	0	0	0	113.7	Q405	Q405-N409 WeakPolarHBondContact O-CB 3.06Å; Q405-N409 VanDerWaalsContact O-CG 3.3Å; Q405-N409 PolarHBondContact O-N 3.34Å; Q405-N409 VanDerWaalsContact O-N 3.11Å; Q405-N409 PolarHBondContact O-ND2 2.75Å
410	A	51.9	Low	49.5	Very low	67 Å²	67	121.6 Å²	121.6	55%	0.554	67%	0.667	S	S	*	*	H	α-helix	trans	-85.3	-27.7	175	0	0	0	0	0	112.3	K406 Q407 E408	K406-A410 WeakPolarHBondContact O-CB 3.34Å; K406-A410 PolarHBondContact O-N 3.42Å; Q407-A410 PolarHBondContact O-N 3.5Å; E408-A410 PolarHBondContact O-N 3.43Å
411	D	49.9	Very low	49.3	Very low	139 Å²	139	122.4 Å²	122.4	74%	0.743	68%	0.677	S	S	*	*	H	α-helix	trans	-83	-28.7	177.9	-115.9	-0.2	0	0	0	112.6	Q407 E408 G413	Q407-D411 PolarHBondContact O-N 3.13Å; Q407-D411 VanDerWaalsContact O-N 3.16Å; E408-D411 PolarHBondContact O-N 3.03Å; E408-D411 VanDerWaalsContact O-N 3.15Å; D411-G413 VanDerWaalsContact C-N 3.27Å; D411-G413 PolarHBondContact O-N 3.39Å
412	E	50.3	Low	49.1	Very low	164 Å²	164	124.3 Å²	124.3	77%	0.766	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-74.2	-15.7	172.6	-71.8	-167.7	163.4	0	0	113.6	E408 N414	E408-E412 PolarHBondContact O-N 3.31Å; E408-E412 VanDerWaalsContact O-N 3.09Å; E412-N414 PolarHBondContact O-N 2.9Å
413	G	45.9	Very low	49	Very low	64 Å²	64	125.7 Å²	125.7	66%	0.66	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-83.9	-1	-177.2	0	0	0	0	0	115.9	D411	D411-G413 VanDerWaalsContact C-N 3.27Å; D411-G413 PolarHBondContact O-N 3.39Å
414	N	48.2	Very low	48.8	Very low	154 Å²	154	125.4 Å²	125.4	82%	0.824	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-117.3	18.4	-172	-117.6	6.2	0	0	0	114.3	E412	E412-N414 PolarHBondContact O-N 2.9Å
415	G	47.5	Very low	48.5	Very low	71 Å²	71	129.3 Å²	129.3	73%	0.732	73%	0.731	S	S	*	*			trans	-118.1	49.5	-175.4	0	0	0	0	0	115
416	S	45.4	Very low	48.3	Very low	111 Å²	111	131.2 Å²	131.2	78%	0.776	75%	0.75	S	S	*	*			trans	-170.8	100	159	51	0	0	0	0	111.4
417	D	38.2	Very low	48	Very low	249 Å²	249	127.9 Å²	127.9	100%	1.332	75%	0.753	S	S	*	*			trans	-158.6	0	137.2	-102.6	-11	0	0	0	109.8

Retrieved 417 of 417 residues in 859.4 ms (Link to these results)

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