A0A087X8A8_POEFO Loading...

Synthesis of cytochrome C oxidase 1

AlphaFold DB , UniProt , Accession A0A087X8A8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 303 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	Y	35.5	Very low	34.8	Very low	277 Å²	277	146.9 Å²	146.9	100%	1.086	83%	0.831	S	S	*	*				0	129.3	0	-77.2	-90.7	0	0	0	108.4
2	T	37.5	Very low	34.8	Very low	131 Å²	131	146.9 Å²	146.9	80%	0.804	83%	0.826	S	S	*	*			trans	59.8	98.1	174.3	60.8	0	0	0	0	116.8
3	L	34.5	Very low	34.4	Very low	183 Å²	183	148.5 Å²	148.5	96%	0.958	82%	0.818	S	S	*	*				72.9	120.7	61.5	-75.5	164.4	0	0	0	115.8
4	G	30.5	Very low	34.3	Very low	75 Å²	75	148.4 Å²	148.4	77%	0.773	82%	0.816	S	S	*	*			trans	128	129.9	142.2	0	0	0	0	0	114.3
5	S	31.7	Very low	34.5	Very low	121 Å²	121	148.4 Å²	148.4	85%	0.846	81%	0.813	S	S	*	*			cis	-167.2	140.9	-14.1	-177.3	0	0	0	0	107
6	S	37.2	Very low	34.4	Very low	91 Å²	91	144.7 Å²	144.7	64%	0.636	82%	0.82	S	S	*	*			trans	-65	153.8	169.7	-169.7	0	0	0	0	112.5
7	K	34.6	Very low	34.5	Very low	210 Å²	210	141.5 Å²	141.5	91%	0.913	81%	0.807	S	S	*	*			trans	-148.3	128.6	137.9	-80	-159	178	176.1	0	111.3
8	E	33.3	Very low	34.2	Very low	179 Å²	179	144.5 Å²	144.5	84%	0.836	80%	0.804	S	S	*	*			trans	-84.8	169.3	-174.9	-70.3	-176.6	119.7	0	0	115
9	L	39.5	Very low	34.2	Very low	160 Å²	160	146.1 Å²	146.1	84%	0.838	81%	0.81	S	S	*	*			trans	-51.5	167.7	173.2	-60.7	152.9	0	0	0	115.7
10	P	38.6	Very low	34.5	Very low	131 Å²	131	145.3 Å²	145.3	85%	0.851	81%	0.808	S	S	*	*				-142.4	160.2	88.4	35.2	-18.1	0	0	0	111.5
11	G	29.8	Very low	34.5	Very low	58 Å²	58	145.4 Å²	145.4	60%	0.598	80%	0.803	S	S	*	*			cis	162.4	158.2	14.9	0	0	0	0	0	108.7
12	L	34.5	Very low	34.4	Very low	147 Å²	147	138 Å²	138	77%	0.77	79%	0.791	S	S	*	*			trans	65.4	119.8	160.5	-72	111	0	0	0	118.8
13	K	30.2	Very low	34.3	Very low	167 Å²	167	142.2 Å²	142.2	73%	0.726	80%	0.799	S	S	*	*			cis	127.3	145.2	28.3	-100.8	-177.5	-145.4	179.4	0	103.9
14	N	33.3	Very low	34.5	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	79%	0.785	S	S	*	*			trans	92.1	118.9	173.8	-53.6	-20.6	0	0	0	113.3
15	L	37	Very low	34.8	Very low	149 Å²	149	142.3 Å²	142.3	78%	0.78	79%	0.793	S	S	*	*			cis	-149.3	119	11.6	-82.3	114.8	0	0	0	109.6	C17	L15-C17 PolarHBondContact O-N 3.5Å
16	G	31.9	Very low	35.1	Very low	89 Å²	89	145.3 Å²	145.3	92%	0.918	79%	0.794	S	S	*	*			trans	-77.6	104.1	144.2	0	0	0	0	0	107.7
17	C	37.2	Very low	35.3	Very low	90 Å²	90	148.4 Å²	148.4	61%	0.608	80%	0.803	S	S	*	*			trans	-160.8	145.6	159.5	-153.2	0	0	0	0	105.9	L15	L15-C17 PolarHBondContact O-N 3.5Å
18	W	28.9	Very low	35.4	Very low	196 Å²	196	150.4 Å²	150.4	74%	0.742	81%	0.805	S	S	*	*			trans	91.9	42	-171.4	-56.5	88.7	0	0	0	116.4	Q21	W18-Q21 HydrophobicContact CE3-CB 4.21Å; W18-Q21 HydrophobicContact CZ3-CB 3.92Å
19	L	34.4	Very low	35.4	Very low	175 Å²	175	146.6 Å²	146.6	92%	0.916	80%	0.804	S	S	*	*	S	Bend	trans	-108.6	44.4	149.7	-148	107.7	0	0	0	111.1
20	V	39.3	Very low	35.4	Very low	129 Å²	129	145.5 Å²	145.5	78%	0.782	80%	0.804	S	S	*	*	S	Bend	trans	-155.6	73.5	163.7	-173.8	0	0	0	0	108.3
21	Q	34.6	Very low	35.1	Very low	149 Å²	149	150.2 Å²	150.2	70%	0.696	80%	0.804	S	S	*	*	S	Bend	trans	167.8	79.3	158.1	-99	167.4	-0.8	0	0	109.9	W18	W18-Q21 HydrophobicContact CE3-CB 4.21Å; W18-Q21 HydrophobicContact CZ3-CB 3.92Å
22	S	34.2	Very low	35.2	Very low	120 Å²	120	156.1 Å²	156.1	84%	0.839	82%	0.821	S	S	*	*	S	Bend	trans	-160.7	29.5	147.9	-162.1	0	0	0	0	112.3
23	K	35.4	Very low	35	Very low	221 Å²	221	153.6 Å²	153.6	96%	0.961	82%	0.822	S	S	*	*	S	Bend	trans	-106.4	62.4	161.8	-104.9	-176.2	177.4	-179.6	0	107.3
24	A	37.8	Very low	35	Very low	82 Å²	82	155 Å²	155	68%	0.678	83%	0.83	S	S	*	*			trans	-160.9	42.1	177.7	0	0	0	0	0	112.2
25	L	37.2	Very low	34.8	Very low	177 Å²	177	153.2 Å²	153.2	93%	0.927	83%	0.829	S	S	*	*			trans	-150.6	48.4	169.1	-95.7	170.7	0	0	0	110.3
26	Q	38.6	Very low	34.7	Very low	185 Å²	185	153.7 Å²	153.7	86%	0.864	83%	0.832	S	S	*	*	S	Bend	trans	-127.3	138.7	155.3	-89.5	177.4	-25.3	0	0	106
27	N	41.1	Very low	34.9	Very low	156 Å²	156	156.9 Å²	156.9	83%	0.834	83%	0.826	S	S	*	*			trans	90.4	68.6	-174.1	-60.2	-32.5	0	0	0	116.7
28	R	35.7	Very low	34.4	Very low	252 Å²	252	155.6 Å²	155.6	95%	0.951	83%	0.828	S	S	*	*			trans	-155.9	63.1	154.3	-127.4	-176.8	-174.7	-156	1.7	113.1
29	A	33.6	Very low	34.6	Very low	99 Å²	99	158 Å²	158	82%	0.818	84%	0.837	S	S	*	*	S	Bend	trans	-170	30.9	159	0	0	0	0	0	114.6
30	V	39.5	Very low	34.5	Very low	137 Å²	137	159 Å²	159	83%	0.83	84%	0.837	S	S	*	*	S	Bend	trans	-146.6	130.7	161.8	-176.8	0	0	0	0	107.5
31	R	33	Very low	34.2	Very low	230 Å²	230	157.4 Å²	157.4	87%	0.868	84%	0.837	S	S	*	*			trans	96	88.6	-174.1	-64.3	-178.3	-98.8	-144.1	-6.7	114.7
32	L	31.4	Very low	33.9	Very low	181 Å²	181	153.8 Å²	153.8	95%	0.948	84%	0.841	S	S	*	*			trans	-163.8	91.8	146.5	-100.1	169.4	0	0	0	108.5
33	A	30.4	Very low	33.6	Very low	95 Å²	95	159.9 Å²	159.9	79%	0.785	85%	0.845	S	S	*	*			trans	-177	64.4	152.9	0	0	0	0	0	110.3
34	H	31.1	Very low	33.5	Very low	196 Å²	196	158.5 Å²	158.5	91%	0.907	84%	0.839	S	S	*	*			trans	-146.9	143.5	156.5	-113.6	-100	0	0	0	107.1
35	S	29.5	Very low	33.2	Very low	109 Å²	109	163.1 Å²	163.1	76%	0.762	85%	0.846	S	S	*	*			trans	87.1	80.4	169.7	178.4	0	0	0	0	118.2
36	L	33.4	Very low	32.8	Very low	160 Å²	160	159.2 Å²	159.2	84%	0.838	83%	0.834	S	S	*	*			trans	-151.7	126.2	140.9	-76.6	-175	0	0	0	104
37	I	35.9	Very low	32.4	Very low	156 Å²	156	158 Å²	158	80%	0.8	83%	0.833	S	S	*	*			cis	-158.6	144.8	20.9	-87	142.4	0	0	0	106.2
38	G	28.3	Very low	31.8	Very low	63 Å²	63	155.9 Å²	155.9	65%	0.649	83%	0.83	S	S	*	*			trans	-102.2	159.9	172.2	0	0	0	0	0	113.6
39	R	32.6	Very low	31.5	Very low	246 Å²	246	147.6 Å²	147.6	93%	0.928	82%	0.815	S	S	*	*			trans	79.1	113.2	151.7	-68.7	-175.8	-178.8	176	1.4	120.4
40	E	32.7	Very low	31.6	Very low	196 Å²	196	154.1 Å²	154.1	92%	0.916	82%	0.818	S	S	*	*				177.5	152.6	116.3	-97.3	-177.6	170.4	0	0	106.6
41	A	31.4	Very low	31.2	Very low	95 Å²	95	154 Å²	154	79%	0.785	82%	0.819	S	S	*	*			cis	-160	155.9	-13.6	0	0	0	0	0	105.5
42	G	29.2	Very low	31.2	Very low	74 Å²	74	150.4 Å²	150.4	76%	0.763	81%	0.812	S	S	*	*			trans	-79.4	162.5	-168.5	0	0	0	0	0	117.2
43	R	27.7	Very low	31.4	Very low	248 Å²	248	150 Å²	150	94%	0.936	81%	0.809	S	S	*	*			trans	-165.4	142.3	144.3	-139.8	169.6	-74.8	-171.5	-2.3	111.8
44	K	34.2	Very low	31.3	Very low	191 Å²	191	149.2 Å²	149.2	83%	0.83	80%	0.797	S	S	*	*			trans	-76.2	178.6	178	-65.7	-177.6	175.5	-177	0	112.4
45	H	30.8	Very low	31.3	Very low	180 Å²	180	151 Å²	151	83%	0.833	80%	0.798	S	S	*	*			trans	109.5	105.6	172.8	-66.1	-83.4	0	0	0	111.8
46	S	28.9	Very low	31.6	Very low	95 Å²	95	153.3 Å²	153.3	66%	0.664	80%	0.801	S	S	*	*				66.4	118.1	64.2	-168.9	0	0	0	0	114.2
47	L	29.8	Very low	31.8	Very low	160 Å²	160	152.1 Å²	152.1	84%	0.838	80%	0.8	S	S	*	*			trans	80.2	115.7	155.6	-67.8	158.8	0	0	0	120.6
48	S	27.9	Very low	31.6	Very low	110 Å²	110	152 Å²	152	77%	0.769	80%	0.801	S	S	*	*				75	130.1	120.2	-163.2	0	0	0	0	121.3
49	A	31.1	Very low	32	Very low	78 Å²	78	153 Å²	153	65%	0.645	80%	0.803	S	S	*	*			trans	81.5	123.1	147.3	0	0	0	0	0	119.7
50	R	33.9	Very low	32.2	Very low	236 Å²	236	146.1 Å²	146.1	89%	0.891	79%	0.792	S	S	*	*			trans	59.8	121.3	145.9	-66.4	173.7	169.3	178.7	-4.3	114
51	T	32.7	Very low	32.3	Very low	136 Å²	136	145.7 Å²	145.7	83%	0.834	78%	0.782	S	S	*	*				-169.9	134.2	85.5	-58.8	0	0	0	0	109.2
52	E	33.1	Very low	32.3	Very low	154 Å²	154	153.3 Å²	153.3	72%	0.72	79%	0.791	S	S	*	*			trans	-48	141.9	168.4	-71.3	-107.1	140.2	0	0	114.1
53	L	33.8	Very low	32.6	Very low	171 Å²	171	158.8 Å²	158.8	90%	0.895	79%	0.789	S	S	*	*			trans	-153.2	104.2	140	-113.1	147.3	0	0	0	111
54	C	28.9	Very low	33.2	Very low	79 Å²	79	153.4 Å²	153.4	53%	0.534	78%	0.784	S	S	.	*			trans	-50.3	134.1	168.8	-80.8	0	0	0	0	113.4	L56	C54-L56 HydrophobicContact CB-CG 4.39Å
55	Y	31.7	Very low	33.1	Very low	235 Å²	235	154 Å²	154	92%	0.922	79%	0.786	S	S	*	*			trans	-103.4	104.1	147.4	-89.8	-87.2	0	0	0	108.1
56	L	35.6	Very low	33.4	Very low	157 Å²	157	157.1 Å²	157.1	82%	0.822	79%	0.791	S	S	*	*			trans	-81.1	115.7	177.3	-81.5	166.2	0	0	0	110.5	C54 N58	C54-L56 HydrophobicContact CB-CG 4.39Å; L56-N58 PolarHBondContact O-N 2.75Å
57	V	36.5	Very low	33.7	Very low	135 Å²	135	155.4 Å²	155.4	82%	0.818	79%	0.789	S	S	*	*			trans	-70.1	117.5	160.1	174.8	0	0	0	0	108	A59	V57-A59 PolarHBondContact O-N 3.29Å; V57-A59 VanDerWaalsContact O-N 3.14Å
58	N	32.6	Very low	34.1	Very low	153 Å²	153	154.3 Å²	154.3	82%	0.818	79%	0.788	S	S	*	*			trans	-82	89.6	179.9	-163.6	1.7	0	0	0	110.3	L56	L56-N58 PolarHBondContact O-N 2.75Å
59	A	37.3	Very low	34.2	Very low	85 Å²	85	157.3 Å²	157.3	70%	0.702	79%	0.79	S	S	*	*			trans	-105.6	91.6	167.9	0	0	0	0	0	109	V57 R61	V57-A59 PolarHBondContact O-N 3.29Å; V57-A59 VanDerWaalsContact O-N 3.14Å; A59-R61 VanDerWaalsContact C-N 3.32Å; A59-R61 PolarHBondContact O-N 2.84Å
60	S	35.5	Very low	34.3	Very low	101 Å²	101	164 Å²	164	71%	0.706	80%	0.799	S	S	*	*			trans	-73.7	86	177.5	54.2	0	0	0	0	111.6
61	R	35.9	Very low	34.5	Very low	187 Å²	187	161.2 Å²	161.2	71%	0.706	80%	0.801	S	S	*	*			trans	4.6	112.5	139.3	-159.8	170.5	-173.5	-170.4	1.5	117.6	A59 R63	A59-R61 VanDerWaalsContact C-N 3.32Å; A59-R61 PolarHBondContact O-N 2.84Å; R61-R63 HydrophobicContact CG-CG 4.33Å; R61-R63 PolarHBondContact O-N 2.95Å
62	W	30.3	Very low	34.8	Very low	255 Å²	255	162.2 Å²	162.2	97%	0.966	79%	0.794	S	S	*	*			trans	-69.8	118.7	157.9	-69.5	56.6	0	0	0	108.8
63	R	36.2	Very low	35.3	Very low	189 Å²	189	163.2 Å²	163.2	71%	0.713	80%	0.803	S	S	*	*			trans	-104.5	117.8	168.5	-78.8	-169.7	-162.3	-149.2	7.4	109.8	R61	R61-R63 HydrophobicContact CG-CG 4.33Å; R61-R63 PolarHBondContact O-N 2.95Å
64	T	40.9	Very low	35.8	Very low	135 Å²	135	163.5 Å²	163.5	83%	0.828	80%	0.799	S	S	*	*			trans	-56.1	131.4	159.7	48.4	0	0	0	0	110.8
65	F	32.3	Very low	36.5	Very low	202 Å²	202	164.5 Å²	164.5	89%	0.886	81%	0.807	S	S	*	*			trans	-120.6	107.8	163.9	-125.8	-95	0	0	0	108.8
66	R	37.3	Very low	37.4	Very low	246 Å²	246	159.2 Å²	159.2	93%	0.928	81%	0.805	S	S	*	*			trans	-95.7	146	158.1	-83.5	-173.9	-177.1	-153.5	1.2	107.5
67	G	34.3	Very low	37.9	Very low	60 Å²	60	162.3 Å²	162.3	62%	0.619	81%	0.806	S	S	*	*			trans	119.9	88	152.1	0	0	0	0	0	116.3
68	T	37.4	Very low	38.4	Very low	136 Å²	136	161.3 Å²	161.3	83%	0.834	80%	0.802	S	S	*	*				31.6	128.5	128.2	47.2	0	0	0	0	120.2
69	Q	31.7	Very low	39.1	Very low	174 Å²	174	163.7 Å²	163.7	81%	0.813	81%	0.805	S	S	*	*				166.2	114.2	99.5	-175.4	162.8	-12.2	0	0	112.5
70	W	31.7	Very low	39.5	Very low	219 Å²	219	164.6 Å²	164.6	83%	0.83	81%	0.807	S	S	*	*			trans	28.8	121.3	142.3	-67.3	83.7	0	0	0	121.4
71	L	38.1	Very low	40.2	Very low	177 Å²	177	164.5 Å²	164.5	93%	0.927	81%	0.806	S	S	*	*			trans	-143.7	135.4	135.2	-102.3	159.2	0	0	0	110.8
72	K	40.3	Very low	40.8	Very low	156 Å²	156	164.4 Å²	164.4	68%	0.678	82%	0.815	S	S	*	*			trans	-68.6	135.9	-172.5	-65.6	163.8	172.9	175	0	111.4
73	L	43	Very low	41.7	Very low	175 Å²	175	158.2 Å²	158.2	92%	0.916	81%	0.808	S	S	*	*			trans	-135.7	110	141.4	-103.8	110.6	0	0	0	109.1	S75	L73-S75 PolarHBondContact O-N 3.46Å
74	H	45.4	Very low	42.2	Very low	177 Å²	177	154.2 Å²	154.2	82%	0.819	81%	0.809	S	S	*	*			trans	-61.7	120.1	164.7	-85.8	-114.5	0	0	0	108.7
75	S	43.3	Very low	42.7	Very low	100 Å²	100	153 Å²	153	70%	0.699	81%	0.806	S	S	*	*			trans	-133	114.9	147.3	71.6	0	0	0	0	107.6	L73 R77	L73-S75 PolarHBondContact O-N 3.46Å; S75-R77 PolarHBondContact O-N 3.5Å
76	S	50.3	Low	43.4	Very low	125 Å²	125	147.1 Å²	147.1	87%	0.874	80%	0.802	S	S	*	*			trans	-59.9	120.4	172.8	24.1	0	0	0	0	109.4
77	R	45.9	Very low	43.8	Very low	221 Å²	221	143 Å²	143	83%	0.834	80%	0.799	S	S	*	*			trans	-123.4	135.6	160.7	-73.4	-170.6	173.1	-165.1	-2.1	108.7	S75	S75-R77 PolarHBondContact O-N 3.5Å
78	P	47	Very low	44.5	Very low	114 Å²	114	149.5 Å²	149.5	74%	0.74	81%	0.81	S	S	*	*			trans	-67.8	146.2	-169	28.5	-33.5	0	0	0	110.9	S80	P78-S80 PolarHBondContact O-N 2.89Å
79	F	46.3	Very low	44.9	Very low	204 Å²	204	148 Å²	148	90%	0.895	81%	0.806	S	S	*	*			trans	-58.3	103	168.9	-174.4	-98	0	0	0	109
80	S	46	Very low	46	Very low	104 Å²	104	149.5 Å²	149.5	73%	0.727	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-94.1	123.4	166.3	-64.4	0	0	0	0	108.8	P78	P78-S80 PolarHBondContact O-N 2.89Å
81	S	50.3	Low	47	Very low	98 Å²	98	148.6 Å²	148.6	69%	0.685	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-50.7	140.7	177.9	36.4	0	0	0	0	113.4
82	M	48.6	Very low	47.9	Very low	185 Å²	185	144.4 Å²	144.4	91%	0.911	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62.6	136.3	165.6	-74.7	-176.2	-124.2	0	0	110.4
83	P	50.1	Low	49.2	Very low	126 Å²	126	139.1 Å²	139.1	82%	0.818	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-80.4	132.8	151.8	30.7	-23.9	0	0	0	109.3
84	S	45.7	Very low	50.5	Low	104 Å²	104	137.6 Å²	137.6	73%	0.727	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.1	144.3	171.8	178.1	0	0	0	0	111.9
85	S	51.8	Low	51.8	Low	110 Å²	110	133.6 Å²	133.6	77%	0.769	78%	0.775	S	S	*	*			trans	45.9	109.6	147.6	58.2	0	0	0	0	118.9
86	G	47.7	Very low	53.9	Low	78 Å²	78	131.7 Å²	131.7	80%	0.804	76%	0.759	S	S	*	*			trans	171	101.3	161.2	0	0	0	0	0	115.4
87	D	44.3	Very low	55.3	Low	161 Å²	161	136.2 Å²	136.2	86%	0.861	76%	0.757	S	S	*	*			trans	80.3	124.8	151.2	-144.2	-4.1	0	0	0	120.7	S89	D87-S89 PolarHBondContact O-N 2.98Å; D87-S89 VanDerWaalsContact O-N 3.09Å
88	K	49.3	Very low	57.3	Low	196 Å²	196	134 Å²	134	85%	0.852	75%	0.754	S	S	*	*			trans	-78.5	87.9	177.1	-70.5	-176.9	179.8	178	0	108.7	K90	K88-K90 PolarHBondContact O-N 3.42Å
89	S	46.8	Very low	59.2	Low	105 Å²	105	131.4 Å²	131.4	73%	0.734	74%	0.738	S	S	*	*			trans	-69	108.8	165.8	66.1	0	0	0	0	109.6	D87 K91	D87-S89 PolarHBondContact O-N 2.98Å; D87-S89 VanDerWaalsContact O-N 3.09Å; S89-K91 PolarHBondContact O-N 2.94Å
90	K	54.3	Low	61.3	Low	204 Å²	204	124.9 Å²	124.9	89%	0.887	71%	0.712	S	S	*	*			trans	-56.5	105.2	170.6	-82	177.8	175.4	174.4	0	108.5	K88 S92	K88-K90 PolarHBondContact O-N 3.42Å; K90-S92 PolarHBondContact O-N 3.13Å
91	K	52.1	Low	63.5	Low	200 Å²	200	122.7 Å²	122.7	87%	0.87	70%	0.7	S	S	*	*			trans	-64.9	100.4	166.5	-67.9	-177.5	-179.7	179.9	0	107.9	S89 G93	S89-K91 PolarHBondContact O-N 2.94Å; K91-G93 PolarHBondContact O-N 2.73Å
92	S	58.6	Low	65.6	Low	89 Å²	89	122 Å²	122	62%	0.622	69%	0.692	S	S	*	*			trans	-68.4	123.8	170.6	-148.5	0	0	0	0	107.7	K90	K90-S92 PolarHBondContact O-N 3.13Å
93	G	65.9	Low	67.6	Low	45 Å²	45	117.3 Å²	117.3	46%	0.464	67%	0.673	S	S	.	*			trans	-62.2	170	170.8	0	0	0	0	0	111.2	K91 V95	K91-G93 PolarHBondContact O-N 2.73Å; G93-V95 PolarHBondContact O-N 2.77Å
94	P	72.1	Confident	69.8	Low	144 Å²	144	118.7 Å²	118.7	94%	0.935	67%	0.667	S	S	*	*	S	Bend	trans	-62.2	-5.3	-173.3	24.7	-34	0	0	0	114.9
95	V	72	Confident	72.1	Confident	92 Å²	92	116.8 Å²	116.8	56%	0.558	66%	0.658	S	S	*	*	S	Bend	trans	-122.9	108	176.7	-168.5	0	0	0	0	109.4	G93 L100	G93-V95 PolarHBondContact O-N 2.77Å; V95-L100 HydrophobicContact CG1-CD1 4Å; V95-L100 HydrophobicContact CG1-CG 3.83Å
96	T	86.3	Confident	74.2	Confident	60 Å²	60	116.5 Å²	116.5	37%	0.368	65%	0.646	S	S	.	*			trans	-74.9	143.8	170.8	31	0	0	0	0	111.1	K98 S99 L100	T96-K98 PolarHBondContact O-N 3.39Å; T96-K98 VanDerWaalsContact O-N 3.08Å; T96-S99 WeakPolarHBondContact O-CB 3.25Å; T96-S99 PolarHBondContact O-N 3.16Å; T96-S99 PolarHBondContact OG1-OG 3.39Å; T96-L100 PolarHBondContact O-N 3.36Å
97	W	81.4	Confident	76.5	Confident	221 Å²	221	114.2 Å²	114.2	84%	0.837	62%	0.623	S	S	*	*	H	α-helix	trans	-54.5	-30.3	177.2	-164.7	-91.9	0	0	0	113.3	L100 A101	W97-L100 PolarHBondContact O-N 2.96Å; W97-A101 PolarHBondContact O-N 3.12Å; W97-A101 VanDerWaalsContact O-N 3.08Å
98	K	86.6	Confident	79	Confident	175 Å²	175	108.7 Å²	108.7	76%	0.761	60%	0.604	S	S	*	*	H	α-helix	trans	-65	-42	173.7	-62.8	-176.7	179.3	-177.4	0	112.4	T96 L100 A101 V102	T96-K98 PolarHBondContact O-N 3.39Å; T96-K98 VanDerWaalsContact O-N 3.08Å; K98-L100 VanDerWaalsContact C-N 3.34Å; K98-A101 PolarHBondContact O-N 3.05Å; K98-V102 WeakPolarHBondContact O-CG2 3.49Å; K98-V102 PolarHBondContact O-N 3.07Å; K98-V102 VanDerWaalsContact O-N 3.08Å
99	S	86.3	Confident	81.2	Confident	58 Å²	58	102.7 Å²	102.7	41%	0.406	59%	0.59	S	S	.	*	H	α-helix	trans	-66.4	-39.1	178.6	-49.6	0	0	0	0	111.2	T96 V102 T103	T96-S99 WeakPolarHBondContact O-CB 3.25Å; T96-S99 PolarHBondContact O-N 3.16Å; T96-S99 PolarHBondContact OG1-OG 3.39Å; S99-V102 PolarHBondContact O-N 3.39Å; S99-T103 PolarHBondContact O-N 3Å; S99-T103 PolarHBondContact O-OG1 3.34Å; S99-T103 VanDerWaalsContact O-OG1 3.06Å
100	L	90.9	Very high	83.5	Confident	67 Å²	67	102.8 Å²	102.8	35%	0.351	58%	0.582	S	S	.	*	H	α-helix	trans	-59.1	-49.4	172	-93.7	162.6	0	0	0	111.7	V95 T96 W97 K98 V102 T103 F104	V95-L100 HydrophobicContact CG1-CD1 4Å; V95-L100 HydrophobicContact CG1-CG 3.83Å; T96-L100 PolarHBondContact O-N 3.36Å; W97-L100 PolarHBondContact O-N 2.96Å; K98-L100 VanDerWaalsContact C-N 3.34Å; L100-V102 VanDerWaalsContact C-N 3.3Å; L100-V102 PolarHBondContact O-N 3.33Å; L100-T103 WeakPolarHBondContact CA-OG1 3.31Å; L100-T103 PolarHBondContact O-N 3.26Å; L100-T103 PolarHBondContact O-OG1 3.48Å; L100-F104 HydrophobicContact CD2-CD2 4.32Å; L100-F104 HydrophobicContact CD2-CE2 3.92Å; L100-F104 VanDerWaalsContact O-CD2 3.32Å; L100-F104 WeakPolarHBondContact O-CD2 3.36Å; L100-F104 PolarHBondContact O-N 3.17Å
101	A	92.4	Very high	85.4	Confident	58 Å²	58	98.7 Å²	98.7	48%	0.479	57%	0.57	S	S	.	*	H	α-helix	trans	-58.5	-41.6	179.1	0	0	0	0	0	112.5	W97 K98 F104 A105	W97-A101 PolarHBondContact O-N 3.12Å; W97-A101 VanDerWaalsContact O-N 3.08Å; K98-A101 PolarHBondContact O-N 3.05Å; A101-F104 PolarHBondContact O-N 3.35Å; A101-A105 WeakPolarHBondContact O-CB 3.04Å; A101-A105 PolarHBondContact O-N 3.08Å
102	V	94.4	Very high	87.4	Confident	84 Å²	84	91.1 Å²	91.1	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-65.4	-44.6	176.6	173.7	0	0	0	0	111.4	K98 S99 L100 F104 A105 I106	K98-V102 WeakPolarHBondContact O-CG2 3.49Å; K98-V102 PolarHBondContact O-N 3.07Å; K98-V102 VanDerWaalsContact O-N 3.08Å; S99-V102 PolarHBondContact O-N 3.39Å; L100-V102 VanDerWaalsContact C-N 3.3Å; L100-V102 PolarHBondContact O-N 3.33Å; V102-F104 VanDerWaalsContact C-N 3.33Å; V102-F104 PolarHBondContact O-N 3.37Å; V102-A105 PolarHBondContact O-N 3.01Å; V102-I106 HydrophobicContact CG1-CD1 3.77Å; V102-I106 HydrophobicContact CG1-CG1 4.43Å; V102-I106 WeakPolarHBondContact O-CG1 3.3Å; V102-I106 PolarHBondContact O-N 2.87Å
103	T	91.8	Very high	89.1	Confident	86 Å²	86	88.1 Å²	88.1	53%	0.528	53%	0.531	S	S	.	.	H	α-helix	trans	-62.6	-38.2	176.9	44.8	0	0	0	0	112.8	S99 L100 G107	S99-T103 PolarHBondContact O-N 3Å; S99-T103 PolarHBondContact O-OG1 3.34Å; S99-T103 VanDerWaalsContact O-OG1 3.06Å; L100-T103 WeakPolarHBondContact CA-OG1 3.31Å; L100-T103 PolarHBondContact O-N 3.26Å; L100-T103 PolarHBondContact O-OG1 3.48Å; T103-G107 PolarHBondContact O-N 2.99Å
104	F	94.9	Very high	90.3	Very high	155 Å²	155	91.5 Å²	91.5	68%	0.68	54%	0.536	S	S	*	.	H	α-helix	trans	-67.4	-38.6	174.8	-88.8	-76.6	0	0	0	112.4	L100 A101 V102 G108	L100-F104 HydrophobicContact CD2-CD2 4.32Å; L100-F104 HydrophobicContact CD2-CE2 3.92Å; L100-F104 VanDerWaalsContact O-CD2 3.32Å; L100-F104 WeakPolarHBondContact O-CD2 3.36Å; L100-F104 PolarHBondContact O-N 3.17Å; A101-F104 PolarHBondContact O-N 3.35Å; V102-F104 VanDerWaalsContact C-N 3.33Å; V102-F104 PolarHBondContact O-N 3.37Å; F104-G108 PolarHBondContact O-N 2.99Å
105	A	95.3	Very high	91.3	Very high	65 Å²	65	92.5 Å²	92.5	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-64.8	-46.4	176.9	0	0	0	0	0	111.9	A101 V102 G108 A109	A101-A105 WeakPolarHBondContact O-CB 3.04Å; A101-A105 PolarHBondContact O-N 3.08Å; V102-A105 PolarHBondContact O-N 3.01Å; A105-G108 PolarHBondContact O-N 3.34Å; A105-A109 WeakPolarHBondContact O-CB 3.34Å; A105-A109 PolarHBondContact O-N 2.84Å
106	I	95.3	Very high	92.2	Very high	104 Å²	104	95.4 Å²	95.4	53%	0.533	53%	0.528	S	S	.	.	H	α-helix	trans	-65.3	-46.7	177.5	-63.9	170	0	0	0	110.1	V102 G108 A109 L110	V102-I106 HydrophobicContact CG1-CD1 3.77Å; V102-I106 HydrophobicContact CG1-CG1 4.43Å; V102-I106 WeakPolarHBondContact O-CG1 3.3Å; V102-I106 PolarHBondContact O-N 2.87Å; I106-G108 VanDerWaalsContact C-N 3.34Å; I106-G108 PolarHBondContact O-N 3.04Å; I106-A109 PolarHBondContact O-N 3.34Å; I106-L110 WeakPolarHBondContact O-CB 3.18Å; I106-L110 PolarHBondContact O-N 2.92Å
107	G	95.3	Very high	92.3	Very high	30 Å²	30	99 Å²	99	31%	0.309	54%	0.538	S	S	.	.	H	α-helix	trans	-60.3	-42.2	177	0	0	0	0	0	112.6	T103 L110 L111	T103-G107 PolarHBondContact O-N 2.99Å; G107-L110 PolarHBondContact O-N 2.85Å; G107-L111 WeakPolarHBondContact O-CB 3.32Å; G107-L111 VanDerWaalsContact O-CG 3.28Å; G107-L111 WeakPolarHBondContact O-CG 3.42Å; G107-L111 PolarHBondContact O-N 2.92Å
108	G	96.3	Very high	92.6	Very high	44 Å²	44	94.7 Å²	94.7	45%	0.454	53%	0.526	S	S	.	.	H	α-helix	trans	-64	-42.1	176	0	0	0	0	0	113	F104 A105 I106 G112	F104-G108 PolarHBondContact O-N 2.99Å; A105-G108 PolarHBondContact O-N 3.34Å; I106-G108 VanDerWaalsContact C-N 3.34Å; I106-G108 PolarHBondContact O-N 3.04Å; G108-G112 PolarHBondContact O-N 2.81Å
109	A	95.5	Very high	92.6	Very high	70 Å²	70	92.6 Å²	92.6	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-64.7	-41.9	175.2	0	0	0	0	0	111.9	A105 I106 G112 G113	A105-A109 WeakPolarHBondContact O-CB 3.34Å; A105-A109 PolarHBondContact O-N 2.84Å; I106-A109 PolarHBondContact O-N 3.34Å; A109-G112 PolarHBondContact O-N 2.79Å; A109-G113 PolarHBondContact O-N 2.85Å
110	L	95.3	Very high	92.4	Very high	108 Å²	108	93.9 Å²	93.9	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-67.5	-44.6	179.7	-144.7	153.4	0	0	0	111	I106 G107 G113 M114	I106-L110 WeakPolarHBondContact O-CB 3.18Å; I106-L110 PolarHBondContact O-N 2.92Å; G107-L110 PolarHBondContact O-N 2.85Å; L110-G113 PolarHBondContact O-N 2.81Å; L110-M114 HydrophobicContact CD2-CG 4.21Å; L110-M114 HydrophobicContact CD2-SD 3.82Å; L110-M114 WeakPolarHBondContact O-CB 3.25Å; L110-M114 VanDerWaalsContact O-CG 3.26Å; L110-M114 WeakPolarHBondContact O-CG 3.32Å; L110-M114 PolarHBondContact O-N 3.4Å
111	L	94.2	Very high	92.1	Very high	118 Å²	118	97.3 Å²	97.3	62%	0.618	53%	0.528	S	S	*	.	H	α-helix	trans	-64.3	-40.3	173.3	-71.9	173.6	0	0	0	112.4	G107 M114 K115	G107-L111 WeakPolarHBondContact O-CB 3.32Å; G107-L111 VanDerWaalsContact O-CG 3.28Å; G107-L111 WeakPolarHBondContact O-CG 3.42Å; G107-L111 PolarHBondContact O-N 2.92Å; L111-M114 PolarHBondContact O-N 3.13Å; L111-K115 WeakPolarHBondContact O-CB 3.5Å; L111-K115 PolarHBondContact O-N 3.06Å
112	G	95	Very high	91.7	Very high	40 Å²	40	99.6 Å²	99.6	41%	0.412	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-46.6	175.4	0	0	0	0	0	111.9	G108 A109 K115 Y116	G108-G112 PolarHBondContact O-N 2.81Å; A109-G112 PolarHBondContact O-N 2.79Å; G112-K115 PolarHBondContact O-N 3.09Å; G112-Y116 WeakPolarHBondContact O-CB 3.21Å; G112-Y116 PolarHBondContact O-N 2.91Å
113	G	93.6	Very high	91.1	Very high	26 Å²	26	99.8 Å²	99.8	27%	0.268	52%	0.524	S	S	.	.	H	α-helix	trans	-60.1	-49	173.2	0	0	0	0	0	112	A109 L110 K115 Y116 F117	A109-G113 PolarHBondContact O-N 2.85Å; L110-G113 PolarHBondContact O-N 2.81Å; G113-K115 VanDerWaalsContact C-N 3.31Å; G113-K115 PolarHBondContact O-N 3.3Å; G113-Y116 WeakPolarHBondContact O-CB 3.12Å; G113-Y116 PolarHBondContact O-N 2.99Å; G113-F117 WeakPolarHBondContact O-CD2 3.43Å; G113-F117 PolarHBondContact O-N 2.94Å
114	M	91.6	Very high	90.6	Very high	117 Å²	117	100 Å²	100	58%	0.576	52%	0.522	S	S	*	.	H	α-helix	trans	-57.9	-41.9	176	-74.8	178.4	72.5	0	0	112.3	L110 L111 K118	L110-M114 HydrophobicContact CD2-CG 4.21Å; L110-M114 HydrophobicContact CD2-SD 3.82Å; L110-M114 WeakPolarHBondContact O-CB 3.25Å; L110-M114 VanDerWaalsContact O-CG 3.26Å; L110-M114 WeakPolarHBondContact O-CG 3.32Å; L110-M114 PolarHBondContact O-N 3.4Å; L111-M114 PolarHBondContact O-N 3.13Å; M114-K118 WeakPolarHBondContact O-CB 3.27Å; M114-K118 PolarHBondContact O-N 2.73Å
115	K	93.1	Very high	89.9	Confident	165 Å²	165	96.6 Å²	96.6	72%	0.717	51%	0.51	S	S	*	.	H	α-helix	trans	-66.4	-39.5	177.9	-171.7	178.2	179.6	179.3	0	111.8	L111 G112 G113 K119	L111-K115 WeakPolarHBondContact O-CB 3.5Å; L111-K115 PolarHBondContact O-N 3.06Å; G112-K115 PolarHBondContact O-N 3.09Å; G113-K115 VanDerWaalsContact C-N 3.31Å; G113-K115 PolarHBondContact O-N 3.3Å; K115-K119 WeakPolarHBondContact O-CB 3.45Å; K115-K119 PolarHBondContact O-N 2.66Å; K115-K119 VanDerWaalsContact O-N 3.17Å
116	Y	91.6	Very high	88.9	Confident	152 Å²	152	97.8 Å²	97.8	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-63.4	-53.8	175.5	177.8	-96.6	0	0	0	111.4	G112 G113 K118 K119 E120	G112-Y116 WeakPolarHBondContact O-CB 3.21Å; G112-Y116 PolarHBondContact O-N 2.91Å; G113-Y116 WeakPolarHBondContact O-CB 3.12Å; G113-Y116 PolarHBondContact O-N 2.99Å; Y116-K118 VanDerWaalsContact C-N 3.34Å; Y116-K118 PolarHBondContact O-N 2.69Å; Y116-K119 PolarHBondContact O-N 2.91Å; Y116-E120 PolarHBondContact O-N 3.15Å; Y116-E120 VanDerWaalsContact O-N 3.1Å
117	F	88.3	Confident	87.7	Confident	135 Å²	135	99.3 Å²	99.3	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-65	-34.9	179.7	-74.5	-64.1	0	0	0	113.1	G113 K121	G113-F117 WeakPolarHBondContact O-CD2 3.43Å; G113-F117 PolarHBondContact O-N 2.94Å; F117-K121 VanDerWaalsContact O-CB 3.27Å; F117-K121 WeakPolarHBondContact O-CB 3.4Å; F117-K121 PolarHBondContact O-N 3.24Å
118	K	87.3	Confident	86.6	Confident	132 Å²	132	104.2 Å²	104.2	57%	0.574	52%	0.522	S	S	*	.	H	α-helix	trans	-63.5	-44.7	175.6	-176.5	176.5	173.5	179.6	0	111.3	M114 Y116 K121 E122	M114-K118 WeakPolarHBondContact O-CB 3.27Å; M114-K118 PolarHBondContact O-N 2.73Å; Y116-K118 VanDerWaalsContact C-N 3.34Å; Y116-K118 PolarHBondContact O-N 2.69Å; K118-K121 PolarHBondContact O-N 2.81Å; K118-E122 WeakPolarHBondContact CE-OE1 3.1Å; K118-E122 IonicContact NZ-OE1 3.9Å; K118-E122 WeakPolarHBondContact O-CB 3.49Å; K118-E122 WeakPolarHBondContact O-CG 3.45Å; K118-E122 PolarHBondContact O-N 2.9Å
119	K	85.4	Confident	85.1	Confident	131 Å²	131	108.3 Å²	108.3	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-62.8	-46.4	178.6	-175.6	-179.4	174.7	-173.8	0	111.6	K115 Y116 K121 E122 E123	K115-K119 WeakPolarHBondContact O-CB 3.45Å; K115-K119 PolarHBondContact O-N 2.66Å; K115-K119 VanDerWaalsContact O-N 3.17Å; Y116-K119 PolarHBondContact O-N 2.91Å; K119-K121 VanDerWaalsContact C-N 3.35Å; K119-K121 PolarHBondContact O-N 2.93Å; K119-E122 PolarHBondContact O-N 3.32Å; K119-E123 WeakPolarHBondContact CE-OE1 3.41Å; K119-E123 WeakPolarHBondContact O-CG 3.33Å; K119-E123 PolarHBondContact O-N 2.54Å
120	E	83.2	Confident	83.5	Confident	85 Å²	85	109 Å²	109	40%	0.397	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-43.7	177.6	-172.9	174.1	-157.2	0	0	111.5	Y116 E123 L124	Y116-E120 PolarHBondContact O-N 3.15Å; Y116-E120 VanDerWaalsContact O-N 3.1Å; E120-E123 PolarHBondContact O-N 2.77Å; E120-L124 HydrophobicContact CG-CD1 4.26Å; E120-L124 WeakPolarHBondContact O-CB 3.29Å; E120-L124 VanDerWaalsContact O-CG 3.27Å; E120-L124 WeakPolarHBondContact O-CG 3.48Å; E120-L124 PolarHBondContact O-N 3.03Å
121	K	83.5	Confident	81.8	Confident	139 Å²	139	112.7 Å²	112.7	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-63.9	-40.9	176.5	-169.8	-179.7	179.4	-179.1	0	112.6	F117 K118 K119 L124 I125	F117-K121 VanDerWaalsContact O-CB 3.27Å; F117-K121 WeakPolarHBondContact O-CB 3.4Å; F117-K121 PolarHBondContact O-N 3.24Å; K118-K121 PolarHBondContact O-N 2.81Å; K119-K121 VanDerWaalsContact C-N 3.35Å; K119-K121 PolarHBondContact O-N 2.93Å; K121-L124 PolarHBondContact O-N 3.03Å; K121-I125 HydrophobicContact CD-CD1 4.47Å; K121-I125 HydrophobicContact CG-CD1 3.89Å; K121-I125 HydrophobicContact CG-CG1 4.44Å; K121-I125 WeakPolarHBondContact O-CB 3.4Å; K121-I125 VanDerWaalsContact O-CG1 3.22Å; K121-I125 WeakPolarHBondContact O-CG1 3.25Å; K121-I125 PolarHBondContact O-N 3Å
122	E	84.6	Confident	80	Confident	105 Å²	105	111.4 Å²	111.4	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-44.7	176.1	-78.7	171.4	179.6	0	0	111.6	K118 K119 L124 I125 E126	K118-E122 WeakPolarHBondContact CE-OE1 3.1Å; K118-E122 IonicContact NZ-OE1 3.9Å; K118-E122 WeakPolarHBondContact O-CB 3.49Å; K118-E122 WeakPolarHBondContact O-CG 3.45Å; K118-E122 PolarHBondContact O-N 2.9Å; K119-E122 PolarHBondContact O-N 3.32Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 2.95Å; E122-I125 PolarHBondContact O-N 2.78Å; E122-E126 WeakPolarHBondContact O-CB 3.12Å; E122-E126 PolarHBondContact O-N 3.08Å
123	E	81.6	Confident	78.2	Confident	88 Å²	88	116.1 Å²	116.1	41%	0.411	55%	0.545	S	S	.	.	H	α-helix	trans	-63.1	-37.4	176.4	-72.2	179	-167.3	0	0	112.3	K119 E120 K127	K119-E123 WeakPolarHBondContact CE-OE1 3.41Å; K119-E123 WeakPolarHBondContact O-CG 3.33Å; K119-E123 PolarHBondContact O-N 2.54Å; E120-E123 PolarHBondContact O-N 2.77Å; E123-K127 WeakPolarHBondContact O-CB 3.43Å; E123-K127 VanDerWaalsContact O-CG 3.32Å; E123-K127 WeakPolarHBondContact O-CG 3.4Å; E123-K127 PolarHBondContact O-N 2.85Å
124	L	81.8	Confident	76.4	Confident	90 Å²	90	116.6 Å²	116.6	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-69.4	-46.1	175.9	-72	172	0	0	0	112	E120 K121 E122 E126 K127 E128	E120-L124 HydrophobicContact CG-CD1 4.26Å; E120-L124 WeakPolarHBondContact O-CB 3.29Å; E120-L124 VanDerWaalsContact O-CG 3.27Å; E120-L124 WeakPolarHBondContact O-CG 3.48Å; E120-L124 PolarHBondContact O-N 3.03Å; K121-L124 PolarHBondContact O-N 3.03Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 2.95Å; L124-E126 VanDerWaalsContact C-N 3.29Å; L124-E126 PolarHBondContact O-N 2.82Å; L124-K127 PolarHBondContact O-N 2.93Å; L124-E128 WeakPolarHBondContact O-CB 3.47Å; L124-E128 WeakPolarHBondContact O-CG 3.34Å; L124-E128 PolarHBondContact O-N 3.25Å
125	I	80.1	Confident	75	Confident	85 Å²	85	121.4 Å²	121.4	44%	0.436	56%	0.562	S	S	.	*	H	α-helix	trans	-60	-42	176.4	-71.4	166.7	0	0	0	110.4	K121 E122 E128 R129	K121-I125 HydrophobicContact CD-CD1 4.47Å; K121-I125 HydrophobicContact CG-CD1 3.89Å; K121-I125 HydrophobicContact CG-CG1 4.44Å; K121-I125 WeakPolarHBondContact O-CB 3.4Å; K121-I125 VanDerWaalsContact O-CG1 3.22Å; K121-I125 WeakPolarHBondContact O-CG1 3.25Å; K121-I125 PolarHBondContact O-N 3Å; E122-I125 PolarHBondContact O-N 2.78Å; I125-E128 PolarHBondContact O-N 2.9Å; I125-R129 WeakPolarHBondContact O-CB 3.34Å; I125-R129 PolarHBondContact O-N 2.89Å
126	E	73.8	Confident	73.7	Confident	90 Å²	90	116.6 Å²	116.6	42%	0.421	55%	0.548	S	S	.	.	H	α-helix	trans	-65.4	-42.2	177.5	179.5	166.2	-151.7	0	0	112	E122 L124 R129 N130	E122-E126 WeakPolarHBondContact O-CB 3.12Å; E122-E126 PolarHBondContact O-N 3.08Å; L124-E126 VanDerWaalsContact C-N 3.29Å; L124-E126 PolarHBondContact O-N 2.82Å; E126-R129 IonicContact OE1-NH2 2.73Å; E126-N130 VanDerWaalsContact O-CB 3.31Å; E126-N130 WeakPolarHBondContact O-CB 3.34Å; E126-N130 PolarHBondContact O-N 3.18Å; E126-N130 PolarHBondContact O-ND2 3.21Å
127	K	71.5	Confident	72.7	Confident	136 Å²	136	113.1 Å²	113.1	59%	0.591	55%	0.551	S	S	*	*	H	α-helix	trans	-63.4	-43.4	173.6	-79.1	174.6	-179.2	171.2	0	112.1	E123 L124 N130 K131	E123-K127 WeakPolarHBondContact O-CB 3.43Å; E123-K127 VanDerWaalsContact O-CG 3.32Å; E123-K127 WeakPolarHBondContact O-CG 3.4Å; E123-K127 PolarHBondContact O-N 2.85Å; L124-K127 PolarHBondContact O-N 2.93Å; K127-N130 PolarHBondContact O-N 3.42Å; K127-K131 WeakPolarHBondContact O-CB 3.38Å; K127-K131 PolarHBondContact O-N 3.32Å
128	E	71.6	Confident	72.4	Confident	133 Å²	133	107.9 Å²	107.9	62%	0.621	53%	0.529	S	S	*	.	H	α-helix	trans	-67.2	-40.6	178.2	-78.1	-173.8	166.7	0	0	112.1	L124 I125 K131 S132	L124-E128 WeakPolarHBondContact O-CB 3.47Å; L124-E128 WeakPolarHBondContact O-CG 3.34Å; L124-E128 PolarHBondContact O-N 3.25Å; I125-E128 PolarHBondContact O-N 2.9Å; E128-K131 PolarHBondContact O-N 3.31Å; E128-S132 WeakPolarHBondContact O-CB 3.36Å; E128-S132 PolarHBondContact O-N 3.07Å; E128-S132 PolarHBondContact O-OG 2.82Å
129	R	64.3	Low	72.3	Confident	130 Å²	130	102.7 Å²	102.7	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-61.5	-46.5	172.9	180	-178.2	59	-168.1	-4.5	111.2	I125 E126 K131 S132 L133	I125-R129 WeakPolarHBondContact O-CB 3.34Å; I125-R129 PolarHBondContact O-N 2.89Å; E126-R129 IonicContact OE1-NH2 2.73Å; R129-K131 VanDerWaalsContact C-N 3.27Å; R129-K131 PolarHBondContact O-N 3.18Å; R129-S132 PolarHBondContact O-OG 3.35Å; R129-L133 HydrophobicContact CG-CD1 4.15Å; R129-L133 PolarHBondContact O-N 2.81Å
130	N	61.7	Low	72.3	Confident	84 Å²	84	98 Å²	98	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-66.8	-28.7	178	-72.6	-6.5	0	0	0	112.6	E126 K127	E126-N130 VanDerWaalsContact O-CB 3.31Å; E126-N130 WeakPolarHBondContact O-CB 3.34Å; E126-N130 PolarHBondContact O-N 3.18Å; E126-N130 PolarHBondContact O-ND2 3.21Å; K127-N130 PolarHBondContact O-N 3.42Å
131	K	61.2	Low	72.6	Confident	185 Å²	185	98.1 Å²	98.1	80%	0.804	51%	0.509	S	S	*	.	H	α-helix	trans	-84.7	-35.5	178.9	-169.9	177.9	-179.6	-176.2	0	113.1	K127 E128 R129	K127-K131 WeakPolarHBondContact O-CB 3.38Å; K127-K131 PolarHBondContact O-N 3.32Å; E128-K131 PolarHBondContact O-N 3.31Å; R129-K131 VanDerWaalsContact C-N 3.27Å; R129-K131 PolarHBondContact O-N 3.18Å
132	S	55.1	Low	73.1	Confident	92 Å²	92	92 Å²	92	64%	0.643	48%	0.483	S	S	*	.	H	α-helix	trans	-80.9	-28.4	-174.3	57.7	0	0	0	0	113.7	E128 R129	E128-S132 WeakPolarHBondContact O-CB 3.36Å; E128-S132 PolarHBondContact O-N 3.07Å; E128-S132 PolarHBondContact O-OG 2.82Å; R129-S132 PolarHBondContact O-OG 3.35Å
133	L	57.6	Low	73.6	Confident	138 Å²	138	89 Å²	89	72%	0.723	47%	0.474	S	S	*	.	S	Bend	trans	-97.7	-12.2	-177.6	-62.4	175.9	0	0	0	113.8	R129	R129-L133 HydrophobicContact CG-CD1 4.15Å; R129-L133 PolarHBondContact O-N 2.81Å
134	G	56	Low	74.3	Confident	37 Å²	37	84.9 Å²	84.9	38%	0.381	45%	0.454	S	S	.	.			trans	62.6	152.5	-161.4	0	0	0	0	0	110.4	P136	G134-P136 VanDerWaalsContact O-CD 3.31Å; G134-P136 WeakPolarHBondContact O-CD 3.36Å
135	R	61.4	Low	75	Confident	217 Å²	217	83.5 Å²	83.5	82%	0.819	45%	0.447	S	S	*	.			trans	-65.6	121.5	165.9	-67.3	-173.7	-159	167.2	7.4	106	A137	R135-A137 PolarHBondContact O-N 3.07Å; R135-A137 VanDerWaalsContact O-N 3.15Å
136	P	65.2	Low	75.8	Confident	64 Å²	64	80.4 Å²	80.4	42%	0.416	43%	0.431	S	S	.	.			trans	-57	128.4	173.3	24.4	-30.8	0	0	0	106.8	G134 L138	G134-P136 VanDerWaalsContact O-CD 3.31Å; G134-P136 WeakPolarHBondContact O-CD 3.36Å; P136-L138 HydrophobicContact CB-CD1 4.35Å; P136-L138 HydrophobicContact CB-CG 4.05Å; P136-L138 HydrophobicContact CG-CD1 4.04Å; P136-L138 HydrophobicContact CG-CG 4.22Å; P136-L138 PolarHBondContact O-N 2.92Å
137	A	70.8	Confident	76.8	Confident	80 Å²	80	77.7 Å²	77.7	66%	0.661	42%	0.418	S	S	*	.			trans	-68.2	85.2	173	0	0	0	0	0	107.3	R135	R135-A137 PolarHBondContact O-N 3.07Å; R135-A137 VanDerWaalsContact O-N 3.15Å
138	L	83.5	Confident	77.9	Confident	24 Å²	24	75.6 Å²	75.6	13%	0.126	41%	0.414	C	S	.	.			trans	-107.4	144.7	172.4	-65.2	177.6	0	0	0	107.4	P136 R244 Y267 F275	P136-L138 HydrophobicContact CB-CD1 4.35Å; P136-L138 HydrophobicContact CB-CG 4.05Å; P136-L138 HydrophobicContact CG-CD1 4.04Å; P136-L138 HydrophobicContact CG-CG 4.22Å; P136-L138 PolarHBondContact O-N 2.92Å; L138-R244 HydrophobicContact CD2-CB 3.93Å; L138-R244 HydrophobicContact CD2-CG 3.71Å; L138-Y267 HydrophobicContact CD1-CE1 4.49Å; L138-F275 HydrophobicContact CB-CB 4.17Å; L138-F275 HydrophobicContact CB-CD1 3.98Å; L138-F275 HydrophobicContact CB-CD2 4.01Å; L138-F275 HydrophobicContact CB-CE1 4.44Å; L138-F275 HydrophobicContact CB-CE2 4.46Å; L138-F275 HydrophobicContact CB-CG 3.75Å; L138-F275 HydrophobicContact CD1-CD1 4.25Å; L138-F275 HydrophobicContact CD1-CD2 4.42Å; L138-F275 HydrophobicContact CD1-CE1 3.86Å; L138-F275 HydrophobicContact CD1-CE2 4.05Å; L138-F275 HydrophobicContact CD1-CZ 3.75Å; L138-F275 WeakPolarHBondContact O-CB 3.45Å
139	G	83.7	Confident	79	Confident	24 Å²	24	73.8 Å²	73.8	25%	0.247	41%	0.408	C	S	.	.			trans	96.9	168.5	-174.4	0	0	0	0	0	112.1	A242	G139-A242 PolarHBondContact N-O 3.49Å
140	G	85.8	Confident	80.5	Confident	31 Å²	31	73.9 Å²	73.9	32%	0.32	41%	0.412	S	S	.	.			trans	161.4	165.9	-174.8	0	0	0	0	0	110.5
141	P	89.8	Confident	82.1	Confident	88 Å²	88	74.7 Å²	74.7	57%	0.571	42%	0.422	S	S	*	.			trans	-66.7	138.5	-179.3	28.3	-34.1	0	0	0	110.3	S154	P141-S154 WeakPolarHBondContact CA-OG 3.44Å
142	F	93.4	Very high	83.7	Confident	11 Å²	11	66.3 Å²	66.3	5%	0.048	39%	0.387	C	S	.	.			trans	-128.5	149.5	172.4	64.2	-99.5	0	0	0	110	L144 R153 S154 F157 L229 V239	F142-L144 HydrophobicContact CD2-CB 4.49Å; F142-L144 HydrophobicContact CD2-CD1 3.98Å; F142-L144 HydrophobicContact CD2-CG 4.13Å; F142-L144 HydrophobicContact CG-CD1 4.5Å; F142-R153 WeakPolarHBondContact O-CA 3.23Å; F142-S154 PolarHBondContact N-OG 2.82Å; F142-S154 PolarHBondContact O-N 3Å; F142-S154 PolarHBondContact O-OG 2.74Å; F142-F157 HydrophobicContact CE2-CD2 4.32Å; F142-F157 AromaticContact CE2-CE2 3.9Å; F142-F157 HydrophobicContact CE2-CE2 3.9Å; F142-F157 AromaticContact CZ-CD2 3.84Å; F142-F157 HydrophobicContact CZ-CD2 3.84Å; F142-F157 AromaticContact CZ-CE2 3.78Å; F142-F157 HydrophobicContact CZ-CE2 3.78Å; F142-L229 HydrophobicContact CE2-CD1 3.84Å; F142-L229 HydrophobicContact CZ-CD1 4.38Å; F142-V239 HydrophobicContact CB-CB 4.09Å; F142-V239 HydrophobicContact CB-CG2 3.85Å; F142-V239 HydrophobicContact CD1-CG2 4.41Å; F142-V239 HydrophobicContact CG-CG2 4.33Å
143	S	95.4	Very high	85.6	Confident	42 Å²	42	67.8 Å²	67.8	29%	0.294	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	101.2	173.9	-177.2	0	0	0	0	106.8	Q235	S143-Q235 PolarHBondContact O-NE2 3.11Å
144	L	96.7	Very high	87.3	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	-174.1	-176.2	-66.6	173.8	0	0	0	109.7	F142 S152 I203 L229 T230 Q235 V239	F142-L144 HydrophobicContact CD2-CB 4.49Å; F142-L144 HydrophobicContact CD2-CD1 3.98Å; F142-L144 HydrophobicContact CD2-CG 4.13Å; F142-L144 HydrophobicContact CG-CD1 4.5Å; L144-S152 PolarHBondContact N-O 2.94Å; L144-S152 PolarHBondContact O-N 3.24Å; L144-I203 HydrophobicContact CD1-CD1 4.22Å; L144-I203 HydrophobicContact CD1-CG1 4.38Å; L144-I203 HydrophobicContact CD1-CG2 3.93Å; L144-L229 HydrophobicContact CB-CB 4.21Å; L144-L229 HydrophobicContact CD1-CB 3.86Å; L144-L229 HydrophobicContact CD1-CD1 4Å; L144-T230 WeakPolarHBondContact CB-O 3.48Å; L144-Q235 HydrophobicContact CD2-CB 3.92Å; L144-V239 HydrophobicContact CD1-CG1 4.33Å
145	I	96.8	Very high	89.1	Confident	60 Å²	60	65.1 Å²	65.1	31%	0.308	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133	175.9	-54.9	175.6	0	0	0	106.7	K150 L229 T230	I145-K150 CarbonylContact C-O 3.55Å; I145-K150 WeakPolarHBondContact CA-O 3.35Å; I145-L229 CarbonylContact O-C 3.6Å; I145-L229 WeakPolarHBondContact O-CA 3.39Å; I145-T230 PolarHBondContact N-O 3.11Å; I145-T230 PolarHBondContact O-N 3.27Å
146	D	95.9	Very high	90.7	Very high	21 Å²	21	58.8 Å²	58.8	11%	0.112	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	164.7	173.4	82.8	-3.6	0	0	0	111.7	N148 N149 K150 G228 L229	D146-N148 PolarHBondContact O-N 2.79Å; D146-N148 WeakPolarHBondContact OD1-CA 3.19Å; D146-N148 WeakPolarHBondContact OD1-CB 3.37Å; D146-N148 PolarHBondContact OD1-N 3.3Å; D146-N148 PolarHBondContact OD2-ND2 3.31Å; D146-N149 PolarHBondContact O-N 3.25Å; D146-N149 PolarHBondContact OD1-N 3.49Å; D146-N149 VanDerWaalsContact OD1-N 3.07Å; D146-K150 PolarHBondContact N-O 3.39Å; D146-K150 WeakPolarHBondContact OD1-CA 3.25Å; D146-K150 WeakPolarHBondContact OD1-CB 3.21Å; D146-K150 PolarHBondContact OD1-N 3.21Å; D146-G228 CarbonylContact C-O 3.58Å; D146-G228 WeakPolarHBondContact CA-O 3.27Å; D146-L229 HydrophobicContact CB-CD2 3.91Å
147	H	95.1	Very high	92	Very high	32 Å²	32	56.1 Å²	56.1	15%	0.148	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-8.9	174	63.8	-83.4	0	0	0	114.4	M215 A216 G228	H147-M215 HydrophobicContact CB-CB 4.08Å; H147-A216 HydrophobicContact CB-CB 3.95Å; H147-A216 WeakPolarHBondContact O-CB 3.44Å; H147-G228 PolarHBondContact N-O 3.34Å; H147-G228 PolarHBondContact ND1-N 3.39Å; H147-G228 PolarHBondContact ND1-O 2.99Å
148	N	94.9	Very high	93.1	Very high	93 Å²	93	56.7 Å²	56.7	50%	0.497	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	16.2	172.7	-55.6	-63.7	0	0	0	112.5	D146 K150	D146-N148 PolarHBondContact O-N 2.79Å; D146-N148 WeakPolarHBondContact OD1-CA 3.19Å; D146-N148 WeakPolarHBondContact OD1-CB 3.37Å; D146-N148 PolarHBondContact OD1-N 3.3Å; D146-N148 PolarHBondContact OD2-ND2 3.31Å; N148-K150 HydrophobicContact CB-CG 4.47Å; N148-K150 PolarHBondContact O-N 3.24Å
149	N	94.6	Very high	93.6	Very high	95 Å²	95	58.5 Å²	58.5	51%	0.508	33%	0.334	S	S	.	.	S	Bend	trans	60.9	25.4	-177	-80.2	-63.4	0	0	0	114.4	D146 A212 E213	D146-N149 PolarHBondContact O-N 3.25Å; D146-N149 PolarHBondContact OD1-N 3.49Å; D146-N149 VanDerWaalsContact OD1-N 3.07Å; N149-A212 WeakPolarHBondContact OD1-CB 3.42Å; N149-E213 PolarHBondContact ND2-OE1 2.88Å
150	K	95.4	Very high	94.2	Very high	131 Å²	131	62.4 Å²	62.4	57%	0.57	34%	0.342	S	S	*	.			trans	-98	138	175.1	-60.7	177.7	-178	173.6	0	110.5	I145 D146 N148 S152	I145-K150 CarbonylContact C-O 3.55Å; I145-K150 WeakPolarHBondContact CA-O 3.35Å; D146-K150 PolarHBondContact N-O 3.39Å; D146-K150 WeakPolarHBondContact OD1-CA 3.25Å; D146-K150 WeakPolarHBondContact OD1-CB 3.21Å; D146-K150 PolarHBondContact OD1-N 3.21Å; N148-K150 HydrophobicContact CB-CG 4.47Å; N148-K150 PolarHBondContact O-N 3.24Å; K150-S152 PolarHBondContact O-N 3.04Å
151	P	95.6	Very high	94.7	Very high	101 Å²	101	61.3 Å²	61.3	66%	0.656	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	132.6	170	-22.1	32.9	0	0	0	110.6
152	S	95.8	Very high	95.1	Very high	9 Å²	9	57.5 Å²	57.5	6%	0.063	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	119.7	179	-175.3	0	0	0	0	109.8	L144 K150 F157	L144-S152 PolarHBondContact N-O 2.94Å; L144-S152 PolarHBondContact O-N 3.24Å; K150-S152 PolarHBondContact O-N 3.04Å; S152-F157 WeakPolarHBondContact OG-CE2 3.47Å; S152-F157 VanDerWaalsContact OG-CZ 3.25Å; S152-F157 WeakPolarHBondContact OG-CZ 3.39Å
153	R	95.3	Very high	95.3	Very high	124 Å²	124	57 Å²	57	47%	0.468	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	155.4	-178.6	-57.4	176.5	178.1	-89.8	-4.9	110.7	F142 E155 D156 F157	F142-R153 WeakPolarHBondContact O-CA 3.23Å; R153-E155 VanDerWaalsContact CB-OE2 3.27Å; R153-E155 WeakPolarHBondContact CB-OE2 3.47Å; R153-E155 PolarHBondContact O-N 3.02Å; R153-D156 PolarHBondContact N-OD2 3.01Å; R153-D156 WeakPolarHBondContact O-CB 3.38Å; R153-D156 PolarHBondContact O-N 3.47Å; R153-F157 VanDerWaalsContact O-CD2 3.23Å; R153-F157 WeakPolarHBondContact O-CD2 3.47Å; R153-F157 WeakPolarHBondContact O-CE2 3.19Å
154	S	93	Very high	95.3	Very high	22 Å²	22	55 Å²	55	15%	0.154	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-51.1	-38.4	171.8	30.1	0	0	0	0	112.7	P141 F142 D156 F157	P141-S154 WeakPolarHBondContact CA-OG 3.44Å; F142-S154 PolarHBondContact N-OG 2.82Å; F142-S154 PolarHBondContact O-N 3Å; F142-S154 PolarHBondContact O-OG 2.74Å; S154-D156 PolarHBondContact O-N 3.48Å; S154-F157 PolarHBondContact O-N 3.09Å
155	E	93.9	Very high	95.4	Very high	96 Å²	96	54.9 Å²	54.9	45%	0.449	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-65.8	-28.3	-177.8	-59	75.8	-122.8	0	0	112.7	R153 F157 L158	R153-E155 VanDerWaalsContact CB-OE2 3.27Å; R153-E155 WeakPolarHBondContact CB-OE2 3.47Å; R153-E155 PolarHBondContact O-N 3.02Å; E155-F157 PolarHBondContact O-N 2.58Å; E155-L158 HydrophobicContact CB-CD1 4.32Å; E155-L158 WeakPolarHBondContact O-CB 3.37Å; E155-L158 WeakPolarHBondContact O-CG 3.38Å; E155-L158 PolarHBondContact O-N 3.36Å
156	D	93.9	Very high	95.4	Very high	84 Å²	84	52 Å²	52	45%	0.449	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-65	-25.1	-179.7	-60.3	-36.5	0	0	0	111	R153 S154 R160	R153-D156 PolarHBondContact N-OD2 3.01Å; R153-D156 WeakPolarHBondContact O-CB 3.38Å; R153-D156 PolarHBondContact O-N 3.47Å; S154-D156 PolarHBondContact O-N 3.48Å; D156-R160 PolarHBondContact O-NH2 2.87Å
157	F	93.9	Very high	95.3	Very high	8 Å²	8	51 Å²	51	4%	0.035	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-94.1	1.4	-177.6	-56	-82.7	0	0	0	114.4	F142 S152 R153 S154 E155 R160 I162 I201 I227	F142-F157 HydrophobicContact CE2-CD2 4.32Å; F142-F157 AromaticContact CE2-CE2 3.9Å; F142-F157 HydrophobicContact CE2-CE2 3.9Å; F142-F157 AromaticContact CZ-CD2 3.84Å; F142-F157 HydrophobicContact CZ-CD2 3.84Å; F142-F157 AromaticContact CZ-CE2 3.78Å; F142-F157 HydrophobicContact CZ-CE2 3.78Å; S152-F157 WeakPolarHBondContact OG-CE2 3.47Å; S152-F157 VanDerWaalsContact OG-CZ 3.25Å; S152-F157 WeakPolarHBondContact OG-CZ 3.39Å; R153-F157 VanDerWaalsContact O-CD2 3.23Å; R153-F157 WeakPolarHBondContact O-CD2 3.47Å; R153-F157 WeakPolarHBondContact O-CE2 3.19Å; S154-F157 PolarHBondContact O-N 3.09Å; E155-F157 PolarHBondContact O-N 2.58Å; F157-R160 WeakPolarHBondContact O-CB 3.31Å; F157-R160 PolarHBondContact O-N 2.88Å; F157-R160 VanDerWaalsContact O-N 3.14Å; F157-I162 HydrophobicContact CB-CD1 3.21Å; F157-I162 HydrophobicContact CB-CG1 4.01Å; F157-I162 HydrophobicContact CD1-CD1 4.42Å; F157-I162 HydrophobicContact CG-CD1 3.87Å; F157-I201 HydrophobicContact CD1-CD1 3.87Å; F157-I201 HydrophobicContact CD2-CD1 4.44Å; F157-I201 HydrophobicContact CE1-CD1 3.48Å; F157-I201 VanDerWaalsContact CE1-CD1 3.48Å; F157-I201 HydrophobicContact CE2-CD1 4.09Å; F157-I201 HydrophobicContact CG-CD1 4.34Å; F157-I201 HydrophobicContact CZ-CD1 3.6Å; F157-I227 HydrophobicContact CE1-CD1 4.05Å
158	L	93.8	Very high	95.2	Very high	93 Å²	93	49.6 Å²	49.6	49%	0.487	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	143.1	174.5	-66.6	173.9	0	0	0	111.1	E155 R160	E155-L158 HydrophobicContact CB-CD1 4.32Å; E155-L158 WeakPolarHBondContact O-CB 3.37Å; E155-L158 WeakPolarHBondContact O-CG 3.38Å; E155-L158 PolarHBondContact O-N 3.36Å; L158-R160 VanDerWaalsContact C-N 3.27Å; L158-R160 PolarHBondContact O-N 3.31Å
159	G	94	Very high	95.1	Very high	61 Å²	61	46.2 Å²	46.2	63%	0.629	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.8	-4.7	-174.1	0	0	0	0	0	114.9	P271	G159-P271 WeakPolarHBondContact CA-O 3.47Å; G159-P271 PolarHBondContact N-O 2.94Å
160	R	94.9	Very high	94.8	Very high	106 Å²	106	46.4 Å²	46.4	40%	0.4	24%	0.24	S	C	.	.	S	Bend	trans	-115.5	149.8	179.7	-61.5	-176.9	-85.5	177.4	-4	111.3	D156 F157 L158 P271	D156-R160 PolarHBondContact O-NH2 2.87Å; F157-R160 WeakPolarHBondContact O-CB 3.31Å; F157-R160 PolarHBondContact O-N 2.88Å; F157-R160 VanDerWaalsContact O-N 3.14Å; L158-R160 VanDerWaalsContact C-N 3.27Å; L158-R160 PolarHBondContact O-N 3.31Å; R160-P271 VanDerWaalsContact O-CA 3.32Å; R160-P271 WeakPolarHBondContact O-CA 3.35Å
161	W	96.9	Very high	94.4	Very high	9 Å²	9	40.9 Å²	40.9	3%	0.034	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	134.5	167.5	-73.8	83.4	0	0	0	109.2	P196 L198 T199 L268 P271 V276 H295 M296 Y299	W161-P196 VanDerWaalsContact CD1-CG 3.42Å; W161-P196 HydrophobicContact CG-CG 4.45Å; W161-L198 HydrophobicContact CB-CD1 3.79Å; W161-T199 PolarHBondContact O-N 2.79Å; W161-L268 HydrophobicContact CE3-CD1 3.85Å; W161-L268 HydrophobicContact CE3-CD2 4.28Å; W161-L268 HydrophobicContact CE3-CG 4.07Å; W161-L268 HydrophobicContact CZ3-CD1 4.29Å; W161-L268 HydrophobicContact CZ3-CD2 3.86Å; W161-L268 HydrophobicContact CZ3-CG 4.03Å; W161-P271 HydrophobicContact CZ2-CG 4.49Å; W161-V276 HydrophobicContact CH2-CG2 4.41Å; W161-V276 HydrophobicContact CZ3-CB 4.46Å; W161-V276 HydrophobicContact CZ3-CG1 4.28Å; W161-V276 HydrophobicContact CZ3-CG2 4.02Å; W161-H295 HydrophobicContact CH2-CB 3.99Å; W161-H295 HydrophobicContact CZ3-CB 4.19Å; W161-M296 HydrophobicContact CB-CE 3.55Å; W161-M296 HydrophobicContact CD2-CE 3.85Å; W161-M296 HydrophobicContact CD2-CG 3.78Å; W161-M296 HydrophobicContact CE3-CE 4.39Å; W161-M296 HydrophobicContact CE3-CG 4.26Å; W161-M296 HydrophobicContact CG-CE 3.46Å; W161-M296 VanDerWaalsContact CG-CE 3.46Å; W161-M296 HydrophobicContact CG-CG 4.2Å; W161-M296 HydrophobicContact CH2-CG 4.32Å; W161-M296 HydrophobicContact CZ2-CB 4.32Å; W161-M296 HydrophobicContact CZ2-CG 3.87Å; W161-M296 HydrophobicContact CZ3-CG 4.5Å; W161-Y299 HydrophobicContact CZ2-CD1 4.33Å; W161-Y299 AromaticContact CZ2-CG 3.99Å; W161-Y299 HydrophobicContact CZ2-CG 3.99Å
162	I	97.1	Very high	93.7	Very high	7 Å²	7	40.3 Å²	40.3	4%	0.036	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.4	-175.4	-42	167.1	0	0	0	109	F157 I164 T199 I201 V269	F157-I162 HydrophobicContact CB-CD1 3.21Å; F157-I162 HydrophobicContact CB-CG1 4.01Å; F157-I162 HydrophobicContact CD1-CD1 4.42Å; F157-I162 HydrophobicContact CG-CD1 3.87Å; I162-I164 HydrophobicContact CG2-CD1 4.3Å; I162-I164 HydrophobicContact CG2-CG1 3.67Å; I162-T199 WeakPolarHBondContact CA-O 3.36Å; I162-I201 HydrophobicContact CG2-CB 4.26Å; I162-I201 HydrophobicContact CG2-CD1 3.33Å; I162-I201 HydrophobicContact CG2-CG1 3.6Å; I162-V269 HydrophobicContact CB-CB 4.19Å; I162-V269 HydrophobicContact CD1-CB 4.34Å; I162-V269 HydrophobicContact CD1-CG1 4.32Å; I162-V269 PolarHBondContact N-O 2.9Å; I162-V269 PolarHBondContact O-N 3.49Å
163	L	97.7	Very high	93	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	109.1	169.5	-170.4	59.4	0	0	0	108.3	M182 V185 L198 T199 P200 I201 M266 Y267 F279 I292	L163-M182 HydrophobicContact CD2-CE 4.5Å; L163-M182 HydrophobicContact CD2-CG 3.77Å; L163-M182 HydrophobicContact CG-CE 4.09Å; L163-M182 HydrophobicContact CG-CG 4.24Å; L163-M182 HydrophobicContact CG-SD 4.46Å; L163-V185 HydrophobicContact CD2-CG1 4.04Å; L163-L198 HydrophobicContact CB-CD1 4.13Å; L163-L198 HydrophobicContact CB-CD2 4.15Å; L163-L198 HydrophobicContact CB-CG 4.18Å; L163-L198 HydrophobicContact CD2-CD2 4.04Å; L163-T199 PolarHBondContact N-O 3.25Å; L163-P200 WeakPolarHBondContact O-CA 3.44Å; L163-I201 PolarHBondContact O-N 3.12Å; L163-M266 HydrophobicContact CD1-CB 3.94Å; L163-M266 HydrophobicContact CD2-SD 4.33Å; L163-M266 HydrophobicContact CG-CB 4.43Å; L163-Y267 WeakPolarHBondContact CA-O 3.34Å; L163-F279 HydrophobicContact CD1-CD2 4.27Å; L163-F279 HydrophobicContact CD1-CE2 4.38Å; L163-I292 HydrophobicContact CD1-CD1 4.35Å; L163-I292 HydrophobicContact CD2-CD1 4.18Å
164	I	97.4	Very high	92.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.5	-174.4	-57.4	176.1	0	0	0	109.4	I162 F166 I201 I203 Y243 M266 Y267 V269	I162-I164 HydrophobicContact CG2-CD1 4.3Å; I162-I164 HydrophobicContact CG2-CG1 3.67Å; I164-F166 HydrophobicContact CG2-CD2 4.17Å; I164-F166 HydrophobicContact CG2-CE2 3.71Å; I164-F166 HydrophobicContact CG2-CZ 4.2Å; I164-I201 CarbonylContact C-O 3.57Å; I164-I201 WeakPolarHBondContact CA-O 3.5Å; I164-I201 HydrophobicContact CG1-CB 4.36Å; I164-I203 HydrophobicContact CG2-CD1 3.59Å; I164-I203 HydrophobicContact CG2-CG1 3.95Å; I164-Y243 HydrophobicContact CD1-CE1 4.1Å; I164-Y243 WeakPolarHBondContact CD1-OH 3.11Å; I164-M266 CarbonylContact O-C 3.58Å; I164-M266 WeakPolarHBondContact O-CA 3.44Å; I164-Y267 PolarHBondContact N-O 3.02Å; I164-Y267 PolarHBondContact O-N 2.77Å; I164-V269 HydrophobicContact CD1-CG2 3.73Å; I164-V269 HydrophobicContact CG1-CG2 4.41Å
165	Y	97.3	Very high	92.7	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140	167.6	176.8	-108.1	0	0	0	110.2	C175 E178 I179 M182 I201 L202 I203 H262 I264 M266	Y165-C175 HydrophobicContact CE1-CB 4.24Å; Y165-E178 HydrophobicContact CE1-CB 4.16Å; Y165-E178 HydrophobicContact CE2-CB 3.85Å; Y165-E178 HydrophobicContact CE2-CG 4.13Å; Y165-I179 HydrophobicContact CD1-CG1 4.17Å; Y165-I179 HydrophobicContact CE1-CG1 4.32Å; Y165-M182 HydrophobicContact CG-CE 4.26Å; Y165-I201 PolarHBondContact N-O 2.85Å; Y165-L202 HydrophobicContact CD1-CD1 3.75Å; Y165-L202 HydrophobicContact CE1-CD1 4.39Å; Y165-L202 WeakPolarHBondContact O-CA 3.38Å; Y165-I203 PolarHBondContact O-N 2.89Å; Y165-H262 AromaticContact CZ-CE1 3.94Å; Y165-H262 PolarHBondContact OH-CE1 3.1Å; Y165-I264 HydrophobicContact CE2-CG2 4.32Å; Y165-M266 HydrophobicContact CD2-CG 4.13Å
166	F	96.6	Very high	92.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.2	176.7	-68.7	-98.5	0	0	0	108	I164 I203 I205 V239 Y243 V245 H262 Y267	I164-F166 HydrophobicContact CG2-CD2 4.17Å; I164-F166 HydrophobicContact CG2-CE2 3.71Å; I164-F166 HydrophobicContact CG2-CZ 4.2Å; F166-I203 WeakPolarHBondContact CA-O 3.19Å; F166-I203 HydrophobicContact CD1-CB 3.98Å; F166-I203 HydrophobicContact CD1-CG2 3.98Å; F166-I203 HydrophobicContact CE1-CB 4.06Å; F166-I203 HydrophobicContact CE1-CD1 4.04Å; F166-I203 HydrophobicContact CE1-CG2 3.89Å; F166-I203 HydrophobicContact CZ-CD1 4Å; F166-I205 HydrophobicContact CB-CG2 3.9Å; F166-I205 HydrophobicContact CD1-CG2 4.03Å; F166-I205 HydrophobicContact CG-CG2 4.46Å; F166-V239 HydrophobicContact CE1-CG1 4.21Å; F166-V239 HydrophobicContact CE1-CG2 4.1Å; F166-V239 HydrophobicContact CZ-CG2 4.1Å; F166-Y243 HydrophobicContact CE2-CD1 4.16Å; F166-Y243 HydrophobicContact CE2-CD2 4.33Å; F166-Y243 AromaticContact CE2-CG 3.83Å; F166-Y243 HydrophobicContact CE2-CG 3.83Å; F166-Y243 HydrophobicContact CZ-CD1 4.37Å; F166-Y243 AromaticContact CZ-CD2 3.72Å; F166-Y243 HydrophobicContact CZ-CD2 3.72Å; F166-Y243 HydrophobicContact CZ-CE2 4.48Å; F166-Y243 AromaticContact CZ-CG 3.65Å; F166-Y243 HydrophobicContact CZ-CG 3.65Å; F166-V245 HydrophobicContact CB-CG1 3.97Å; F166-V245 HydrophobicContact CB-CG2 4.29Å; F166-V245 HydrophobicContact CD1-CB 4.46Å; F166-V245 HydrophobicContact CD1-CG1 4.35Å; F166-V245 HydrophobicContact CD1-CG2 3.98Å; F166-V245 HydrophobicContact CD2-CG2 3.48Å; F166-V245 VanDerWaalsContact CD2-CG2 3.48Å; F166-V245 HydrophobicContact CE1-CG2 4.12Å; F166-V245 HydrophobicContact CE2-CG2 3.64Å; F166-V245 HydrophobicContact CG-CB 4.39Å; F166-V245 HydrophobicContact CG-CG1 4.1Å; F166-V245 HydrophobicContact CG-CG2 3.65Å; F166-V245 HydrophobicContact CZ-CG2 3.96Å; F166-H262 PolarHBondContact O-CE1 3.25Å; F166-H262 PolarHBondContact O-ND1 3.4Å; F166-Y267 AromaticContact CD2-CD2 3.91Å; F166-Y267 HydrophobicContact CD2-CD2 3.91Å; F166-Y267 AromaticContact CD2-CE2 3.69Å; F166-Y267 HydrophobicContact CD2-CE2 3.69Å; F166-Y267 AromaticContact CE2-CD2 3.82Å; F166-Y267 HydrophobicContact CE2-CD2 3.82Å; F166-Y267 AromaticContact CE2-CE2 3.84Å; F166-Y267 HydrophobicContact CE2-CE2 3.84Å
167	G	94.6	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	-167.1	-176.8	0	0	0	0	0	110.9	I203 T204 I205	G167-I203 PolarHBondContact N-O 3.21Å; G167-I203 VanDerWaalsContact N-O 3.09Å; G167-T204 CarbonylContact O-C 3.43Å; G167-T204 WeakPolarHBondContact O-CA 3.35Å; G167-I205 VanDerWaalsContact O-CG1 3.29Å; G167-I205 WeakPolarHBondContact O-CG1 3.46Å; G167-I205 PolarHBondContact O-N 3.4Å
168	F	93.7	Very high	92.9	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	22%	0.218	C	C	.	.			trans	-151.8	156	176.7	62.4	-74.8	0	0	0	109.8	H170 C171 I205 D206 D210 V260 H262	F168-H170 VanDerWaalsContact C-N 3.3Å; F168-H170 HydrophobicContact CD2-CB 3.95Å; F168-H170 HydrophobicContact CE2-CB 4.07Å; F168-H170 WeakPolarHBondContact CE2-O 3.17Å; F168-H170 PolarHBondContact O-N 2.88Å; F168-C171 HydrophobicContact CD1-CB 4.18Å; F168-C171 HydrophobicContact CD2-CB 4.31Å; F168-C171 HydrophobicContact CE1-CB 3.7Å; F168-C171 HydrophobicContact CE2-CB 3.87Å; F168-C171 VanDerWaalsContact CE2-N 3.29Å; F168-C171 HydrophobicContact CG-CB 4.46Å; F168-C171 HydrophobicContact CZ-CB 3.53Å; F168-I205 HydrophobicContact CB-CG1 4.35Å; F168-I205 HydrophobicContact CD1-CD1 3.83Å; F168-I205 HydrophobicContact CD1-CG1 4.22Å; F168-I205 HydrophobicContact CE1-CD1 4.5Å; F168-I205 HydrophobicContact CG-CD1 4.48Å; F168-D206 HydrophobicContact CB-CB 3.82Å; F168-D206 HydrophobicContact CG-CB 4.47Å; F168-D210 WeakPolarHBondContact CA-OD2 3.41Å; F168-D210 WeakPolarHBondContact CB-OD2 3.48Å; F168-V260 HydrophobicContact CD1-CB 4.4Å; F168-V260 HydrophobicContact CE1-CB 4.17Å; F168-V260 WeakPolarHBondContact CE1-O 3.21Å; F168-V260 HydrophobicContact CZ-CB 4.34Å; F168-H262 AromaticContact CD1-CD2 3.89Å; F168-H262 AromaticContact CE1-CD2 3.66Å; F168-H262 AromaticContact CE1-NE2 3.89Å
169	T	92.1	Very high	93	Very high	23 Å²	23	34.7 Å²	34.7	14%	0.141	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-22.8	-170.7	66.9	0	0	0	0	113.8	C171 D210 M215 Y218	T169-C171 VanDerWaalsContact C-N 3.35Å; T169-C171 PolarHBondContact O-N 2.9Å; T169-D210 WeakPolarHBondContact CB-OD1 3.44Å; T169-D210 HydrophobicContact CG2-CB 4.42Å; T169-D210 WeakPolarHBondContact CG2-OD1 3.48Å; T169-D210 PolarHBondContact N-OD1 3.03Å; T169-D210 PolarHBondContact N-OD2 3.17Å; T169-D210 PolarHBondContact OG1-OD1 3.27Å; T169-M215 HydrophobicContact CG2-SD 3.55Å; T169-M215 VanDerWaalsContact CG2-SD 3.55Å; T169-Y218 HydrophobicContact CG2-CD1 3.8Å; T169-Y218 HydrophobicContact CG2-CD2 4.35Å; T169-Y218 HydrophobicContact CG2-CE1 4.46Å; T169-Y218 HydrophobicContact CG2-CG 3.72Å
170	H	88.4	Confident	93.1	Very high	98 Å²	98	37.1 Å²	37.1	45%	0.454	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	17.3	-176.7	-66.9	71.3	0	0	0	113.7	F168 D210	F168-H170 VanDerWaalsContact C-N 3.3Å; F168-H170 HydrophobicContact CD2-CB 3.95Å; F168-H170 HydrophobicContact CE2-CB 4.07Å; F168-H170 WeakPolarHBondContact CE2-O 3.17Å; F168-H170 PolarHBondContact O-N 2.88Å; H170-D210 IonicContact ND1-OD1 2.64Å
171	C	86.6	Confident	93.2	Very high	16 Å²	16	33.3 Å²	33.3	11%	0.108	18%	0.176	C	C	.	.			trans	-79	124.3	178.6	-172.3	0	0	0	0	110.2	F168 T169 D173 C175	F168-C171 HydrophobicContact CD1-CB 4.18Å; F168-C171 HydrophobicContact CD2-CB 4.31Å; F168-C171 HydrophobicContact CE1-CB 3.7Å; F168-C171 HydrophobicContact CE2-CB 3.87Å; F168-C171 VanDerWaalsContact CE2-N 3.29Å; F168-C171 HydrophobicContact CG-CB 4.46Å; F168-C171 HydrophobicContact CZ-CB 3.53Å; T169-C171 VanDerWaalsContact C-N 3.35Å; T169-C171 PolarHBondContact O-N 2.9Å; C171-D173 PolarHBondContact O-N 3.33Å; C171-C175 HydrophobicContact CB-CB 3.59Å; C171-C175 WeakPolarHBondContact CB-SG 3.41Å; C171-C175 PolarHBondContact SG-N 3.05Å; C171-C175 VanDerWaalsContact SG-N 3.44Å
172	P	80.9	Confident	93.2	Very high	89 Å²	89	32.9 Å²	32.9	58%	0.578	18%	0.175	S	C	*	.	S	Bend	trans	-69	-34.7	-171.2	24.7	-33.7	0	0	0	113.9
173	D	81.3	Confident	93.3	Very high	115 Å²	115	33.3 Å²	33.3	62%	0.615	18%	0.177	S	C	*	.	S	Bend	trans	-135.6	-51.7	-169.7	-54.3	-52.1	0	0	0	113.6	C171 P176	C171-D173 PolarHBondContact O-N 3.33Å; D173-P176 WeakPolarHBondContact O-CD 3.06Å
174	I	90.2	Very high	93.2	Very high	64 Å²	64	38 Å²	38	33%	0.328	20%	0.199	S	C	.	.	H	α-helix	trans	-74.4	-42.2	-164.4	-61.8	178.2	0	0	0	113.3	E178 I264	I174-E178 HydrophobicContact CG2-CG 4.34Å; I174-E178 WeakPolarHBondContact O-CG 3.47Å; I174-E178 PolarHBondContact O-N 3.31Å; I174-E178 VanDerWaalsContact O-N 3.13Å; I174-I264 HydrophobicContact CD1-CD1 3.86Å; I174-I264 HydrophobicContact CG2-CD1 3.62Å; I174-I264 HydrophobicContact CG2-CG1 3.85Å; I174-I264 HydrophobicContact CG2-CG2 3.84Å
175	C	91.4	Very high	93.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.7	-45.9	-178.4	-66.4	0	0	0	0	113.1	Y165 C171 D177 E178 I179 H262	Y165-C175 HydrophobicContact CE1-CB 4.24Å; C171-C175 HydrophobicContact CB-CB 3.59Å; C171-C175 WeakPolarHBondContact CB-SG 3.41Å; C171-C175 PolarHBondContact SG-N 3.05Å; C171-C175 VanDerWaalsContact SG-N 3.44Å; C175-D177 VanDerWaalsContact C-N 3.34Å; C175-D177 PolarHBondContact O-N 3.39Å; C175-E178 PolarHBondContact O-N 3.2Å; C175-I179 HydrophobicContact CB-CD1 4.48Å; C175-I179 WeakPolarHBondContact O-CD1 3.39Å; C175-I179 VanDerWaalsContact O-CG1 3.22Å; C175-I179 WeakPolarHBondContact O-CG1 3.38Å; C175-I179 PolarHBondContact O-N 3.46Å; C175-H262 PolarHBondContact SG-NE2 3.17Å
176	P	94.1	Very high	93.3	Very high	29 Å²	29	38 Å²	38	19%	0.188	20%	0.199	C	C	.	.	H	α-helix	trans	-52.9	-49.8	174.5	-27.3	34.2	0	0	0	112.8	D173 E178 I179 E180 F222	D173-P176 WeakPolarHBondContact O-CD 3.06Å; P176-E178 PolarHBondContact O-N 2.93Å; P176-I179 PolarHBondContact O-N 2.68Å; P176-E180 WeakPolarHBondContact O-CG 3.44Å; P176-E180 PolarHBondContact O-N 3.27Å; P176-F222 HydrophobicContact CB-CE1 4.25Å; P176-F222 HydrophobicContact CB-CZ 4.17Å
177	D	94.9	Very high	93.3	Very high	100 Å²	100	41 Å²	41	54%	0.535	22%	0.215	S	C	.	.	H	α-helix	trans	-58.5	-43.8	179.9	-76.1	-2.4	0	0	0	112.5	C175 K181	C175-D177 VanDerWaalsContact C-N 3.34Å; C175-D177 PolarHBondContact O-N 3.39Å; D177-K181 WeakPolarHBondContact O-CB 3.35Å; D177-K181 PolarHBondContact O-N 2.99Å
178	E	96.1	Very high	93.3	Very high	9 Å²	9	43.3 Å²	43.3	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-71.3	-35.5	179.3	-68.1	-63.6	120.4	0	0	112.3	Y165 I174 C175 P176 K181 M182 I264 M266 Q281	Y165-E178 HydrophobicContact CE1-CB 4.16Å; Y165-E178 HydrophobicContact CE2-CB 3.85Å; Y165-E178 HydrophobicContact CE2-CG 4.13Å; I174-E178 HydrophobicContact CG2-CG 4.34Å; I174-E178 WeakPolarHBondContact O-CG 3.47Å; I174-E178 PolarHBondContact O-N 3.31Å; I174-E178 VanDerWaalsContact O-N 3.13Å; C175-E178 PolarHBondContact O-N 3.2Å; P176-E178 PolarHBondContact O-N 2.93Å; E178-K181 PolarHBondContact O-N 2.78Å; E178-K181 WeakPolarHBondContact OE1-CE 3.39Å; E178-K181 IonicContact OE1-NZ 2.87Å; E178-K181 PolarHBondContact OE1-NZ 3.49Å; E178-K181 WeakPolarHBondContact OE2-CE 3.5Å; E178-K181 IonicContact OE2-NZ 3.08Å; E178-K181 PolarHBondContact OE2-NZ 2.82Å; E178-M182 WeakPolarHBondContact O-CB 3.3Å; E178-M182 PolarHBondContact O-N 3.14Å; E178-I264 HydrophobicContact CG-CG2 3.61Å; E178-M266 HydrophobicContact CB-CE 4.09Å; E178-M266 WeakPolarHBondContact O-CE 3.35Å; E178-Q281 WeakPolarHBondContact OE1-CG 2.89Å
179	I	96.3	Very high	93.5	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-68.1	-44.6	176.5	-66.2	163.8	0	0	0	110	Y165 C175 P176 K181 M182 I183 L202 Y218 F222 L226	Y165-I179 HydrophobicContact CD1-CG1 4.17Å; Y165-I179 HydrophobicContact CE1-CG1 4.32Å; C175-I179 HydrophobicContact CB-CD1 4.48Å; C175-I179 WeakPolarHBondContact O-CD1 3.39Å; C175-I179 VanDerWaalsContact O-CG1 3.22Å; C175-I179 WeakPolarHBondContact O-CG1 3.38Å; C175-I179 PolarHBondContact O-N 3.46Å; P176-I179 PolarHBondContact O-N 2.68Å; I179-K181 VanDerWaalsContact C-N 3.32Å; I179-K181 PolarHBondContact O-N 2.73Å; I179-M182 WeakPolarHBondContact O-CA 3.44Å; I179-M182 VanDerWaalsContact O-CB 3.31Å; I179-M182 WeakPolarHBondContact O-CB 3.44Å; I179-M182 PolarHBondContact O-N 3.38Å; I179-I183 HydrophobicContact CG2-CG1 4.47Å; I179-I183 WeakPolarHBondContact O-CG1 3.49Å; I179-I183 PolarHBondContact O-N 3.45Å; I179-L202 HydrophobicContact CD1-CD1 4.08Å; I179-L202 HydrophobicContact CD1-CD2 3.95Å; I179-L202 HydrophobicContact CG1-CD1 4.45Å; I179-Y218 HydrophobicContact CD1-CE1 3.55Å; I179-F222 HydrophobicContact CB-CD1 4.12Å; I179-F222 HydrophobicContact CB-CE1 4.15Å; I179-F222 HydrophobicContact CB-CG 4.44Å; I179-F222 HydrophobicContact CD1-CE2 4.37Å; I179-F222 HydrophobicContact CD1-CZ 4.41Å; I179-F222 HydrophobicContact CG2-CB 3.86Å; I179-F222 HydrophobicContact CG2-CD1 3.58Å; I179-F222 HydrophobicContact CG2-CD2 3.92Å; I179-F222 HydrophobicContact CG2-CE1 4.07Å; I179-F222 HydrophobicContact CG2-CE2 4.4Å; I179-F222 HydrophobicContact CG2-CG 3.5Å; I179-F222 VanDerWaalsContact CG2-CG 3.5Å; I179-F222 HydrophobicContact CG2-CZ 4.46Å; I179-L226 HydrophobicContact CG2-CD2 3.62Å
180	E	96.4	Very high	93.6	Very high	112 Å²	112	44.5 Å²	44.5	52%	0.523	23%	0.232	S	C	.	.	H	α-helix	trans	-56.4	-48.2	174.3	-73.7	-176.5	178.9	0	0	111.2	P176 M182 I183 E184 F222	P176-E180 WeakPolarHBondContact O-CG 3.44Å; P176-E180 PolarHBondContact O-N 3.27Å; E180-M182 VanDerWaalsContact C-N 3.28Å; E180-M182 PolarHBondContact O-N 3.32Å; E180-I183 PolarHBondContact O-N 2.9Å; E180-I183 VanDerWaalsContact O-N 3.09Å; E180-E184 PolarHBondContact O-N 3.43Å; E180-F222 HydrophobicContact CG-CD1 3.95Å; E180-F222 HydrophobicContact CG-CE1 4.02Å
181	K	97.1	Very high	94	Very high	25 Å²	25	48.4 Å²	48.4	11%	0.109	24%	0.242	C	C	.	.	H	α-helix	trans	-58.7	-38.4	174.8	-174.1	175.4	68	-170.1	0	112.4	D177 E178 I179 E184 V185 M266 Q281 K283 I288	D177-K181 WeakPolarHBondContact O-CB 3.35Å; D177-K181 PolarHBondContact O-N 2.99Å; E178-K181 PolarHBondContact O-N 2.78Å; E178-K181 WeakPolarHBondContact OE1-CE 3.39Å; E178-K181 IonicContact OE1-NZ 2.87Å; E178-K181 PolarHBondContact OE1-NZ 3.49Å; E178-K181 WeakPolarHBondContact OE2-CE 3.5Å; E178-K181 IonicContact OE2-NZ 3.08Å; E178-K181 PolarHBondContact OE2-NZ 2.82Å; I179-K181 VanDerWaalsContact C-N 3.32Å; I179-K181 PolarHBondContact O-N 2.73Å; K181-E184 PolarHBondContact O-N 3.4Å; K181-V185 VanDerWaalsContact O-CG2 3.3Å; K181-V185 WeakPolarHBondContact O-CG2 3.31Å; K181-V185 PolarHBondContact O-N 2.94Å; K181-V185 VanDerWaalsContact O-N 3.13Å; K181-M266 HydrophobicContact CB-CE 4.35Å; K181-Q281 PolarHBondContact NZ-O 3.42Å; K181-K283 WeakPolarHBondContact CD-O 3.49Å; K181-K283 PolarHBondContact NZ-O 3.29Å; K181-I288 HydrophobicContact CD-CD1 4.33Å
182	M	97.7	Very high	94.4	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-63	-44.2	174.7	178.7	-177.2	-65.4	0	0	111.5	L163 Y165 E178 I179 E180 V185 V186 P200 L226 M266	L163-M182 HydrophobicContact CD2-CE 4.5Å; L163-M182 HydrophobicContact CD2-CG 3.77Å; L163-M182 HydrophobicContact CG-CE 4.09Å; L163-M182 HydrophobicContact CG-CG 4.24Å; L163-M182 HydrophobicContact CG-SD 4.46Å; Y165-M182 HydrophobicContact CG-CE 4.26Å; E178-M182 WeakPolarHBondContact O-CB 3.3Å; E178-M182 PolarHBondContact O-N 3.14Å; I179-M182 WeakPolarHBondContact O-CA 3.44Å; I179-M182 VanDerWaalsContact O-CB 3.31Å; I179-M182 WeakPolarHBondContact O-CB 3.44Å; I179-M182 PolarHBondContact O-N 3.38Å; E180-M182 VanDerWaalsContact C-N 3.28Å; E180-M182 PolarHBondContact O-N 3.32Å; M182-V185 WeakPolarHBondContact O-CB 3.2Å; M182-V185 PolarHBondContact O-N 2.81Å; M182-V186 WeakPolarHBondContact O-CG2 3.26Å; M182-V186 PolarHBondContact O-N 3.44Å; M182-P200 HydrophobicContact CG-CB 3.97Å; M182-P200 HydrophobicContact SD-CB 3.47Å; M182-P200 WeakPolarHBondContact SD-CB 3.42Å; M182-L226 HydrophobicContact SD-CD1 4.46Å; M182-M266 HydrophobicContact CB-CE 3.89Å; M182-M266 HydrophobicContact CB-SD 4.21Å; M182-M266 HydrophobicContact CE-CG 4.11Å; M182-M266 HydrophobicContact CE-SD 4.26Å
183	I	97.7	Very high	94.9	Very high	16 Å²	16	56 Å²	56	8%	0.082	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-41.3	179.1	-60.5	-45.6	0	0	0	110.7	I179 E180 V185 V186 D187 P200 F222 L226	I179-I183 HydrophobicContact CG2-CG1 4.47Å; I179-I183 WeakPolarHBondContact O-CG1 3.49Å; I179-I183 PolarHBondContact O-N 3.45Å; E180-I183 PolarHBondContact O-N 2.9Å; E180-I183 VanDerWaalsContact O-N 3.09Å; I183-V185 VanDerWaalsContact C-N 3.29Å; I183-V185 PolarHBondContact O-N 2.83Å; I183-V186 PolarHBondContact O-N 2.8Å; I183-V186 VanDerWaalsContact O-N 3.16Å; I183-D187 PolarHBondContact O-N 2.84Å; I183-P200 HydrophobicContact CD1-CB 4.26Å; I183-P200 HydrophobicContact CD1-CG 4.13Å; I183-F222 HydrophobicContact CG1-CB 4.37Å; I183-L226 HydrophobicContact CD1-CB 4.27Å; I183-L226 HydrophobicContact CD1-CD1 4.44Å
184	E	97.4	Very high	95.5	Very high	97 Å²	97	54.2 Å²	54.2	45%	0.453	26%	0.263	S	S	.	.	H	α-helix	trans	-55.6	-45.2	173.1	-70.9	-175.2	171.3	0	0	112	E180 K181 V186 D187 E188 S285	E180-E184 PolarHBondContact O-N 3.43Å; K181-E184 PolarHBondContact O-N 3.4Å; E184-V186 PolarHBondContact O-N 3.46Å; E184-D187 PolarHBondContact O-N 2.79Å; E184-E188 WeakPolarHBondContact O-CB 3.22Å; E184-E188 WeakPolarHBondContact O-CG 3.47Å; E184-E188 PolarHBondContact O-N 3.5Å; E184-S285 VanDerWaalsContact OE2-CB 3.27Å; E184-S285 WeakPolarHBondContact OE2-CB 3.48Å; E184-S285 PolarHBondContact OE2-OG 3.38Å
185	V	97.8	Very high	95.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-45.8	177.4	168.6	0	0	0	0	111.1	L163 K181 M182 I183 D187 E188 I189 L198 I288 I292	L163-V185 HydrophobicContact CD2-CG1 4.04Å; K181-V185 VanDerWaalsContact O-CG2 3.3Å; K181-V185 WeakPolarHBondContact O-CG2 3.31Å; K181-V185 PolarHBondContact O-N 2.94Å; K181-V185 VanDerWaalsContact O-N 3.13Å; M182-V185 WeakPolarHBondContact O-CB 3.2Å; M182-V185 PolarHBondContact O-N 2.81Å; I183-V185 VanDerWaalsContact C-N 3.29Å; I183-V185 PolarHBondContact O-N 2.83Å; V185-D187 VanDerWaalsContact C-N 3.35Å; V185-D187 PolarHBondContact O-N 3.47Å; V185-E188 PolarHBondContact O-N 2.89Å; V185-I189 WeakPolarHBondContact O-CG1 3.45Å; V185-I189 PolarHBondContact O-N 3.04Å; V185-L198 HydrophobicContact CG1-CD2 4.06Å; V185-I288 HydrophobicContact CB-CG2 4.45Å; V185-I288 HydrophobicContact CG1-CG2 3.81Å; V185-I288 HydrophobicContact CG2-CB 3.78Å; V185-I288 HydrophobicContact CG2-CD1 4.37Å; V185-I288 HydrophobicContact CG2-CG2 3.79Å; V185-I292 HydrophobicContact CG1-CD1 3.65Å
186	V	97.4	Very high	95.9	Very high	1 Å²	1	54 Å²	54	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-45.9	178.1	171.7	0	0	0	0	110.6	M182 I183 E184 E188 I189 D190 L198 P200 K225	M182-V186 WeakPolarHBondContact O-CG2 3.26Å; M182-V186 PolarHBondContact O-N 3.44Å; I183-V186 PolarHBondContact O-N 2.8Å; I183-V186 VanDerWaalsContact O-N 3.16Å; E184-V186 PolarHBondContact O-N 3.46Å; V186-E188 PolarHBondContact O-N 2.88Å; V186-I189 PolarHBondContact O-N 2.89Å; V186-D190 WeakPolarHBondContact O-CB 3.46Å; V186-D190 PolarHBondContact O-N 3.07Å; V186-L198 HydrophobicContact CG2-CB 4.36Å; V186-L198 HydrophobicContact CG2-CD2 3.87Å; V186-L198 HydrophobicContact CG2-CG 4.11Å; V186-P200 HydrophobicContact CG1-CG 4.48Å; V186-P200 HydrophobicContact CG2-CB 3.88Å; V186-P200 HydrophobicContact CG2-CG 3.86Å; V186-K225 HydrophobicContact CG1-CD 4.06Å
187	D	96.5	Very high	95.8	Very high	63 Å²	63	58.3 Å²	58.3	34%	0.337	29%	0.286	S	S	.	.	H	α-helix	trans	-71	-29.9	-179.8	-72.3	-22.4	0	0	0	112.9	I183 E184 V185 R191 K225	I183-D187 PolarHBondContact O-N 2.84Å; E184-D187 PolarHBondContact O-N 2.79Å; V185-D187 VanDerWaalsContact C-N 3.35Å; V185-D187 PolarHBondContact O-N 3.47Å; D187-R191 VanDerWaalsContact O-CG 3.27Å; D187-R191 WeakPolarHBondContact O-CG 3.47Å; D187-R191 PolarHBondContact O-N 3.48Å; D187-R191 PolarHBondContact O-NE 3.48Å; D187-K225 IonicContact OD1-NZ 3.79Å; D187-K225 PolarHBondContact OD1-NZ 3.17Å
188	E	96.1	Very high	95.9	Very high	50 Å²	50	53.8 Å²	53.8	23%	0.234	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-43.7	167.9	-77.5	-176.1	177.8	0	0	112.6	E184 V185 V186 S289	E184-E188 WeakPolarHBondContact O-CB 3.22Å; E184-E188 WeakPolarHBondContact O-CG 3.47Å; E184-E188 PolarHBondContact O-N 3.5Å; V185-E188 PolarHBondContact O-N 2.89Å; V186-E188 PolarHBondContact O-N 2.88Å; E188-S289 WeakPolarHBondContact OE2-CB 3.15Å; E188-S289 PolarHBondContact OE2-OG 2.96Å
189	I	96.9	Very high	96	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-67.4	-45.3	177.4	-67.2	-63.1	0	0	0	111.2	V185 V186 R191 I192 L195 L198 S289 I292 A293 M296	V185-I189 WeakPolarHBondContact O-CG1 3.45Å; V185-I189 PolarHBondContact O-N 3.04Å; V186-I189 PolarHBondContact O-N 2.89Å; I189-R191 PolarHBondContact O-N 2.92Å; I189-I192 WeakPolarHBondContact O-CA 3.33Å; I189-I192 WeakPolarHBondContact O-CB 3.37Å; I189-I192 PolarHBondContact O-N 2.86Å; I189-L195 HydrophobicContact CD1-CD1 4.12Å; I189-L195 HydrophobicContact CG2-CB 4.42Å; I189-L195 HydrophobicContact CG2-CD1 4.46Å; I189-L198 HydrophobicContact CG1-CD2 4.33Å; I189-L198 HydrophobicContact CG2-CB 4.22Å; I189-S289 WeakPolarHBondContact CD1-O 3.45Å; I189-I292 HydrophobicContact CD1-CB 4.2Å; I189-I292 HydrophobicContact CD1-CG2 3.97Å; I189-I292 HydrophobicContact CG1-CG2 4.21Å; I189-A293 HydrophobicContact CD1-CB 4.01Å; I189-M296 HydrophobicContact CG2-CE 4.06Å; I189-M296 HydrophobicContact CG2-SD 4Å
190	D	94.6	Very high	96.1	Very high	48 Å²	48	54.3 Å²	54.3	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-64.3	-26	-178.8	-76.9	-6.7	0	0	0	112.7	V186 I192 K225	V186-D190 WeakPolarHBondContact O-CB 3.46Å; V186-D190 PolarHBondContact O-N 3.07Å; D190-I192 PolarHBondContact O-N 3.43Å; D190-K225 WeakPolarHBondContact OD2-CE 3.38Å; D190-K225 IonicContact OD2-NZ 2.65Å; D190-K225 PolarHBondContact OD2-NZ 3.24Å
191	R	95.7	Very high	96.1	Very high	180 Å²	180	49 Å²	49	68%	0.679	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.6	171.1	-80.3	179.2	-77.9	-158.1	2.1	112.7	D187 I189 K193	D187-R191 VanDerWaalsContact O-CG 3.27Å; D187-R191 WeakPolarHBondContact O-CG 3.47Å; D187-R191 PolarHBondContact O-N 3.48Å; D187-R191 PolarHBondContact O-NE 3.48Å; I189-R191 PolarHBondContact O-N 2.92Å; R191-K193 PolarHBondContact O-N 3.2Å
192	I	95.5	Very high	96.2	Very high	57 Å²	57	47.9 Å²	47.9	29%	0.292	24%	0.236	S	C	.	.			trans	-91.7	90.3	-179.5	-51.9	169.4	0	0	0	109.5	I189 D190 S194 L195	I189-I192 WeakPolarHBondContact O-CA 3.33Å; I189-I192 WeakPolarHBondContact O-CB 3.37Å; I189-I192 PolarHBondContact O-N 2.86Å; D190-I192 PolarHBondContact O-N 3.43Å; I192-S194 PolarHBondContact O-N 3.19Å; I192-L195 HydrophobicContact CB-CB 4.5Å; I192-L195 HydrophobicContact CB-CD1 3.91Å; I192-L195 HydrophobicContact CB-CG 4.11Å; I192-L195 HydrophobicContact CD1-CD1 3.79Å; I192-L195 HydrophobicContact CG1-CD1 4.46Å; I192-L195 HydrophobicContact CG2-CB 4.45Å; I192-L195 HydrophobicContact CG2-CD1 3.81Å; I192-L195 HydrophobicContact CG2-CG 3.7Å; I192-L195 PolarHBondContact O-N 3.32Å
193	K	92.7	Very high	96.1	Very high	206 Å²	206	47.9 Å²	47.9	90%	0.896	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-17.4	-175.8	-61.9	-168.4	177.9	-173.5	0	116.7	R191	R191-K193 PolarHBondContact O-N 3.2Å
194	S	93.9	Very high	96.1	Very high	79 Å²	79	47.1 Å²	47.1	55%	0.552	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-10.8	177.9	55.3	0	0	0	0	113.7	I192 Q300	I192-S194 PolarHBondContact O-N 3.19Å; S194-Q300 PolarHBondContact O-NE2 2.97Å; S194-Q300 VanDerWaalsContact O-NE2 3.1Å
195	L	94.6	Very high	96	Very high	13 Å²	13	42.5 Å²	42.5	7%	0.068	21%	0.211	C	C	.	.	S	Bend	trans	-98.5	150.1	179.2	-60.9	-177.8	0	0	0	110.7	I189 I192 A293 M296 R297	I189-L195 HydrophobicContact CD1-CD1 4.12Å; I189-L195 HydrophobicContact CG2-CB 4.42Å; I189-L195 HydrophobicContact CG2-CD1 4.46Å; I192-L195 HydrophobicContact CB-CB 4.5Å; I192-L195 HydrophobicContact CB-CD1 3.91Å; I192-L195 HydrophobicContact CB-CG 4.11Å; I192-L195 HydrophobicContact CD1-CD1 3.79Å; I192-L195 HydrophobicContact CG1-CD1 4.46Å; I192-L195 HydrophobicContact CG2-CB 4.45Å; I192-L195 HydrophobicContact CG2-CD1 3.81Å; I192-L195 HydrophobicContact CG2-CG 3.7Å; I192-L195 PolarHBondContact O-N 3.32Å; L195-A293 HydrophobicContact CD1-CB 3.59Å; L195-M296 HydrophobicContact CB-SD 4.06Å; L195-M296 HydrophobicContact CD1-SD 4.21Å; L195-M296 HydrophobicContact CD2-CB 3.94Å; L195-M296 HydrophobicContact CG-SD 4.5Å; L195-R297 HydrophobicContact CD2-CG 3.84Å
196	P	94	Very high	95.8	Very high	45 Å²	45	42.5 Å²	42.5	29%	0.292	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-68.8	157.9	169.4	31.6	-35	0	0	0	111	W161 M296	W161-P196 VanDerWaalsContact CD1-CG 3.42Å; W161-P196 HydrophobicContact CG-CG 4.45Å; P196-M296 HydrophobicContact CG-CE 4.3Å; P196-M296 HydrophobicContact CG-CG 4.27Å; P196-M296 HydrophobicContact CG-SD 4.1Å
197	N	92.8	Very high	95.6	Very high	120 Å²	120	43.6 Å²	43.6	64%	0.642	22%	0.218	S	C	*	.	P	Polyproline II helix	trans	-63.5	146.7	176.8	-59.7	-8.9	0	0	0	111.4
198	L	97.3	Very high	95.3	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.5	173.7	-173.8	65	0	0	0	109.7	W161 L163 V185 V186 I189 P200 L268 I292 M296	W161-L198 HydrophobicContact CB-CD1 3.79Å; L163-L198 HydrophobicContact CB-CD1 4.13Å; L163-L198 HydrophobicContact CB-CD2 4.15Å; L163-L198 HydrophobicContact CB-CG 4.18Å; L163-L198 HydrophobicContact CD2-CD2 4.04Å; V185-L198 HydrophobicContact CG1-CD2 4.06Å; V186-L198 HydrophobicContact CG2-CB 4.36Å; V186-L198 HydrophobicContact CG2-CD2 3.87Å; V186-L198 HydrophobicContact CG2-CG 4.11Å; I189-L198 HydrophobicContact CG1-CD2 4.33Å; I189-L198 HydrophobicContact CG2-CB 4.22Å; L198-P200 WeakPolarHBondContact O-CD 3.37Å; L198-L268 HydrophobicContact CD1-CD1 4.12Å; L198-I292 HydrophobicContact CD1-CG2 4.5Å; L198-I292 HydrophobicContact CD2-CD1 3.87Å; L198-I292 HydrophobicContact CD2-CG2 4.44Å; L198-M296 HydrophobicContact CB-CE 4.29Å; L198-M296 HydrophobicContact CD1-CE 4.06Å
199	T	97.5	Very high	95.1	Very high	20 Å²	20	45.4 Å²	45.4	12%	0.123	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	111.8	179	-53.2	0	0	0	0	110	W161 I162 L163 I201 I227	W161-T199 PolarHBondContact O-N 2.79Å; I162-T199 WeakPolarHBondContact CA-O 3.36Å; L163-T199 PolarHBondContact N-O 3.25Å; T199-I201 HydrophobicContact CG2-CG1 4.3Å; T199-I227 HydrophobicContact CG2-CD1 3.7Å
200	P	97.9	Very high	95	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	131.8	174.1	28.9	-30.2	0	0	0	111.4	L163 M182 I183 V186 L198 K225 L226 I227	L163-P200 WeakPolarHBondContact O-CA 3.44Å; M182-P200 HydrophobicContact CG-CB 3.97Å; M182-P200 HydrophobicContact SD-CB 3.47Å; M182-P200 WeakPolarHBondContact SD-CB 3.42Å; I183-P200 HydrophobicContact CD1-CB 4.26Å; I183-P200 HydrophobicContact CD1-CG 4.13Å; V186-P200 HydrophobicContact CG1-CG 4.48Å; V186-P200 HydrophobicContact CG2-CB 3.88Å; V186-P200 HydrophobicContact CG2-CG 3.86Å; L198-P200 WeakPolarHBondContact O-CD 3.37Å; P200-K225 HydrophobicContact CG-CB 4.24Å; P200-L226 HydrophobicContact CB-CD1 3.87Å; P200-L226 HydrophobicContact CG-CD1 4.35Å; P200-I227 PolarHBondContact O-N 3.39Å
201	I	97.8	Very high	95	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.7	178.2	-58.9	-171.1	0	0	0	109.9	F157 I162 L163 I164 Y165 T199 I203 I227 L229	F157-I201 HydrophobicContact CD1-CD1 3.87Å; F157-I201 HydrophobicContact CD2-CD1 4.44Å; F157-I201 HydrophobicContact CE1-CD1 3.48Å; F157-I201 VanDerWaalsContact CE1-CD1 3.48Å; F157-I201 HydrophobicContact CE2-CD1 4.09Å; F157-I201 HydrophobicContact CG-CD1 4.34Å; F157-I201 HydrophobicContact CZ-CD1 3.6Å; I162-I201 HydrophobicContact CG2-CB 4.26Å; I162-I201 HydrophobicContact CG2-CD1 3.33Å; I162-I201 HydrophobicContact CG2-CG1 3.6Å; L163-I201 PolarHBondContact O-N 3.12Å; I164-I201 CarbonylContact C-O 3.57Å; I164-I201 WeakPolarHBondContact CA-O 3.5Å; I164-I201 HydrophobicContact CG1-CB 4.36Å; Y165-I201 PolarHBondContact N-O 2.85Å; T199-I201 HydrophobicContact CG2-CG1 4.3Å; I201-I203 HydrophobicContact CG2-CG1 3.93Å; I201-I227 CarbonylContact C-O 3.56Å; I201-I227 WeakPolarHBondContact CA-O 3.47Å; I201-I227 HydrophobicContact CG1-CB 4.35Å; I201-L229 HydrophobicContact CG2-CD1 3.56Å; I201-L229 HydrophobicContact CG2-CG 3.8Å
202	L	97.7	Very high	94.9	Very high	2 Å²	2	38 Å²	38	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.4	168	175.7	67.2	0	0	0	108.8	Y165 I179 M215 Y218 V219 L226 I227 G228 L229	Y165-L202 HydrophobicContact CD1-CD1 3.75Å; Y165-L202 HydrophobicContact CE1-CD1 4.39Å; Y165-L202 WeakPolarHBondContact O-CA 3.38Å; I179-L202 HydrophobicContact CD1-CD1 4.08Å; I179-L202 HydrophobicContact CD1-CD2 3.95Å; I179-L202 HydrophobicContact CG1-CD1 4.45Å; L202-M215 HydrophobicContact CB-CE 4.46Å; L202-M215 HydrophobicContact CD2-CE 3.72Å; L202-M215 HydrophobicContact CG-CE 3.92Å; L202-Y218 HydrophobicContact CD2-CD1 3.86Å; L202-Y218 HydrophobicContact CD2-CE1 3.9Å; L202-V219 HydrophobicContact CD2-CG1 4.26Å; L202-L226 HydrophobicContact CB-CD1 4.23Å; L202-I227 PolarHBondContact N-O 3.22Å; L202-G228 CarbonylContact O-C 3.5Å; L202-G228 WeakPolarHBondContact O-CA 3.37Å; L202-L229 PolarHBondContact O-N 3.46Å
203	I	97.3	Very high	94.9	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.9	172.4	-58.5	-177.6	0	0	0	108.2	L144 I164 Y165 F166 G167 I201 L229 V239	L144-I203 HydrophobicContact CD1-CD1 4.22Å; L144-I203 HydrophobicContact CD1-CG1 4.38Å; L144-I203 HydrophobicContact CD1-CG2 3.93Å; I164-I203 HydrophobicContact CG2-CD1 3.59Å; I164-I203 HydrophobicContact CG2-CG1 3.95Å; Y165-I203 PolarHBondContact O-N 2.89Å; F166-I203 WeakPolarHBondContact CA-O 3.19Å; F166-I203 HydrophobicContact CD1-CB 3.98Å; F166-I203 HydrophobicContact CD1-CG2 3.98Å; F166-I203 HydrophobicContact CE1-CB 4.06Å; F166-I203 HydrophobicContact CE1-CD1 4.04Å; F166-I203 HydrophobicContact CE1-CG2 3.89Å; F166-I203 HydrophobicContact CZ-CD1 4Å; G167-I203 PolarHBondContact N-O 3.21Å; G167-I203 VanDerWaalsContact N-O 3.09Å; I201-I203 HydrophobicContact CG2-CG1 3.93Å; I203-L229 HydrophobicContact CG1-CB 4.3Å; I203-L229 HydrophobicContact CG1-CD1 4.24Å; I203-V239 HydrophobicContact CD1-CG2 4.07Å; I203-V239 HydrophobicContact CG2-CG1 4.06Å
204	T	96.6	Very high	95	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	141	175	-175.1	0	0	0	0	111.8	G167 D206 D210 L229 T230 V236	G167-T204 CarbonylContact O-C 3.43Å; G167-T204 WeakPolarHBondContact O-CA 3.35Å; T204-D206 PolarHBondContact OG1-N 2.8Å; T204-D210 WeakPolarHBondContact CB-OD2 3.4Å; T204-D210 HydrophobicContact CG2-CB 4.06Å; T204-D210 WeakPolarHBondContact OG1-CB 3.49Å; T204-D210 VanDerWaalsContact OG1-CG 3.31Å; T204-D210 PolarHBondContact OG1-OD2 2.65Å; T204-L229 PolarHBondContact N-O 3.07Å; T204-T230 WeakPolarHBondContact CG2-OG1 3.4Å; T204-V236 HydrophobicContact CG2-CG2 4.49Å; T204-V236 VanDerWaalsContact O-CG1 3.25Å; T204-V236 WeakPolarHBondContact O-CG1 3.22Å
205	I	94.8	Very high	95.2	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	16%	0.159	C	C	.	.	S	Bend	trans	-102.2	1.4	167	53.4	113.6	0	0	0	112.7	F166 G167 F168 V245 Y247 V260 H262	F166-I205 HydrophobicContact CB-CG2 3.9Å; F166-I205 HydrophobicContact CD1-CG2 4.03Å; F166-I205 HydrophobicContact CG-CG2 4.46Å; G167-I205 VanDerWaalsContact O-CG1 3.29Å; G167-I205 WeakPolarHBondContact O-CG1 3.46Å; G167-I205 PolarHBondContact O-N 3.4Å; F168-I205 HydrophobicContact CB-CG1 4.35Å; F168-I205 HydrophobicContact CD1-CD1 3.83Å; F168-I205 HydrophobicContact CD1-CG1 4.22Å; F168-I205 HydrophobicContact CE1-CD1 4.5Å; F168-I205 HydrophobicContact CG-CD1 4.48Å; I205-V245 HydrophobicContact CG2-CG1 4.44Å; I205-Y247 HydrophobicContact CB-CG 4.44Å; I205-V260 HydrophobicContact CD1-CB 3.73Å; I205-V260 HydrophobicContact CD1-CG1 3.27Å; I205-H262 HydrophobicContact CD1-CB 3.66Å; I205-H262 HydrophobicContact CG1-CB 4.26Å
206	D	93.9	Very high	95.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.			trans	-129.6	71.4	179.4	-172.2	0.6	0	0	0	112.2	F168 T204 D208 R209 D210 Y258 V260	F168-D206 HydrophobicContact CB-CB 3.82Å; F168-D206 HydrophobicContact CG-CB 4.47Å; T204-D206 PolarHBondContact OG1-N 2.8Å; D206-D208 PolarHBondContact O-N 2.92Å; D206-D208 VanDerWaalsContact O-N 3.17Å; D206-D208 PolarHBondContact OD1-N 2.9Å; D206-R209 PolarHBondContact O-N 3.38Å; D206-R209 IonicContact OD2-CZ 3.3Å; D206-R209 IonicContact OD2-NE 2.95Å; D206-R209 PolarHBondContact OD2-NE 3.22Å; D206-R209 IonicContact OD2-NH2 2.84Å; D206-R209 PolarHBondContact OD2-NH2 3.03Å; D206-D210 VanDerWaalsContact O-CB 3.25Å; D206-D210 WeakPolarHBondContact O-CB 3.3Å; D206-D210 PolarHBondContact O-N 3.4Å; D206-Y258 PolarHBondContact OD1-OH 3.1Å; D206-Y258 PolarHBondContact OD2-OH 2.97Å; D206-V260 HydrophobicContact CB-CG2 4.43Å
207	P	93.4	Very high	95.3	Very high	24 Å²	24	30 Å²	30	16%	0.156	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.8	-178.2	27.5	-34.6	0	0	0	114.2	G231 V233 V236	P207-G231 WeakPolarHBondContact CB-O 3.39Å; P207-V233 HydrophobicContact CG-CB 4.46Å; P207-V233 HydrophobicContact CG-CG2 3.98Å; P207-V236 HydrophobicContact CB-CG2 4Å; P207-V236 HydrophobicContact CG-CB 4.2Å; P207-V236 HydrophobicContact CG-CG2 3.93Å
208	D	91.1	Very high	95.4	Very high	105 Å²	105	25.4 Å²	25.4	56%	0.561	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-30.7	179.7	-68.4	-32.1	0	0	0	111.5	D206	D206-D208 PolarHBondContact O-N 2.92Å; D206-D208 VanDerWaalsContact O-N 3.17Å; D206-D208 PolarHBondContact OD1-N 2.9Å
209	R	90.5	Very high	95.4	Very high	46 Å²	46	25.4 Å²	25.4	17%	0.174	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-33.8	177	-66.3	-172.5	-68.8	-171	-3	113	D206 T211 D257 Y258	D206-R209 PolarHBondContact O-N 3.38Å; D206-R209 IonicContact OD2-CZ 3.3Å; D206-R209 IonicContact OD2-NE 2.95Å; D206-R209 PolarHBondContact OD2-NE 3.22Å; D206-R209 IonicContact OD2-NH2 2.84Å; D206-R209 PolarHBondContact OD2-NH2 3.03Å; R209-T211 PolarHBondContact O-N 3.13Å; R209-T211 VanDerWaalsContact O-N 3.08Å; R209-D257 IonicContact NH1-OD1 3.8Å; R209-D257 PolarHBondContact NH1-OD1 3.23Å; R209-Y258 PolarHBondContact NH1-O 2.64Å; R209-Y258 PolarHBondContact NH2-O 2.87Å
210	D	94.8	Very high	95.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.			trans	-88	74.3	-173.6	-65.6	-11.2	0	0	0	111.8	F168 T169 H170 T204 D206 M215 T230	F168-D210 WeakPolarHBondContact CA-OD2 3.41Å; F168-D210 WeakPolarHBondContact CB-OD2 3.48Å; T169-D210 WeakPolarHBondContact CB-OD1 3.44Å; T169-D210 HydrophobicContact CG2-CB 4.42Å; T169-D210 WeakPolarHBondContact CG2-OD1 3.48Å; T169-D210 PolarHBondContact N-OD1 3.03Å; T169-D210 PolarHBondContact N-OD2 3.17Å; T169-D210 PolarHBondContact OG1-OD1 3.27Å; H170-D210 IonicContact ND1-OD1 2.64Å; T204-D210 WeakPolarHBondContact CB-OD2 3.4Å; T204-D210 HydrophobicContact CG2-CB 4.06Å; T204-D210 WeakPolarHBondContact OG1-CB 3.49Å; T204-D210 VanDerWaalsContact OG1-CG 3.31Å; T204-D210 PolarHBondContact OG1-OD2 2.65Å; D206-D210 VanDerWaalsContact O-CB 3.25Å; D206-D210 WeakPolarHBondContact O-CB 3.3Å; D206-D210 PolarHBondContact O-N 3.4Å; D210-M215 HydrophobicContact CB-CG 4.1Å; D210-M215 HydrophobicContact CB-SD 3.97Å; D210-T230 WeakPolarHBondContact O-CB 3.32Å; D210-T230 PolarHBondContact O-OG1 2.9Å
211	T	94.5	Very high	95.1	Very high	66 Å²	66	40 Å²	40	41%	0.405	21%	0.213	S	C	.	.			trans	-65.6	164.9	171.5	81.4	0	0	0	0	111.3	R209 E213 A214 M215	R209-T211 PolarHBondContact O-N 3.13Å; R209-T211 VanDerWaalsContact O-N 3.08Å; T211-E213 WeakPolarHBondContact CB-OE2 3.16Å; T211-E213 PolarHBondContact O-N 3.2Å; T211-E213 PolarHBondContact OG1-N 3.47Å; T211-E213 PolarHBondContact OG1-OE2 3.3Å; T211-A214 PolarHBondContact O-N 3.03Å; T211-A214 PolarHBondContact OG1-N 3.33Å; T211-M215 WeakPolarHBondContact O-CB 3.43Å; T211-M215 WeakPolarHBondContact O-CG 3.32Å; T211-M215 PolarHBondContact O-N 2.7Å
212	A	95.3	Very high	95	Very high	7 Å²	7	42.1 Å²	42.1	6%	0.058	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-37.5	177.9	0	0	0	0	0	111.8	N149 A216 T230	N149-A212 WeakPolarHBondContact OD1-CB 3.42Å; A212-A216 WeakPolarHBondContact O-CB 3.37Å; A212-A216 PolarHBondContact O-N 2.93Å; A212-T230 HydrophobicContact CB-CG2 4.18Å
213	E	95.1	Very high	94.8	Very high	113 Å²	113	42.5 Å²	42.5	53%	0.528	23%	0.225	S	C	.	.	H	α-helix	trans	-68.4	-43.1	177.7	-58.7	70.2	-149.8	0	0	112	N149 T211 A216 A217	N149-E213 PolarHBondContact ND2-OE1 2.88Å; T211-E213 WeakPolarHBondContact CB-OE2 3.16Å; T211-E213 PolarHBondContact O-N 3.2Å; T211-E213 PolarHBondContact OG1-N 3.47Å; T211-E213 PolarHBondContact OG1-OE2 3.3Å; E213-A216 WeakPolarHBondContact O-CB 2.93Å; E213-A216 PolarHBondContact O-N 2.91Å; E213-A217 PolarHBondContact O-N 3.25Å
214	A	95	Very high	94.7	Very high	32 Å²	32	48.8 Å²	48.8	26%	0.264	27%	0.266	S	S	.	.	H	α-helix	trans	-63.6	-45.1	175.7	0	0	0	0	0	111	T211 A216 A217 Y218	T211-A214 PolarHBondContact O-N 3.03Å; T211-A214 PolarHBondContact OG1-N 3.33Å; A214-A216 VanDerWaalsContact C-N 3.3Å; A214-A216 PolarHBondContact O-N 2.83Å; A214-A217 PolarHBondContact O-N 3.32Å; A214-Y218 WeakPolarHBondContact O-CB 3.22Å; A214-Y218 PolarHBondContact O-N 3.36Å
215	M	96.5	Very high	94.7	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-40.7	174	-72.3	-65.7	-66.6	0	0	111.7	H147 T169 L202 D210 T211 Y218 V219	H147-M215 HydrophobicContact CB-CB 4.08Å; T169-M215 HydrophobicContact CG2-SD 3.55Å; T169-M215 VanDerWaalsContact CG2-SD 3.55Å; L202-M215 HydrophobicContact CB-CE 4.46Å; L202-M215 HydrophobicContact CD2-CE 3.72Å; L202-M215 HydrophobicContact CG-CE 3.92Å; D210-M215 HydrophobicContact CB-CG 4.1Å; D210-M215 HydrophobicContact CB-SD 3.97Å; T211-M215 WeakPolarHBondContact O-CB 3.43Å; T211-M215 WeakPolarHBondContact O-CG 3.32Å; T211-M215 PolarHBondContact O-N 2.7Å; M215-Y218 PolarHBondContact O-N 3.06Å; M215-V219 WeakPolarHBondContact O-CG1 3.45Å; M215-V219 VanDerWaalsContact O-CG2 3.3Å; M215-V219 WeakPolarHBondContact O-CG2 3.38Å; M215-V219 PolarHBondContact O-N 3.42Å
216	A	96.2	Very high	94.8	Very high	28 Å²	28	52.9 Å²	52.9	23%	0.231	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-41.3	179.1	0	0	0	0	0	112.7	H147 A212 E213 A214 K220	H147-A216 HydrophobicContact CB-CB 3.95Å; H147-A216 WeakPolarHBondContact O-CB 3.44Å; A212-A216 WeakPolarHBondContact O-CB 3.37Å; A212-A216 PolarHBondContact O-N 2.93Å; E213-A216 WeakPolarHBondContact O-CB 2.93Å; E213-A216 PolarHBondContact O-N 2.91Å; A214-A216 VanDerWaalsContact C-N 3.3Å; A214-A216 PolarHBondContact O-N 2.83Å; A216-K220 VanDerWaalsContact O-CB 3.3Å; A216-K220 WeakPolarHBondContact O-CB 3.46Å; A216-K220 PolarHBondContact O-N 2.87Å
217	A	95.3	Very high	94.9	Very high	58 Å²	58	54.6 Å²	54.6	48%	0.479	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-48.5	174.3	0	0	0	0	0	110.4	E213 A214 K220	E213-A217 PolarHBondContact O-N 3.25Å; A214-A217 PolarHBondContact O-N 3.32Å; A217-K220 PolarHBondContact O-N 3.45Å
218	Y	95.4	Very high	95.1	Very high	24 Å²	24	53.5 Å²	53.5	9%	0.094	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-52	-176.8	-169.2	-112.2	0	0	0	112.9	T169 I179 L202 A214 M215 K220 E221 F222	T169-Y218 HydrophobicContact CG2-CD1 3.8Å; T169-Y218 HydrophobicContact CG2-CD2 4.35Å; T169-Y218 HydrophobicContact CG2-CE1 4.46Å; T169-Y218 HydrophobicContact CG2-CG 3.72Å; I179-Y218 HydrophobicContact CD1-CE1 3.55Å; L202-Y218 HydrophobicContact CD2-CD1 3.86Å; L202-Y218 HydrophobicContact CD2-CE1 3.9Å; A214-Y218 WeakPolarHBondContact O-CB 3.22Å; A214-Y218 PolarHBondContact O-N 3.36Å; M215-Y218 PolarHBondContact O-N 3.06Å; Y218-K220 PolarHBondContact O-N 3.2Å; Y218-E221 WeakPolarHBondContact O-CB 3.44Å; Y218-E221 PolarHBondContact O-N 3.06Å; Y218-E221 VanDerWaalsContact O-N 3.12Å; Y218-F222 AromaticContact CD1-CE2 3.97Å; Y218-F222 HydrophobicContact CD1-CE2 3.97Å; Y218-F222 HydrophobicContact CD2-CE2 4.05Å; Y218-F222 HydrophobicContact CE1-CD2 4.48Å; Y218-F222 AromaticContact CE1-CE2 3.62Å; Y218-F222 HydrophobicContact CE1-CE2 3.62Å; Y218-F222 HydrophobicContact CE1-CZ 4.25Å; Y218-F222 AromaticContact CE2-CE2 3.7Å; Y218-F222 HydrophobicContact CE2-CE2 3.7Å; Y218-F222 HydrophobicContact CE2-CZ 4.06Å; Y218-F222 HydrophobicContact CG-CE2 4.18Å; Y218-F222 AromaticContact CZ-CE2 3.47Å; Y218-F222 VanDerWaalsContact CZ-CE2 3.47Å; Y218-F222 AromaticContact CZ-CZ 3.75Å; Y218-F222 VanDerWaalsContact O-CD2 3.27Å; Y218-F222 WeakPolarHBondContact O-CD2 3.32Å
219	V	96	Very high	95.4	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.024	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-28.3	-176.3	-61.3	0	0	0	0	113.3	L202 M215 E221 F222 S223 L226	L202-V219 HydrophobicContact CD2-CG1 4.26Å; M215-V219 WeakPolarHBondContact O-CG1 3.45Å; M215-V219 VanDerWaalsContact O-CG2 3.3Å; M215-V219 WeakPolarHBondContact O-CG2 3.38Å; M215-V219 PolarHBondContact O-N 3.42Å; V219-E221 VanDerWaalsContact C-N 3.25Å; V219-E221 PolarHBondContact O-N 2.92Å; V219-F222 PolarHBondContact O-N 3.09Å; V219-S223 PolarHBondContact O-N 3.41Å; V219-L226 HydrophobicContact CB-CB 4.23Å; V219-L226 HydrophobicContact CB-CD2 3.88Å; V219-L226 HydrophobicContact CB-CG 3.95Å; V219-L226 HydrophobicContact CG1-CD2 3.86Å; V219-L226 HydrophobicContact CG1-CG 3.92Å
220	K	95.2	Very high	95.8	Very high	175 Å²	175	46.8 Å²	46.8	76%	0.761	25%	0.254	S	S	*	.	H	α-helix	trans	-67.2	-26.1	178.3	-174.7	179.6	177.7	-174.1	0	112.6	A216 A217 Y218 F222	A216-K220 VanDerWaalsContact O-CB 3.3Å; A216-K220 WeakPolarHBondContact O-CB 3.46Å; A216-K220 PolarHBondContact O-N 2.87Å; A217-K220 PolarHBondContact O-N 3.45Å; Y218-K220 PolarHBondContact O-N 3.2Å; K220-F222 VanDerWaalsContact C-N 3.34Å
221	E	94.6	Very high	95.8	Very high	153 Å²	153	47.4 Å²	47.4	72%	0.715	26%	0.26	S	S	*	.	H	α-helix	trans	-70.3	-31.5	177.7	-66.5	178.2	176.6	0	0	112.1	Y218 V219	Y218-E221 WeakPolarHBondContact O-CB 3.44Å; Y218-E221 PolarHBondContact O-N 3.06Å; Y218-E221 VanDerWaalsContact O-N 3.12Å; V219-E221 VanDerWaalsContact C-N 3.25Å; V219-E221 PolarHBondContact O-N 2.92Å
222	F	95.3	Very high	95.8	Very high	45 Å²	45	47 Å²	47	20%	0.197	26%	0.259	C	S	.	.	H	α-helix	trans	-90.1	-56.2	-177.9	-61.7	-85.3	0	0	0	113.2	P176 I179 E180 I183 Y218 V219 K220 L226	P176-F222 HydrophobicContact CB-CE1 4.25Å; P176-F222 HydrophobicContact CB-CZ 4.17Å; I179-F222 HydrophobicContact CB-CD1 4.12Å; I179-F222 HydrophobicContact CB-CE1 4.15Å; I179-F222 HydrophobicContact CB-CG 4.44Å; I179-F222 HydrophobicContact CD1-CE2 4.37Å; I179-F222 HydrophobicContact CD1-CZ 4.41Å; I179-F222 HydrophobicContact CG2-CB 3.86Å; I179-F222 HydrophobicContact CG2-CD1 3.58Å; I179-F222 HydrophobicContact CG2-CD2 3.92Å; I179-F222 HydrophobicContact CG2-CE1 4.07Å; I179-F222 HydrophobicContact CG2-CE2 4.4Å; I179-F222 HydrophobicContact CG2-CG 3.5Å; I179-F222 VanDerWaalsContact CG2-CG 3.5Å; I179-F222 HydrophobicContact CG2-CZ 4.46Å; E180-F222 HydrophobicContact CG-CD1 3.95Å; E180-F222 HydrophobicContact CG-CE1 4.02Å; I183-F222 HydrophobicContact CG1-CB 4.37Å; Y218-F222 AromaticContact CD1-CE2 3.97Å; Y218-F222 HydrophobicContact CD1-CE2 3.97Å; Y218-F222 HydrophobicContact CD2-CE2 4.05Å; Y218-F222 HydrophobicContact CE1-CD2 4.48Å; Y218-F222 AromaticContact CE1-CE2 3.62Å; Y218-F222 HydrophobicContact CE1-CE2 3.62Å; Y218-F222 HydrophobicContact CE1-CZ 4.25Å; Y218-F222 AromaticContact CE2-CE2 3.7Å; Y218-F222 HydrophobicContact CE2-CE2 3.7Å; Y218-F222 HydrophobicContact CE2-CZ 4.06Å; Y218-F222 HydrophobicContact CG-CE2 4.18Å; Y218-F222 AromaticContact CZ-CE2 3.47Å; Y218-F222 VanDerWaalsContact CZ-CE2 3.47Å; Y218-F222 AromaticContact CZ-CZ 3.75Å; Y218-F222 VanDerWaalsContact O-CD2 3.27Å; Y218-F222 WeakPolarHBondContact O-CD2 3.32Å; V219-F222 PolarHBondContact O-N 3.09Å; K220-F222 VanDerWaalsContact C-N 3.34Å; F222-L226 HydrophobicContact CB-CD2 4.08Å; F222-L226 HydrophobicContact CD2-CD2 4.39Å
223	S	95.2	Very high	95.8	Very high	10 Å²	10	50.2 Å²	50.2	7%	0.07	28%	0.279	C	S	.	.			trans	-163.1	139.1	-176.1	-177.2	0	0	0	0	112.6	V219 K225 L226	V219-S223 PolarHBondContact O-N 3.41Å; S223-K225 PolarHBondContact O-N 2.9Å; S223-K225 VanDerWaalsContact O-N 3.11Å; S223-K225 PolarHBondContact OG-N 3.02Å; S223-L226 WeakPolarHBondContact O-CB 3.31Å; S223-L226 PolarHBondContact O-N 3.25Å; S223-L226 VanDerWaalsContact O-N 3.07Å
224	P	94.6	Very high	95.8	Very high	133 Å²	133	47.9 Å²	47.9	86%	0.864	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.7	173	29.1	-36.4	0	0	0	113.6
225	K	95.1	Very high	95.8	Very high	83 Å²	83	49 Å²	49	36%	0.361	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-17	175.6	-60.5	177	-170.5	165.3	0	112.7	V186 D187 D190 P200 S223 I227	V186-K225 HydrophobicContact CG1-CD 4.06Å; D187-K225 IonicContact OD1-NZ 3.79Å; D187-K225 PolarHBondContact OD1-NZ 3.17Å; D190-K225 WeakPolarHBondContact OD2-CE 3.38Å; D190-K225 IonicContact OD2-NZ 2.65Å; D190-K225 PolarHBondContact OD2-NZ 3.24Å; P200-K225 HydrophobicContact CG-CB 4.24Å; S223-K225 PolarHBondContact O-N 2.9Å; S223-K225 VanDerWaalsContact O-N 3.11Å; S223-K225 PolarHBondContact OG-N 3.02Å; K225-I227 PolarHBondContact O-N 3.21Å
226	L	97.3	Very high	95.7	Very high	4 Å²	4	49 Å²	49	2%	0.021	28%	0.278	C	S	.	.			trans	-74.6	123.7	-175.1	-175.9	61	0	0	0	110.8	I179 M182 I183 P200 L202 V219 F222 S223	I179-L226 HydrophobicContact CG2-CD2 3.62Å; M182-L226 HydrophobicContact SD-CD1 4.46Å; I183-L226 HydrophobicContact CD1-CB 4.27Å; I183-L226 HydrophobicContact CD1-CD1 4.44Å; P200-L226 HydrophobicContact CB-CD1 3.87Å; P200-L226 HydrophobicContact CG-CD1 4.35Å; L202-L226 HydrophobicContact CB-CD1 4.23Å; V219-L226 HydrophobicContact CB-CB 4.23Å; V219-L226 HydrophobicContact CB-CD2 3.88Å; V219-L226 HydrophobicContact CB-CG 3.95Å; V219-L226 HydrophobicContact CG1-CD2 3.86Å; V219-L226 HydrophobicContact CG1-CG 3.92Å; F222-L226 HydrophobicContact CB-CD2 4.08Å; F222-L226 HydrophobicContact CD2-CD2 4.39Å; S223-L226 WeakPolarHBondContact O-CB 3.31Å; S223-L226 PolarHBondContact O-N 3.25Å; S223-L226 VanDerWaalsContact O-N 3.07Å
227	I	97.4	Very high	95.6	Very high	36 Å²	36	51.2 Å²	51.2	19%	0.185	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	112.5	176.5	-57.4	175	0	0	0	108.6	F157 T199 P200 I201 L202 K225 L229	F157-I227 HydrophobicContact CE1-CD1 4.05Å; T199-I227 HydrophobicContact CG2-CD1 3.7Å; P200-I227 PolarHBondContact O-N 3.39Å; I201-I227 CarbonylContact C-O 3.56Å; I201-I227 WeakPolarHBondContact CA-O 3.47Å; I201-I227 HydrophobicContact CG1-CB 4.35Å; L202-I227 PolarHBondContact N-O 3.22Å; K225-I227 PolarHBondContact O-N 3.21Å; I227-L229 HydrophobicContact CG2-CD2 3.83Å; I227-L229 HydrophobicContact CG2-CG 4.32Å
228	G	97.3	Very high	95.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	132.2	167.5	0	0	0	0	0	111.1	D146 H147 L202	D146-G228 CarbonylContact C-O 3.58Å; D146-G228 WeakPolarHBondContact CA-O 3.27Å; H147-G228 PolarHBondContact N-O 3.34Å; H147-G228 PolarHBondContact ND1-N 3.39Å; H147-G228 PolarHBondContact ND1-O 2.99Å; L202-G228 CarbonylContact O-C 3.5Å; L202-G228 WeakPolarHBondContact O-CA 3.37Å
229	L	97.7	Very high	95.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134.7	174	-59.5	-176.4	0	0	0	110.5	F142 L144 I145 D146 I201 L202 I203 T204 I227	F142-L229 HydrophobicContact CE2-CD1 3.84Å; F142-L229 HydrophobicContact CZ-CD1 4.38Å; L144-L229 HydrophobicContact CB-CB 4.21Å; L144-L229 HydrophobicContact CD1-CB 3.86Å; L144-L229 HydrophobicContact CD1-CD1 4Å; I145-L229 CarbonylContact O-C 3.6Å; I145-L229 WeakPolarHBondContact O-CA 3.39Å; D146-L229 HydrophobicContact CB-CD2 3.91Å; I201-L229 HydrophobicContact CG2-CD1 3.56Å; I201-L229 HydrophobicContact CG2-CG 3.8Å; L202-L229 PolarHBondContact O-N 3.46Å; I203-L229 HydrophobicContact CG1-CB 4.3Å; I203-L229 HydrophobicContact CG1-CD1 4.24Å; T204-L229 PolarHBondContact N-O 3.07Å; I227-L229 HydrophobicContact CG2-CD2 3.83Å; I227-L229 HydrophobicContact CG2-CG 4.32Å
230	T	97.2	Very high	95.3	Very high	11 Å²	11	52 Å²	52	7%	0.067	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	178.4	175.2	-171.7	0	0	0	0	110.8	L144 I145 T204 D210 A212	L144-T230 WeakPolarHBondContact CB-O 3.48Å; I145-T230 PolarHBondContact N-O 3.11Å; I145-T230 PolarHBondContact O-N 3.27Å; T204-T230 WeakPolarHBondContact CG2-OG1 3.4Å; D210-T230 WeakPolarHBondContact O-CB 3.32Å; D210-T230 PolarHBondContact O-OG1 2.9Å; A212-T230 HydrophobicContact CB-CG2 4.18Å
231	G	95.3	Very high	95.2	Very high	12 Å²	12	50.4 Å²	50.4	12%	0.124	27%	0.268	C	S	.	.			trans	176.9	-169.5	179.4	0	0	0	0	0	112.6	P207	P207-G231 WeakPolarHBondContact CB-O 3.39Å
232	S	95.5	Very high	95.1	Very high	57 Å²	57	44.4 Å²	44.4	40%	0.399	24%	0.244	S	C	.	.			trans	-67.5	156.1	170	64.1	0	0	0	0	111.5	A234 Q235 V236	S232-A234 PolarHBondContact O-N 3.38Å; S232-A234 VanDerWaalsContact O-N 3.13Å; S232-Q235 WeakPolarHBondContact O-CB 3.41Å; S232-Q235 PolarHBondContact O-N 3Å; S232-Q235 VanDerWaalsContact OG-CG 3.31Å; S232-Q235 WeakPolarHBondContact OG-CG 3.37Å; S232-Q235 PolarHBondContact OG-N 3.11Å; S232-Q235 PolarHBondContact OG-OE1 3.32Å; S232-V236 PolarHBondContact O-N 2.97Å
233	V	94.1	Very high	95	Very high	76 Å²	76	42.6 Å²	42.6	46%	0.461	24%	0.236	S	C	.	.	H	α-helix	trans	-48	-42.7	174.4	-179.4	0	0	0	0	111.7	P207 Q235 V236 E237	P207-V233 HydrophobicContact CG-CB 4.46Å; P207-V233 HydrophobicContact CG-CG2 3.98Å; V233-Q235 PolarHBondContact O-N 3.39Å; V233-V236 PolarHBondContact O-N 3.05Å; V233-E237 VanDerWaalsContact O-CB 3.25Å; V233-E237 WeakPolarHBondContact O-CB 3.44Å; V233-E237 PolarHBondContact O-N 2.98Å
234	A	94.9	Very high	94.8	Very high	63 Å²	63	50 Å²	50	52%	0.521	26%	0.262	S	S	.	.	H	α-helix	trans	-65.8	-38.8	179.2	0	0	0	0	0	113.2	S232 Q238	S232-A234 PolarHBondContact O-N 3.38Å; S232-A234 VanDerWaalsContact O-N 3.13Å; A234-Q238 WeakPolarHBondContact O-CB 3.27Å; A234-Q238 PolarHBondContact O-N 3.43Å
235	Q	95.2	Very high	94.7	Very high	55 Å²	55	44.2 Å²	44.2	26%	0.257	22%	0.224	S	C	.	.	H	α-helix	trans	-69.6	-43	177.8	-71	164.9	-63.5	0	0	111.3	S143 L144 S232 V233 Q238 V239	S143-Q235 PolarHBondContact O-NE2 3.11Å; L144-Q235 HydrophobicContact CD2-CB 3.92Å; S232-Q235 WeakPolarHBondContact O-CB 3.41Å; S232-Q235 PolarHBondContact O-N 3Å; S232-Q235 VanDerWaalsContact OG-CG 3.31Å; S232-Q235 WeakPolarHBondContact OG-CG 3.37Å; S232-Q235 PolarHBondContact OG-N 3.11Å; S232-Q235 PolarHBondContact OG-OE1 3.32Å; V233-Q235 PolarHBondContact O-N 3.39Å; Q235-Q238 WeakPolarHBondContact O-CB 3.4Å; Q235-Q238 PolarHBondContact O-N 2.87Å; Q235-V239 PolarHBondContact O-N 3.43Å; Q235-V239 VanDerWaalsContact O-N 3.08Å
236	V	94.8	Very high	94.4	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-46.5	175.7	173.2	0	0	0	0	110.4	T204 P207 S232 V233 Q238 V239 S240	T204-V236 HydrophobicContact CG2-CG2 4.49Å; T204-V236 VanDerWaalsContact O-CG1 3.25Å; T204-V236 WeakPolarHBondContact O-CG1 3.22Å; P207-V236 HydrophobicContact CB-CG2 4Å; P207-V236 HydrophobicContact CG-CB 4.2Å; P207-V236 HydrophobicContact CG-CG2 3.93Å; S232-V236 PolarHBondContact O-N 2.97Å; V233-V236 PolarHBondContact O-N 3.05Å; V236-Q238 VanDerWaalsContact C-N 3.3Å; V236-Q238 PolarHBondContact O-N 3.26Å; V236-V239 WeakPolarHBondContact O-CG1 3.36Å; V236-V239 PolarHBondContact O-N 2.99Å; V236-S240 WeakPolarHBondContact O-CB 3.49Å; V236-S240 PolarHBondContact O-N 3.16Å; V236-S240 PolarHBondContact O-OG 3.12Å
237	E	93.2	Very high	94.1	Very high	76 Å²	76	50.3 Å²	50.3	36%	0.355	25%	0.246	S	C	.	.	H	α-helix	trans	-62.9	-36.6	178.1	-163.6	-162.5	-171	0	0	111.9	V233 R241	V233-E237 VanDerWaalsContact O-CB 3.25Å; V233-E237 WeakPolarHBondContact O-CB 3.44Å; V233-E237 PolarHBondContact O-N 2.98Å; E237-R241 VanDerWaalsContact CD-NH2 3.31Å; E237-R241 VanDerWaalsContact CG-CZ 3.49Å; E237-R241 WeakPolarHBondContact O-CB 3.45Å; E237-R241 WeakPolarHBondContact O-CG 3.42Å; E237-R241 PolarHBondContact O-N 3.05Å; E237-R241 PolarHBondContact O-NE 2.86Å; E237-R241 IonicContact OE1-CZ 3.76Å; E237-R241 IonicContact OE1-NH1 2.83Å; E237-R241 PolarHBondContact OE1-NH1 3.43Å; E237-R241 IonicContact OE1-NH2 2.7Å; E237-R241 IonicContact OE2-CZ 3.96Å; E237-R241 VanDerWaalsContact OE2-CZ 3.3Å; E237-R241 IonicContact OE2-NH1 3.66Å; E237-R241 PolarHBondContact OE2-NH1 3.32Å; E237-R241 IonicContact OE2-NH2 2.75Å; E237-R241 PolarHBondContact OE2-NH2 3.13Å
238	Q	94.2	Very high	93.6	Very high	100 Å²	100	50.8 Å²	50.8	47%	0.467	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-50.5	174	178.8	-177.3	-19.4	0	0	112	A234 Q235 V236 R241 A242	A234-Q238 WeakPolarHBondContact O-CB 3.27Å; A234-Q238 PolarHBondContact O-N 3.43Å; Q235-Q238 WeakPolarHBondContact O-CB 3.4Å; Q235-Q238 PolarHBondContact O-N 2.87Å; V236-Q238 VanDerWaalsContact C-N 3.3Å; V236-Q238 PolarHBondContact O-N 3.26Å; Q238-R241 PolarHBondContact O-N 3.47Å; Q238-A242 PolarHBondContact O-N 3.35Å
239	V	94.7	Very high	93.1	Very high	1 Å²	1	55 Å²	55	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-68.6	-39.9	-179.4	65.4	0	0	0	0	111.4	F142 L144 F166 I203 Q235 V236 R241 A242 Y243	F142-V239 HydrophobicContact CB-CB 4.09Å; F142-V239 HydrophobicContact CB-CG2 3.85Å; F142-V239 HydrophobicContact CD1-CG2 4.41Å; F142-V239 HydrophobicContact CG-CG2 4.33Å; L144-V239 HydrophobicContact CD1-CG1 4.33Å; F166-V239 HydrophobicContact CE1-CG1 4.21Å; F166-V239 HydrophobicContact CE1-CG2 4.1Å; F166-V239 HydrophobicContact CZ-CG2 4.1Å; I203-V239 HydrophobicContact CD1-CG2 4.07Å; I203-V239 HydrophobicContact CG2-CG1 4.06Å; Q235-V239 PolarHBondContact O-N 3.43Å; Q235-V239 VanDerWaalsContact O-N 3.08Å; V236-V239 WeakPolarHBondContact O-CG1 3.36Å; V236-V239 PolarHBondContact O-N 2.99Å; V239-R241 VanDerWaalsContact C-N 3.28Å; V239-R241 PolarHBondContact O-N 3.11Å; V239-A242 PolarHBondContact O-N 3.25Å; V239-A242 VanDerWaalsContact O-N 3.12Å; V239-Y243 HydrophobicContact CG2-CD2 3.82Å; V239-Y243 HydrophobicContact CG2-CE2 3.94Å; V239-Y243 WeakPolarHBondContact O-CD2 3.48Å; V239-Y243 PolarHBondContact O-N 2.95Å
240	S	93.2	Very high	92.4	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.007	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-40.5	175.1	-64.9	0	0	0	0	111.4	V236 Y243 R244 V245	V236-S240 WeakPolarHBondContact O-CB 3.49Å; V236-S240 PolarHBondContact O-N 3.16Å; V236-S240 PolarHBondContact O-OG 3.12Å; S240-Y243 CarbonylContact O-C 3.55Å; S240-R244 CarbonylContact O-C 3.52Å; S240-R244 WeakPolarHBondContact O-CA 3.42Å; S240-R244 PolarHBondContact O-N 3.13Å; S240-V245 PolarHBondContact O-N 2.98Å
241	R	92.5	Very high	91.7	Very high	142 Å²	142	61.7 Å²	61.7	54%	0.536	32%	0.32	S	S	.	.	H	α-helix	trans	-66.2	-41.9	173.5	-77.9	-176.4	-70.9	-118.8	-7.4	113.3	E237 Q238 V239 Y243 R244	E237-R241 VanDerWaalsContact CD-NH2 3.31Å; E237-R241 VanDerWaalsContact CG-CZ 3.49Å; E237-R241 WeakPolarHBondContact O-CB 3.45Å; E237-R241 WeakPolarHBondContact O-CG 3.42Å; E237-R241 PolarHBondContact O-N 3.05Å; E237-R241 PolarHBondContact O-NE 2.86Å; E237-R241 IonicContact OE1-CZ 3.76Å; E237-R241 IonicContact OE1-NH1 2.83Å; E237-R241 PolarHBondContact OE1-NH1 3.43Å; E237-R241 IonicContact OE1-NH2 2.7Å; E237-R241 IonicContact OE2-CZ 3.96Å; E237-R241 VanDerWaalsContact OE2-CZ 3.3Å; E237-R241 IonicContact OE2-NH1 3.66Å; E237-R241 PolarHBondContact OE2-NH1 3.32Å; E237-R241 IonicContact OE2-NH2 2.75Å; E237-R241 PolarHBondContact OE2-NH2 3.13Å; Q238-R241 PolarHBondContact O-N 3.47Å; V239-R241 VanDerWaalsContact C-N 3.28Å; V239-R241 PolarHBondContact O-N 3.11Å; R241-Y243 VanDerWaalsContact C-N 3.27Å; R241-Y243 PolarHBondContact O-N 3.38Å; R241-R244 PolarHBondContact O-N 3.15Å
242	A	92.5	Very high	91.2	Very high	26 Å²	26	66.9 Å²	66.9	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-61.4	-37.2	179.1	0	0	0	0	0	112.1	G139 Q238 V239	G139-A242 PolarHBondContact N-O 3.49Å; Q238-A242 PolarHBondContact O-N 3.35Å; V239-A242 PolarHBondContact O-N 3.25Å; V239-A242 VanDerWaalsContact O-N 3.12Å
243	Y	92.7	Very high	90.6	Very high	7 Å²	7	68.1 Å²	68.1	3%	0.027	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.4	175.6	-73.7	-94.8	0	0	0	113.7	I164 F166 V239 S240 R241 V245 Y267 V269	I164-Y243 HydrophobicContact CD1-CE1 4.1Å; I164-Y243 WeakPolarHBondContact CD1-OH 3.11Å; F166-Y243 HydrophobicContact CE2-CD1 4.16Å; F166-Y243 HydrophobicContact CE2-CD2 4.33Å; F166-Y243 AromaticContact CE2-CG 3.83Å; F166-Y243 HydrophobicContact CE2-CG 3.83Å; F166-Y243 HydrophobicContact CZ-CD1 4.37Å; F166-Y243 AromaticContact CZ-CD2 3.72Å; F166-Y243 HydrophobicContact CZ-CD2 3.72Å; F166-Y243 HydrophobicContact CZ-CE2 4.48Å; F166-Y243 AromaticContact CZ-CG 3.65Å; F166-Y243 HydrophobicContact CZ-CG 3.65Å; V239-Y243 HydrophobicContact CG2-CD2 3.82Å; V239-Y243 HydrophobicContact CG2-CE2 3.94Å; V239-Y243 WeakPolarHBondContact O-CD2 3.48Å; V239-Y243 PolarHBondContact O-N 2.95Å; S240-Y243 CarbonylContact O-C 3.55Å; R241-Y243 VanDerWaalsContact C-N 3.27Å; R241-Y243 PolarHBondContact O-N 3.38Å; Y243-V245 PolarHBondContact O-N 3.3Å; Y243-Y267 AromaticContact CD1-CD1 3.98Å; Y243-Y267 HydrophobicContact CD1-CD1 3.98Å; Y243-Y267 HydrophobicContact CD1-CD2 4.41Å; Y243-Y267 HydrophobicContact CD1-CE1 4.5Å; Y243-Y267 AromaticContact CD1-CG 3.94Å; Y243-Y267 HydrophobicContact CD1-CG 3.94Å; Y243-Y267 HydrophobicContact CE1-CG 4.49Å; Y243-V269 HydrophobicContact CE1-CG2 4.17Å
244	R	91.6	Very high	89.9	Confident	167 Å²	167	74.2 Å²	74.2	63%	0.63	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	35.3	-176.5	-56.2	-174.7	-177.4	-163.7	-3.5	113.7	L138 S240 R241 Y246	L138-R244 HydrophobicContact CD2-CB 3.93Å; L138-R244 HydrophobicContact CD2-CG 3.71Å; S240-R244 CarbonylContact O-C 3.52Å; S240-R244 WeakPolarHBondContact O-CA 3.42Å; S240-R244 PolarHBondContact O-N 3.13Å; R241-R244 PolarHBondContact O-N 3.15Å; R244-Y246 PolarHBondContact O-N 3.43Å
245	V	91.9	Very high	89.2	Confident	10 Å²	10	78.2 Å²	78.2	6%	0.061	38%	0.377	C	S	.	.			trans	-75.1	117.8	175.2	177.3	0	0	0	0	108	F166 I205 S240 Y243 Y267	F166-V245 HydrophobicContact CB-CG1 3.97Å; F166-V245 HydrophobicContact CB-CG2 4.29Å; F166-V245 HydrophobicContact CD1-CB 4.46Å; F166-V245 HydrophobicContact CD1-CG1 4.35Å; F166-V245 HydrophobicContact CD1-CG2 3.98Å; F166-V245 HydrophobicContact CD2-CG2 3.48Å; F166-V245 VanDerWaalsContact CD2-CG2 3.48Å; F166-V245 HydrophobicContact CE1-CG2 4.12Å; F166-V245 HydrophobicContact CE2-CG2 3.64Å; F166-V245 HydrophobicContact CG-CB 4.39Å; F166-V245 HydrophobicContact CG-CG1 4.1Å; F166-V245 HydrophobicContact CG-CG2 3.65Å; F166-V245 HydrophobicContact CZ-CG2 3.96Å; I205-V245 HydrophobicContact CG2-CG1 4.44Å; S240-V245 PolarHBondContact O-N 2.98Å; Y243-V245 PolarHBondContact O-N 3.3Å; V245-Y267 HydrophobicContact CG2-CE2 4.06Å
246	Y	89.8	Confident	88.3	Confident	154 Å²	154	80.6 Å²	80.6	60%	0.604	39%	0.392	S	S	*	.			trans	-79.9	133.9	168.1	178	-95.9	0	0	0	109.2	R244 H262 T263	R244-Y246 PolarHBondContact O-N 3.43Å; Y246-H262 WeakPolarHBondContact O-CA 3.44Å; Y246-T263 PolarHBondContact N-OG1 3.12Å; Y246-T263 VanDerWaalsContact N-OG1 3.09Å; Y246-T263 PolarHBondContact O-N 2.85Å; Y246-T263 PolarHBondContact O-OG1 3Å; Y246-T263 VanDerWaalsContact O-OG1 3.13Å
247	Y	90.8	Very high	87.5	Confident	61 Å²	61	84.1 Å²	84.1	24%	0.239	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	148.3	167.7	68.5	-80	0	0	0	111	I205 V260 D261	I205-Y247 HydrophobicContact CB-CG 4.44Å; Y247-V260 HydrophobicContact CD2-CG1 4.4Å; Y247-D261 CarbonylContact C-O 3.59Å; Y247-D261 WeakPolarHBondContact CA-O 3.1Å
248	S	87.6	Confident	86.9	Confident	46 Å²	46	81.4 Å²	81.4	32%	0.322	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	126.4	177.8	-177.5	0	0	0	0	110.3	V260 D261	S248-V260 WeakPolarHBondContact O-CA 3.49Å; S248-V260 WeakPolarHBondContact O-CG1 3.27Å; S248-D261 PolarHBondContact N-O 3.23Å; S248-D261 PolarHBondContact O-N 3.34Å
249	Q	85.6	Confident	86.3	Confident	90 Å²	90	81.4 Å²	81.4	42%	0.421	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	127.9	172.6	-63.7	-179.9	0.6	0	0	109.4	Y258 V260	Q249-Y258 HydrophobicContact CB-CD2 4.26Å; Q249-Y258 HydrophobicContact CB-CE2 4.35Å; Q249-Y258 HydrophobicContact CG-CD2 4.36Å; Q249-Y258 HydrophobicContact CG-CE2 3.97Å; Q249-V260 HydrophobicContact CG-CG1 4.48Å; Q249-V260 HydrophobicContact CG-CG2 4.2Å
250	G	83.2	Confident	85.7	Confident	24 Å²	24	81.6 Å²	81.6	25%	0.247	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-71.8	171.7	173.5	0	0	0	0	0	112.7	I259	G250-I259 WeakPolarHBondContact CA-O 3.49Å; G250-I259 PolarHBondContact N-O 3.47Å
251	P	82.9	Confident	85.3	Confident	126 Å²	126	86.4 Å²	86.4	82%	0.818	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-62.6	143.3	171.7	28.9	-33.6	0	0	0	110
252	K	84.7	Confident	85	Confident	122 Å²	122	80.9 Å²	80.9	53%	0.53	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-75.5	141.6	174.7	-54.2	-164.4	-178.5	-173.5	0	110.7	N256 D257 Y258	K252-N256 WeakPolarHBondContact CD-OD1 3.43Å; K252-N256 PolarHBondContact NZ-OD1 3.16Å; K252-D257 CarbonylContact C-O 3.48Å; K252-D257 VanDerWaalsContact CA-O 3.3Å; K252-D257 WeakPolarHBondContact CA-O 3.3Å; K252-Y258 HydrophobicContact CD-CD1 4.42Å; K252-Y258 HydrophobicContact CG-CD1 4.25Å
253	D	83.6	Confident	84.8	Confident	83 Å²	83	81.3 Å²	81.3	44%	0.444	41%	0.407	S	S	.	.			trans	-84.2	-172.8	173.8	68.7	14.9	0	0	0	112.6	D255 N256 D257	D253-D255 PolarHBondContact O-N 3.49Å; D253-D255 WeakPolarHBondContact OD1-CA 3.23Å; D253-D255 PolarHBondContact OD1-N 2.92Å; D253-N256 PolarHBondContact O-N 3.33Å; D253-N256 VanDerWaalsContact O-N 3.16Å; D253-N256 PolarHBondContact OD1-N 3.5Å; D253-D257 PolarHBondContact N-O 2.88Å; D253-D257 PolarHBondContact OD1-N 2.85Å
254	E	77.5	Confident	84.8	Confident	203 Å²	203	82.8 Å²	82.8	95%	0.949	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-25	-179.9	-64.1	-174.3	171.5	0	0	112.9	N256	E254-N256 VanDerWaalsContact C-N 3.31Å
255	D	80.3	Confident	85	Confident	147 Å²	147	76.5 Å²	76.5	79%	0.786	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	7.1	177.1	-67.4	-39.5	0	0	0	112.2	D253 D257	D253-D255 PolarHBondContact O-N 3.49Å; D253-D255 WeakPolarHBondContact OD1-CA 3.23Å; D253-D255 PolarHBondContact OD1-N 2.92Å; D255-D257 PolarHBondContact O-N 2.88Å
256	N	76.2	Confident	85.2	Confident	106 Å²	106	76 Å²	76	57%	0.567	39%	0.39	S	S	*	.	S	Bend	trans	62.9	20.5	-177.6	-167.1	55	0	0	0	113.2	K252 D253 E254	K252-N256 WeakPolarHBondContact CD-OD1 3.43Å; K252-N256 PolarHBondContact NZ-OD1 3.16Å; D253-N256 PolarHBondContact O-N 3.33Å; D253-N256 VanDerWaalsContact O-N 3.16Å; D253-N256 PolarHBondContact OD1-N 3.5Å; E254-N256 VanDerWaalsContact C-N 3.31Å
257	D	78.8	Confident	85.5	Confident	75 Å²	75	69.1 Å²	69.1	40%	0.401	36%	0.363	S	S	.	.			trans	-84.3	153.1	170	-167.3	23	0	0	0	110.6	R209 K252 D253 D255	R209-D257 IonicContact NH1-OD1 3.8Å; R209-D257 PolarHBondContact NH1-OD1 3.23Å; K252-D257 CarbonylContact C-O 3.48Å; K252-D257 VanDerWaalsContact CA-O 3.3Å; K252-D257 WeakPolarHBondContact CA-O 3.3Å; D253-D257 PolarHBondContact N-O 2.88Å; D253-D257 PolarHBondContact OD1-N 2.85Å; D255-D257 PolarHBondContact O-N 2.88Å
258	Y	81.4	Confident	85.7	Confident	18 Å²	18	66.2 Å²	66.2	7%	0.071	35%	0.352	C	S	.	.			trans	-153.5	149.1	179.2	61.9	-84.3	0	0	0	111.8	D206 R209 Q249 K252 V260	D206-Y258 PolarHBondContact OD1-OH 3.1Å; D206-Y258 PolarHBondContact OD2-OH 2.97Å; R209-Y258 PolarHBondContact NH1-O 2.64Å; R209-Y258 PolarHBondContact NH2-O 2.87Å; Q249-Y258 HydrophobicContact CB-CD2 4.26Å; Q249-Y258 HydrophobicContact CB-CE2 4.35Å; Q249-Y258 HydrophobicContact CG-CD2 4.36Å; Q249-Y258 HydrophobicContact CG-CE2 3.97Å; K252-Y258 HydrophobicContact CD-CD1 4.42Å; K252-Y258 HydrophobicContact CG-CD1 4.25Å; Y258-V260 HydrophobicContact CD2-CG2 3.84Å; Y258-V260 HydrophobicContact CE2-CG2 3.63Å
259	I	80.9	Confident	86.1	Confident	101 Å²	101	64.2 Å²	64.2	52%	0.518	34%	0.338	S	S	.	.			trans	-95.3	139.7	174.3	-59.5	174.4	0	0	0	108.3	G250	G250-I259 WeakPolarHBondContact CA-O 3.49Å; G250-I259 PolarHBondContact N-O 3.47Å
260	V	82.9	Confident	86.5	Confident	4 Å²	4	60 Å²	60	2%	0.024	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	115.3	171	-167.8	0	0	0	0	108.6	F168 I205 D206 Y247 S248 Q249 Y258 H262	F168-V260 HydrophobicContact CD1-CB 4.4Å; F168-V260 HydrophobicContact CE1-CB 4.17Å; F168-V260 WeakPolarHBondContact CE1-O 3.21Å; F168-V260 HydrophobicContact CZ-CB 4.34Å; I205-V260 HydrophobicContact CD1-CB 3.73Å; I205-V260 HydrophobicContact CD1-CG1 3.27Å; D206-V260 HydrophobicContact CB-CG2 4.43Å; Y247-V260 HydrophobicContact CD2-CG1 4.4Å; S248-V260 WeakPolarHBondContact O-CA 3.49Å; S248-V260 WeakPolarHBondContact O-CG1 3.27Å; Q249-V260 HydrophobicContact CG-CG1 4.48Å; Q249-V260 HydrophobicContact CG-CG2 4.2Å; Y258-V260 HydrophobicContact CD2-CG2 3.84Å; Y258-V260 HydrophobicContact CE2-CG2 3.63Å; V260-H262 PolarHBondContact O-N 3.38Å
261	D	84.3	Confident	87	Confident	102 Å²	102	59.4 Å²	59.4	55%	0.545	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	128.2	169	-72.7	-36.1	0	0	0	107.7	Y247 S248	Y247-D261 CarbonylContact C-O 3.59Å; Y247-D261 WeakPolarHBondContact CA-O 3.1Å; S248-D261 PolarHBondContact N-O 3.23Å; S248-D261 PolarHBondContact O-N 3.34Å
262	H	86.6	Confident	87.4	Confident	27 Å²	27	57.4 Å²	57.4	13%	0.125	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	167.1	174.7	72.9	94.6	0	0	0	113.1	Y165 F166 F168 C175 I205 Y246 V260 I264	Y165-H262 AromaticContact CZ-CE1 3.94Å; Y165-H262 PolarHBondContact OH-CE1 3.1Å; F166-H262 PolarHBondContact O-CE1 3.25Å; F166-H262 PolarHBondContact O-ND1 3.4Å; F168-H262 AromaticContact CD1-CD2 3.89Å; F168-H262 AromaticContact CE1-CD2 3.66Å; F168-H262 AromaticContact CE1-NE2 3.89Å; C175-H262 PolarHBondContact SG-NE2 3.17Å; I205-H262 HydrophobicContact CD1-CB 3.66Å; I205-H262 HydrophobicContact CG1-CB 4.26Å; Y246-H262 WeakPolarHBondContact O-CA 3.44Å; V260-H262 PolarHBondContact O-N 3.38Å; H262-I264 PolarHBondContact O-N 2.89Å
263	T	88.1	Confident	87.7	Confident	34 Å²	34	53.2 Å²	53.2	21%	0.209	28%	0.284	C	S	.	.			trans	-73.2	124.4	178.9	-54	0	0	0	0	110.7	Y246 I265	Y246-T263 PolarHBondContact N-OG1 3.12Å; Y246-T263 VanDerWaalsContact N-OG1 3.09Å; Y246-T263 PolarHBondContact O-N 2.85Å; Y246-T263 PolarHBondContact O-OG1 3Å; Y246-T263 VanDerWaalsContact O-OG1 3.13Å; T263-I265 HydrophobicContact CG2-CB 4.09Å; T263-I265 HydrophobicContact CG2-CD1 3.43Å; T263-I265 VanDerWaalsContact CG2-CD1 3.43Å; T263-I265 HydrophobicContact CG2-CG1 3.63Å; T263-I265 PolarHBondContact O-N 3.26Å
264	I	92.8	Very high	88	Confident	38 Å²	38	55.2 Å²	55.2	20%	0.195	29%	0.291	C	S	.	.			trans	-93.8	73.7	-177.7	-47.5	162.1	0	0	0	109.8	Y165 I174 E178 H262 Q281	Y165-I264 HydrophobicContact CE2-CG2 4.32Å; I174-I264 HydrophobicContact CD1-CD1 3.86Å; I174-I264 HydrophobicContact CG2-CD1 3.62Å; I174-I264 HydrophobicContact CG2-CG1 3.85Å; I174-I264 HydrophobicContact CG2-CG2 3.84Å; E178-I264 HydrophobicContact CG-CG2 3.61Å; H262-I264 PolarHBondContact O-N 2.89Å; I264-Q281 HydrophobicContact CB-CB 4.33Å; I264-Q281 HydrophobicContact CG2-CB 3.81Å; I264-Q281 HydrophobicContact CG2-CG 4.02Å; I264-Q281 PolarHBondContact O-N 3.23Å
265	I	94.4	Very high	88.7	Confident	35 Å²	35	46.9 Å²	46.9	18%	0.179	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	134.8	-176.8	-64	177	0	0	0	110	T263 Y267 Y278 F279	T263-I265 HydrophobicContact CG2-CB 4.09Å; T263-I265 HydrophobicContact CG2-CD1 3.43Å; T263-I265 VanDerWaalsContact CG2-CD1 3.43Å; T263-I265 HydrophobicContact CG2-CG1 3.63Å; T263-I265 PolarHBondContact O-N 3.26Å; I265-Y267 HydrophobicContact CB-CE2 4.06Å; I265-Y267 HydrophobicContact CG2-CD1 4.38Å; I265-Y267 HydrophobicContact CG2-CD2 4.32Å; I265-Y267 HydrophobicContact CG2-CE1 3.97Å; I265-Y267 HydrophobicContact CG2-CE2 3.9Å; I265-Y267 WeakPolarHBondContact O-CE2 3.45Å; I265-Y278 HydrophobicContact CD1-CD2 4.39Å; I265-Y278 HydrophobicContact CG2-CD2 3.93Å; I265-Y278 HydrophobicContact CG2-CG 4.28Å; I265-F279 CarbonylContact C-O 3.57Å; I265-F279 WeakPolarHBondContact CA-O 3.39Å
266	M	96.6	Very high	89.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	137.8	166.7	-56.8	176.3	-175.9	0	0	110.2	L163 I164 Y165 E178 K181 M182 Y278 F279 I288	L163-M266 HydrophobicContact CD1-CB 3.94Å; L163-M266 HydrophobicContact CD2-SD 4.33Å; L163-M266 HydrophobicContact CG-CB 4.43Å; I164-M266 CarbonylContact O-C 3.58Å; I164-M266 WeakPolarHBondContact O-CA 3.44Å; Y165-M266 HydrophobicContact CD2-CG 4.13Å; E178-M266 HydrophobicContact CB-CE 4.09Å; E178-M266 WeakPolarHBondContact O-CE 3.35Å; K181-M266 HydrophobicContact CB-CE 4.35Å; M182-M266 HydrophobicContact CB-CE 3.89Å; M182-M266 HydrophobicContact CB-SD 4.21Å; M182-M266 HydrophobicContact CE-CG 4.11Å; M182-M266 HydrophobicContact CE-SD 4.26Å; M266-Y278 CarbonylContact O-C 3.51Å; M266-Y278 VanDerWaalsContact O-CA 3.26Å; M266-Y278 WeakPolarHBondContact O-CA 3.46Å; M266-F279 HydrophobicContact CB-CB 4.38Å; M266-F279 HydrophobicContact CB-CD2 4.49Å; M266-F279 PolarHBondContact N-O 2.52Å; M266-F279 PolarHBondContact O-N 2.95Å; M266-I288 HydrophobicContact SD-CD1 4.26Å
267	Y	95.9	Very high	90.1	Very high	9 Å²	9	39.3 Å²	39.3	4%	0.035	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.8	-178.5	-58.5	-94.7	0	0	0	110.1	L138 L163 I164 F166 Y243 V245 I265 F275	L138-Y267 HydrophobicContact CD1-CE1 4.49Å; L163-Y267 WeakPolarHBondContact CA-O 3.34Å; I164-Y267 PolarHBondContact N-O 3.02Å; I164-Y267 PolarHBondContact O-N 2.77Å; F166-Y267 AromaticContact CD2-CD2 3.91Å; F166-Y267 HydrophobicContact CD2-CD2 3.91Å; F166-Y267 AromaticContact CD2-CE2 3.69Å; F166-Y267 HydrophobicContact CD2-CE2 3.69Å; F166-Y267 AromaticContact CE2-CD2 3.82Å; F166-Y267 HydrophobicContact CE2-CD2 3.82Å; F166-Y267 AromaticContact CE2-CE2 3.84Å; F166-Y267 HydrophobicContact CE2-CE2 3.84Å; Y243-Y267 AromaticContact CD1-CD1 3.98Å; Y243-Y267 HydrophobicContact CD1-CD1 3.98Å; Y243-Y267 HydrophobicContact CD1-CD2 4.41Å; Y243-Y267 HydrophobicContact CD1-CE1 4.5Å; Y243-Y267 AromaticContact CD1-CG 3.94Å; Y243-Y267 HydrophobicContact CD1-CG 3.94Å; Y243-Y267 HydrophobicContact CE1-CG 4.49Å; V245-Y267 HydrophobicContact CG2-CE2 4.06Å; I265-Y267 HydrophobicContact CB-CE2 4.06Å; I265-Y267 HydrophobicContact CG2-CD1 4.38Å; I265-Y267 HydrophobicContact CG2-CD2 4.32Å; I265-Y267 HydrophobicContact CG2-CE1 3.97Å; I265-Y267 HydrophobicContact CG2-CE2 3.9Å; I265-Y267 WeakPolarHBondContact O-CE2 3.45Å; Y267-F275 HydrophobicContact CD1-CD2 4.36Å; Y267-F275 AromaticContact CD1-CE2 3.81Å; Y267-F275 HydrophobicContact CD1-CE2 3.81Å
268	L	96.4	Very high	90.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.4	173.5	-175.2	67.2	0	0	0	109.6	W161 L198 V276 D277 F279 I292 H295	W161-L268 HydrophobicContact CE3-CD1 3.85Å; W161-L268 HydrophobicContact CE3-CD2 4.28Å; W161-L268 HydrophobicContact CE3-CG 4.07Å; W161-L268 HydrophobicContact CZ3-CD1 4.29Å; W161-L268 HydrophobicContact CZ3-CD2 3.86Å; W161-L268 HydrophobicContact CZ3-CG 4.03Å; L198-L268 HydrophobicContact CD1-CD1 4.12Å; L268-V276 HydrophobicContact CB-CB 4.48Å; L268-V276 HydrophobicContact CD2-CB 4.08Å; L268-V276 HydrophobicContact CD2-CG1 3.91Å; L268-V276 HydrophobicContact CG-CB 4.17Å; L268-V276 PolarHBondContact O-N 3.18Å; L268-D277 HydrophobicContact CB-CB 4.34Å; L268-D277 WeakPolarHBondContact CB-O 3.27Å; L268-D277 HydrophobicContact CD2-CB 4.32Å; L268-D277 PolarHBondContact N-O 3.33Å; L268-D277 PolarHBondContact O-N 2.88Å; L268-F279 HydrophobicContact CB-CE2 4.05Å; L268-I292 HydrophobicContact CD1-CD1 4.11Å; L268-I292 HydrophobicContact CD1-CG1 3.96Å; L268-I292 HydrophobicContact CD1-CG2 4.22Å; L268-I292 HydrophobicContact CD2-CG1 3.93Å; L268-H295 HydrophobicContact CD2-CB 4.31Å
269	V	95.1	Very high	91.5	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.024	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.6	174.6	-175.6	0	0	0	0	109	I162 I164 Y243	I162-V269 HydrophobicContact CB-CB 4.19Å; I162-V269 HydrophobicContact CD1-CB 4.34Å; I162-V269 HydrophobicContact CD1-CG1 4.32Å; I162-V269 PolarHBondContact N-O 2.9Å; I162-V269 PolarHBondContact O-N 3.49Å; I164-V269 HydrophobicContact CD1-CG2 3.73Å; I164-V269 HydrophobicContact CG1-CG2 4.41Å; Y243-V269 HydrophobicContact CE1-CG2 4.17Å
270	G	94.3	Very high	92.1	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.01	20%	0.199	C	C	.	.			trans	-77.3	168.7	179.9	0	0	0	0	0	112.7	D272 G273 E274	G270-D272 PolarHBondContact O-N 3.34Å; G270-G273 PolarHBondContact O-N 3.35Å; G270-E274 PolarHBondContact N-O 2.9Å
271	P	94.3	Very high	92.5	Very high	12 Å²	12	42 Å²	42	8%	0.078	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-12.4	177.7	29.6	-37.3	0	0	0	113.9	G159 R160 W161 G273 Y299	G159-P271 WeakPolarHBondContact CA-O 3.47Å; G159-P271 PolarHBondContact N-O 2.94Å; R160-P271 VanDerWaalsContact O-CA 3.32Å; R160-P271 WeakPolarHBondContact O-CA 3.35Å; W161-P271 HydrophobicContact CZ2-CG 4.49Å; P271-G273 VanDerWaalsContact C-N 3.28Å; P271-Y299 HydrophobicContact CB-CE1 4.47Å; P271-Y299 HydrophobicContact CG-CD1 3.95Å; P271-Y299 HydrophobicContact CG-CD2 4.31Å; P271-Y299 HydrophobicContact CG-CE1 3.37Å; P271-Y299 HydrophobicContact CG-CE2 3.79Å; P271-Y299 HydrophobicContact CG-CG 4.39Å; P271-Y299 WeakPolarHBondContact CG-OH 3.38Å
272	D	91.2	Very high	92.9	Very high	85 Å²	85	43.7 Å²	43.7	46%	0.455	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.9	169.3	51.4	-6.6	0	0	0	113.1	G270 E274	G270-D272 PolarHBondContact O-N 3.34Å; D272-E274 HydrophobicContact CB-CG 4.37Å; D272-E274 PolarHBondContact OD1-N 3.22Å
273	G	90.4	Very high	93.3	Very high	34 Å²	34	46.6 Å²	46.6	35%	0.351	24%	0.242	S	C	.	.	S	Bend	trans	81.3	4.2	-174.3	0	0	0	0	0	113.3	G270 P271	G270-G273 PolarHBondContact O-N 3.35Å; P271-G273 VanDerWaalsContact C-N 3.28Å
274	E	89.6	Confident	93.7	Very high	125 Å²	125	53.8 Å²	53.8	58%	0.584	27%	0.265	S	S	*	.			trans	-90	149	-178.9	-66.6	-68	146.4	0	0	111.3	G270 D272 V276	G270-E274 PolarHBondContact N-O 2.9Å; D272-E274 HydrophobicContact CB-CG 4.37Å; D272-E274 PolarHBondContact OD1-N 3.22Å; E274-V276 PolarHBondContact O-N 3.34Å
275	F	92.5	Very high	93.8	Very high	28 Å²	28	53 Å²	53	12%	0.123	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	130.2	173.5	172.8	-97.2	0	0	0	111.2	L138 Y267 D277 Y278	L138-F275 HydrophobicContact CB-CB 4.17Å; L138-F275 HydrophobicContact CB-CD1 3.98Å; L138-F275 HydrophobicContact CB-CD2 4.01Å; L138-F275 HydrophobicContact CB-CE1 4.44Å; L138-F275 HydrophobicContact CB-CE2 4.46Å; L138-F275 HydrophobicContact CB-CG 3.75Å; L138-F275 HydrophobicContact CD1-CD1 4.25Å; L138-F275 HydrophobicContact CD1-CD2 4.42Å; L138-F275 HydrophobicContact CD1-CE1 3.86Å; L138-F275 HydrophobicContact CD1-CE2 4.05Å; L138-F275 HydrophobicContact CD1-CZ 3.75Å; L138-F275 WeakPolarHBondContact O-CB 3.45Å; Y267-F275 HydrophobicContact CD1-CD2 4.36Å; Y267-F275 AromaticContact CD1-CE2 3.81Å; Y267-F275 HydrophobicContact CD1-CE2 3.81Å; F275-D277 VanDerWaalsContact CE2-C 3.48Å; F275-D277 WeakPolarHBondContact CE2-O 3.48Å; F275-D277 WeakPolarHBondContact CZ-O 3.44Å; F275-Y278 AromaticContact CZ-CD1 3.91Å; F275-Y278 HydrophobicContact CZ-CD1 3.91Å; F275-Y278 HydrophobicContact CZ-CG 4.4Å
276	V	92.6	Very high	93.9	Very high	48 Å²	48	54.3 Å²	54.3	29%	0.291	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-53.2	-177.8	179.8	0	0	0	0	111.8	W161 L268 E274 H295	W161-V276 HydrophobicContact CH2-CG2 4.41Å; W161-V276 HydrophobicContact CZ3-CB 4.46Å; W161-V276 HydrophobicContact CZ3-CG1 4.28Å; W161-V276 HydrophobicContact CZ3-CG2 4.02Å; L268-V276 HydrophobicContact CB-CB 4.48Å; L268-V276 HydrophobicContact CD2-CB 4.08Å; L268-V276 HydrophobicContact CD2-CG1 3.91Å; L268-V276 HydrophobicContact CG-CB 4.17Å; L268-V276 PolarHBondContact O-N 3.18Å; E274-V276 PolarHBondContact O-N 3.34Å; V276-H295 HydrophobicContact CG1-CB 4.08Å
277	D	93.3	Very high	93.8	Very high	46 Å²	46	58.7 Å²	58.7	25%	0.246	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	165.8	-174.1	-149.2	-12.6	0	0	0	111.9	L268 F275 F279 H295	L268-D277 HydrophobicContact CB-CB 4.34Å; L268-D277 WeakPolarHBondContact CB-O 3.27Å; L268-D277 HydrophobicContact CD2-CB 4.32Å; L268-D277 PolarHBondContact N-O 3.33Å; L268-D277 PolarHBondContact O-N 2.88Å; F275-D277 VanDerWaalsContact CE2-C 3.48Å; F275-D277 WeakPolarHBondContact CE2-O 3.48Å; F275-D277 WeakPolarHBondContact CZ-O 3.44Å; D277-F279 HydrophobicContact CB-CZ 4.21Å; D277-H295 IonicContact OD2-CD2 3.67Å; D277-H295 IonicContact OD2-CE1 2.66Å; D277-H295 IonicContact OD2-NE2 2.69Å; D277-H295 PolarHBondContact OD2-NE2 3.5Å
278	Y	94	Very high	93.8	Very high	128 Å²	128	58.3 Å²	58.3	50%	0.502	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	149.2	175.8	71.5	-86.6	0	0	0	111.9	I265 M266 F275	I265-Y278 HydrophobicContact CD1-CD2 4.39Å; I265-Y278 HydrophobicContact CG2-CD2 3.93Å; I265-Y278 HydrophobicContact CG2-CG 4.28Å; M266-Y278 CarbonylContact O-C 3.51Å; M266-Y278 VanDerWaalsContact O-CA 3.26Å; M266-Y278 WeakPolarHBondContact O-CA 3.46Å; F275-Y278 AromaticContact CZ-CD1 3.91Å; F275-Y278 HydrophobicContact CZ-CD1 3.91Å; F275-Y278 HydrophobicContact CZ-CG 4.4Å
279	F	94.9	Very high	93.9	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.039	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.1	-177.2	-50.7	-73	0	0	0	109.8	L163 I265 M266 L268 D277 I288 A291 I292	L163-F279 HydrophobicContact CD1-CD2 4.27Å; L163-F279 HydrophobicContact CD1-CE2 4.38Å; I265-F279 CarbonylContact C-O 3.57Å; I265-F279 WeakPolarHBondContact CA-O 3.39Å; M266-F279 HydrophobicContact CB-CB 4.38Å; M266-F279 HydrophobicContact CB-CD2 4.49Å; M266-F279 PolarHBondContact N-O 2.52Å; M266-F279 PolarHBondContact O-N 2.95Å; L268-F279 HydrophobicContact CB-CE2 4.05Å; D277-F279 HydrophobicContact CB-CZ 4.21Å; F279-I288 HydrophobicContact CB-CD1 4.05Å; F279-I288 HydrophobicContact CB-CG1 3.98Å; F279-I288 HydrophobicContact CD1-CB 4.43Å; F279-I288 HydrophobicContact CD1-CG1 4.03Å; F279-I288 HydrophobicContact CD1-CG2 4.21Å; F279-I288 HydrophobicContact CD2-CG2 3.68Å; F279-I288 HydrophobicContact CE1-CG2 4.35Å; F279-I288 HydrophobicContact CE2-CG2 3.81Å; F279-I288 HydrophobicContact CG-CB 4.41Å; F279-I288 HydrophobicContact CG-CD1 4.45Å; F279-I288 HydrophobicContact CG-CG1 3.94Å; F279-I288 HydrophobicContact CG-CG2 3.87Å; F279-I288 HydrophobicContact CZ-CG2 4.16Å; F279-A291 HydrophobicContact CE1-CB 3.76Å; F279-A291 HydrophobicContact CZ-CB 4.08Å; F279-I292 HydrophobicContact CE2-CD1 4.07Å; F279-I292 HydrophobicContact CE2-CG1 3.86Å; F279-I292 HydrophobicContact CZ-CG1 3.86Å
280	G	93.3	Very high	93.9	Very high	16 Å²	16	60.6 Å²	60.6	17%	0.165	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	168.2	174.5	0	0	0	0	0	112.6	N282 K283	G280-N282 PolarHBondContact O-N 2.84Å; G280-K283 WeakPolarHBondContact O-CB 3.37Å; G280-K283 PolarHBondContact O-N 2.85Å
281	Q	92.4	Very high	94	Very high	100 Å²	100	61.9 Å²	61.9	47%	0.467	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48	-34.2	177.5	-166.4	-176.9	25.1	0	0	114.1	E178 K181 I264 K283	E178-Q281 WeakPolarHBondContact OE1-CG 2.89Å; K181-Q281 PolarHBondContact NZ-O 3.42Å; I264-Q281 HydrophobicContact CB-CB 4.33Å; I264-Q281 HydrophobicContact CG2-CB 3.81Å; I264-Q281 HydrophobicContact CG2-CG 4.02Å; I264-Q281 PolarHBondContact O-N 3.23Å; Q281-K283 PolarHBondContact O-N 3.42Å
282	N	93.3	Very high	94.2	Very high	138 Å²	138	61.3 Å²	61.3	74%	0.738	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-8.5	-177.7	67.5	-22.2	0	0	0	115.1	G280	G280-N282 PolarHBondContact O-N 2.84Å
283	K	94.4	Very high	94.4	Very high	88 Å²	88	57.4 Å²	57.4	38%	0.383	31%	0.307	S	S	.	.	S	Bend	trans	-87.9	136.2	177.5	-65.6	-63.2	-173.7	177.5	0	111.3	K181 G280 Q281 I288	K181-K283 WeakPolarHBondContact CD-O 3.49Å; K181-K283 PolarHBondContact NZ-O 3.29Å; G280-K283 WeakPolarHBondContact O-CB 3.37Å; G280-K283 PolarHBondContact O-N 2.85Å; Q281-K283 PolarHBondContact O-N 3.42Å; K283-I288 HydrophobicContact CB-CD1 3.99Å; K283-I288 HydrophobicContact CB-CG1 3.75Å
284	R	95.9	Very high	94.7	Very high	186 Å²	186	58.4 Å²	58.4	70%	0.702	31%	0.311	S	S	*	.			trans	-83.7	154.7	173.4	-61.5	-172	176.7	104.4	-1.7	111.2	A286 E287 I288	R284-A286 VanDerWaalsContact C-N 3.32Å; R284-A286 PolarHBondContact O-N 3.39Å; R284-E287 HydrophobicContact CB-CG 4.38Å; R284-E287 PolarHBondContact N-OE2 3.44Å; R284-E287 WeakPolarHBondContact O-CB 3.27Å; R284-E287 PolarHBondContact O-N 2.84Å; R284-I288 WeakPolarHBondContact O-CG1 3.49Å; R284-I288 PolarHBondContact O-N 2.82Å; R284-I288 VanDerWaalsContact O-N 3.11Å
285	S	95.5	Very high	95	Very high	21 Å²	21	54.4 Å²	54.4	15%	0.147	29%	0.293	C	S	.	.	H	α-helix	trans	-49.8	-48.7	179.1	40.9	0	0	0	0	112.7	E184 E287 I288 S289	E184-S285 VanDerWaalsContact OE2-CB 3.27Å; E184-S285 WeakPolarHBondContact OE2-CB 3.48Å; E184-S285 PolarHBondContact OE2-OG 3.38Å; S285-E287 VanDerWaalsContact C-N 3.3Å; S285-E287 PolarHBondContact O-N 2.93Å; S285-I288 WeakPolarHBondContact O-CB 3.11Å; S285-I288 PolarHBondContact O-N 3.44Å; S285-I288 VanDerWaalsContact O-N 3.11Å; S285-S289 PolarHBondContact O-N 3.3Å; S285-S289 PolarHBondContact O-OG 2.89Å
286	A	95.3	Very high	95.1	Very high	62 Å²	62	53.1 Å²	53.1	51%	0.512	29%	0.287	S	S	.	.	H	α-helix	trans	-61.2	-31.2	177.8	0	0	0	0	0	114.9	R284 S289 G290	R284-A286 VanDerWaalsContact C-N 3.32Å; R284-A286 PolarHBondContact O-N 3.39Å; A286-S289 WeakPolarHBondContact CA-OG 3.26Å; A286-S289 PolarHBondContact O-OG 3.49Å; A286-G290 PolarHBondContact O-N 3.14Å; A286-G290 VanDerWaalsContact O-N 3.15Å
287	E	94.9	Very high	95.2	Very high	92 Å²	92	56.1 Å²	56.1	43%	0.43	29%	0.293	S	S	.	.	H	α-helix	trans	-73.7	-40.2	176	-62.3	179.9	126.3	0	0	110.7	R284 S285 A291	R284-E287 HydrophobicContact CB-CG 4.38Å; R284-E287 PolarHBondContact N-OE2 3.44Å; R284-E287 WeakPolarHBondContact O-CB 3.27Å; R284-E287 PolarHBondContact O-N 2.84Å; S285-E287 VanDerWaalsContact C-N 3.3Å; S285-E287 PolarHBondContact O-N 2.93Å; E287-A291 WeakPolarHBondContact O-CB 3.43Å; E287-A291 PolarHBondContact O-N 3.23Å
288	I	96.9	Very high	95.2	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-51.5	178.3	-61	171.3	0	0	0	109.7	K181 V185 M266 F279 K283 R284 S285 G290 A291 I292	K181-I288 HydrophobicContact CD-CD1 4.33Å; V185-I288 HydrophobicContact CB-CG2 4.45Å; V185-I288 HydrophobicContact CG1-CG2 3.81Å; V185-I288 HydrophobicContact CG2-CB 3.78Å; V185-I288 HydrophobicContact CG2-CD1 4.37Å; V185-I288 HydrophobicContact CG2-CG2 3.79Å; M266-I288 HydrophobicContact SD-CD1 4.26Å; F279-I288 HydrophobicContact CB-CD1 4.05Å; F279-I288 HydrophobicContact CB-CG1 3.98Å; F279-I288 HydrophobicContact CD1-CB 4.43Å; F279-I288 HydrophobicContact CD1-CG1 4.03Å; F279-I288 HydrophobicContact CD1-CG2 4.21Å; F279-I288 HydrophobicContact CD2-CG2 3.68Å; F279-I288 HydrophobicContact CE1-CG2 4.35Å; F279-I288 HydrophobicContact CE2-CG2 3.81Å; F279-I288 HydrophobicContact CG-CB 4.41Å; F279-I288 HydrophobicContact CG-CD1 4.45Å; F279-I288 HydrophobicContact CG-CG1 3.94Å; F279-I288 HydrophobicContact CG-CG2 3.87Å; F279-I288 HydrophobicContact CZ-CG2 4.16Å; K283-I288 HydrophobicContact CB-CD1 3.99Å; K283-I288 HydrophobicContact CB-CG1 3.75Å; R284-I288 WeakPolarHBondContact O-CG1 3.49Å; R284-I288 PolarHBondContact O-N 2.82Å; R284-I288 VanDerWaalsContact O-N 3.11Å; S285-I288 WeakPolarHBondContact O-CB 3.11Å; S285-I288 PolarHBondContact O-N 3.44Å; S285-I288 VanDerWaalsContact O-N 3.11Å; I288-G290 VanDerWaalsContact C-N 3.32Å; I288-G290 PolarHBondContact O-N 3.42Å; I288-A291 PolarHBondContact O-N 2.89Å; I288-A291 VanDerWaalsContact O-N 3.16Å; I288-I292 HydrophobicContact CG2-CD1 3.69Å; I288-I292 HydrophobicContact CG2-CG1 4.3Å; I288-I292 WeakPolarHBondContact O-CG1 3.38Å; I288-I292 PolarHBondContact O-N 2.74Å
289	S	96.9	Very high	95.2	Very high	13 Å²	13	57 Å²	57	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-40	179.2	67.5	0	0	0	0	111.9	E188 I189 S285 A286 A291 I292 A293	E188-S289 WeakPolarHBondContact OE2-CB 3.15Å; E188-S289 PolarHBondContact OE2-OG 2.96Å; I189-S289 WeakPolarHBondContact CD1-O 3.45Å; S285-S289 PolarHBondContact O-N 3.3Å; S285-S289 PolarHBondContact O-OG 2.89Å; A286-S289 WeakPolarHBondContact CA-OG 3.26Å; A286-S289 PolarHBondContact O-OG 3.49Å; S289-A291 PolarHBondContact O-N 2.99Å; S289-I292 PolarHBondContact O-N 3.06Å; S289-A293 WeakPolarHBondContact O-CB 3.28Å; S289-A293 PolarHBondContact O-N 3.2Å
290	G	96.7	Very high	94.9	Very high	40 Å²	40	61 Å²	61	41%	0.412	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-44	173.8	0	0	0	0	0	112.9	A286 I288 A294	A286-G290 PolarHBondContact O-N 3.14Å; A286-G290 VanDerWaalsContact O-N 3.15Å; I288-G290 VanDerWaalsContact C-N 3.32Å; I288-G290 PolarHBondContact O-N 3.42Å; G290-A294 PolarHBondContact O-N 2.99Å; G290-A294 VanDerWaalsContact O-N 3.11Å
291	A	96.2	Very high	94.8	Very high	28 Å²	28	68.7 Å²	68.7	23%	0.231	34%	0.343	C	S	.	.	H	α-helix	trans	-67	-47.3	176.8	0	0	0	0	0	112	F279 E287 I288 S289 A293 A294 H295	F279-A291 HydrophobicContact CE1-CB 3.76Å; F279-A291 HydrophobicContact CZ-CB 4.08Å; E287-A291 WeakPolarHBondContact O-CB 3.43Å; E287-A291 PolarHBondContact O-N 3.23Å; I288-A291 PolarHBondContact O-N 2.89Å; I288-A291 VanDerWaalsContact O-N 3.16Å; S289-A291 PolarHBondContact O-N 2.99Å; A291-A293 VanDerWaalsContact C-N 3.35Å; A291-A293 PolarHBondContact O-N 2.89Å; A291-A294 WeakPolarHBondContact O-CB 3.38Å; A291-A294 PolarHBondContact O-N 2.95Å; A291-A294 VanDerWaalsContact O-N 3.12Å; A291-H295 PolarHBondContact O-CD2 2.88Å; A291-H295 VanDerWaalsContact O-CD2 3.25Å; A291-H295 PolarHBondContact O-N 3.43Å
292	I	97.2	Very high	94.3	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58.9	-46.5	176.9	-67.5	174	0	0	0	110.5	L163 V185 I189 L198 L268 F279 I288 S289 A294 H295 M296	L163-I292 HydrophobicContact CD1-CD1 4.35Å; L163-I292 HydrophobicContact CD2-CD1 4.18Å; V185-I292 HydrophobicContact CG1-CD1 3.65Å; I189-I292 HydrophobicContact CD1-CB 4.2Å; I189-I292 HydrophobicContact CD1-CG2 3.97Å; I189-I292 HydrophobicContact CG1-CG2 4.21Å; L198-I292 HydrophobicContact CD1-CG2 4.5Å; L198-I292 HydrophobicContact CD2-CD1 3.87Å; L198-I292 HydrophobicContact CD2-CG2 4.44Å; L268-I292 HydrophobicContact CD1-CD1 4.11Å; L268-I292 HydrophobicContact CD1-CG1 3.96Å; L268-I292 HydrophobicContact CD1-CG2 4.22Å; L268-I292 HydrophobicContact CD2-CG1 3.93Å; F279-I292 HydrophobicContact CE2-CD1 4.07Å; F279-I292 HydrophobicContact CE2-CG1 3.86Å; F279-I292 HydrophobicContact CZ-CG1 3.86Å; I288-I292 HydrophobicContact CG2-CD1 3.69Å; I288-I292 HydrophobicContact CG2-CG1 4.3Å; I288-I292 WeakPolarHBondContact O-CG1 3.38Å; I288-I292 PolarHBondContact O-N 2.74Å; S289-I292 PolarHBondContact O-N 3.06Å; I292-A294 VanDerWaalsContact C-N 3.26Å; I292-A294 PolarHBondContact O-N 3.34Å; I292-H295 PolarHBondContact O-N 3.08Å; I292-H295 VanDerWaalsContact O-N 3.13Å; I292-M296 HydrophobicContact CG2-CE 3.6Å; I292-M296 HydrophobicContact CG2-CG 4.27Å; I292-M296 HydrophobicContact CG2-SD 3.87Å; I292-M296 WeakPolarHBondContact O-CG 3.34Å; I292-M296 PolarHBondContact O-N 3.22Å
293	A	97	Very high	93.1	Very high	3 Å²	3	74.4 Å²	74.4	3%	0.025	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-35.6	177.2	0	0	0	0	0	112.5	I189 L195 S289 A291 R297	I189-A293 HydrophobicContact CD1-CB 4.01Å; L195-A293 HydrophobicContact CD1-CB 3.59Å; S289-A293 WeakPolarHBondContact O-CB 3.28Å; S289-A293 PolarHBondContact O-N 3.2Å; A291-A293 VanDerWaalsContact C-N 3.35Å; A291-A293 PolarHBondContact O-N 2.89Å; A293-R297 WeakPolarHBondContact O-CB 3.37Å; A293-R297 VanDerWaalsContact O-CG 3.23Å; A293-R297 WeakPolarHBondContact O-CG 3.43Å; A293-R297 PolarHBondContact O-N 3Å; A293-R297 VanDerWaalsContact O-N 3.12Å
294	A	95.4	Very high	93	Very high	54 Å²	54	73.8 Å²	73.8	45%	0.446	36%	0.362	S	S	.	.	H	α-helix	trans	-66.9	-44.4	173.9	0	0	0	0	0	112	G290 A291 I292 R297 K298	G290-A294 PolarHBondContact O-N 2.99Å; G290-A294 VanDerWaalsContact O-N 3.11Å; A291-A294 WeakPolarHBondContact O-CB 3.38Å; A291-A294 PolarHBondContact O-N 2.95Å; A291-A294 VanDerWaalsContact O-N 3.12Å; I292-A294 VanDerWaalsContact C-N 3.26Å; I292-A294 PolarHBondContact O-N 3.34Å; A294-R297 PolarHBondContact O-N 3.39Å; A294-K298 WeakPolarHBondContact O-CB 3.39Å; A294-K298 PolarHBondContact O-N 3.08Å
295	H	95.3	Very high	92.9	Very high	42 Å²	42	67.8 Å²	67.8	19%	0.194	34%	0.344	C	S	.	.	H	α-helix	trans	-61.4	-46.2	175.7	-72.7	-55.4	0	0	0	112.1	W161 L268 V276 D277 A291 I292 R297 K298 Y299	W161-H295 HydrophobicContact CH2-CB 3.99Å; W161-H295 HydrophobicContact CZ3-CB 4.19Å; L268-H295 HydrophobicContact CD2-CB 4.31Å; V276-H295 HydrophobicContact CG1-CB 4.08Å; D277-H295 IonicContact OD2-CD2 3.67Å; D277-H295 IonicContact OD2-CE1 2.66Å; D277-H295 IonicContact OD2-NE2 2.69Å; D277-H295 PolarHBondContact OD2-NE2 3.5Å; A291-H295 PolarHBondContact O-CD2 2.88Å; A291-H295 VanDerWaalsContact O-CD2 3.25Å; A291-H295 PolarHBondContact O-N 3.43Å; I292-H295 PolarHBondContact O-N 3.08Å; I292-H295 VanDerWaalsContact O-N 3.13Å; H295-R297 PolarHBondContact O-N 3.32Å; H295-K298 WeakPolarHBondContact O-CB 3.34Å; H295-K298 PolarHBondContact O-N 3.48Å; H295-Y299 PolarHBondContact O-N 2.8Å
296	M	95.8	Very high	92.7	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-59.1	-46.2	176.9	-72.6	175.3	168.8	0	0	112.4	W161 I189 L195 P196 L198 I292 K298 Y299 Q300	W161-M296 HydrophobicContact CB-CE 3.55Å; W161-M296 HydrophobicContact CD2-CE 3.85Å; W161-M296 HydrophobicContact CD2-CG 3.78Å; W161-M296 HydrophobicContact CE3-CE 4.39Å; W161-M296 HydrophobicContact CE3-CG 4.26Å; W161-M296 HydrophobicContact CG-CE 3.46Å; W161-M296 VanDerWaalsContact CG-CE 3.46Å; W161-M296 HydrophobicContact CG-CG 4.2Å; W161-M296 HydrophobicContact CH2-CG 4.32Å; W161-M296 HydrophobicContact CZ2-CB 4.32Å; W161-M296 HydrophobicContact CZ2-CG 3.87Å; W161-M296 HydrophobicContact CZ3-CG 4.5Å; I189-M296 HydrophobicContact CG2-CE 4.06Å; I189-M296 HydrophobicContact CG2-SD 4Å; L195-M296 HydrophobicContact CB-SD 4.06Å; L195-M296 HydrophobicContact CD1-SD 4.21Å; L195-M296 HydrophobicContact CD2-CB 3.94Å; L195-M296 HydrophobicContact CG-SD 4.5Å; P196-M296 HydrophobicContact CG-CE 4.3Å; P196-M296 HydrophobicContact CG-CG 4.27Å; P196-M296 HydrophobicContact CG-SD 4.1Å; L198-M296 HydrophobicContact CB-CE 4.29Å; L198-M296 HydrophobicContact CD1-CE 4.06Å; I292-M296 HydrophobicContact CG2-CE 3.6Å; I292-M296 HydrophobicContact CG2-CG 4.27Å; I292-M296 HydrophobicContact CG2-SD 3.87Å; I292-M296 WeakPolarHBondContact O-CG 3.34Å; I292-M296 PolarHBondContact O-N 3.22Å; M296-K298 VanDerWaalsContact C-N 3.33Å; M296-K298 PolarHBondContact O-N 3.08Å; M296-Y299 PolarHBondContact O-N 2.85Å; M296-Q300 WeakPolarHBondContact O-CG 3.49Å; M296-Q300 PolarHBondContact O-N 2.97Å
297	R	95	Very high	92.6	Very high	112 Å²	112	70.9 Å²	70.9	42%	0.423	35%	0.345	S	S	.	.	H	α-helix	trans	-65.4	-36	177	-71.3	174.4	-168.8	128.2	0.2	112.4	L195 A293 A294 H295 K301	L195-R297 HydrophobicContact CD2-CG 3.84Å; A293-R297 WeakPolarHBondContact O-CB 3.37Å; A293-R297 VanDerWaalsContact O-CG 3.23Å; A293-R297 WeakPolarHBondContact O-CG 3.43Å; A293-R297 PolarHBondContact O-N 3Å; A293-R297 VanDerWaalsContact O-N 3.12Å; A294-R297 PolarHBondContact O-N 3.39Å; H295-R297 PolarHBondContact O-N 3.32Å; R297-K301 WeakPolarHBondContact O-CG 3.32Å; R297-K301 PolarHBondContact O-N 3.07Å
298	K	93.3	Very high	92.4	Very high	116 Å²	116	69.6 Å²	69.6	50%	0.504	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-44.5	176.4	-177.7	-179	176.2	-175.2	0	110.7	A294 H295 M296 K301 Q302	A294-K298 WeakPolarHBondContact O-CB 3.39Å; A294-K298 PolarHBondContact O-N 3.08Å; H295-K298 WeakPolarHBondContact O-CB 3.34Å; H295-K298 PolarHBondContact O-N 3.48Å; M296-K298 VanDerWaalsContact C-N 3.33Å; M296-K298 PolarHBondContact O-N 3.08Å; K298-K301 PolarHBondContact O-N 3.09Å; K298-Q302 WeakPolarHBondContact O-CG 3.4Å; K298-Q302 PolarHBondContact O-N 3.4Å
299	Y	92.5	Very high	92.1	Very high	76 Å²	76	74.2 Å²	74.2	30%	0.298	36%	0.362	S	S	.	.	H	α-helix	trans	-60.2	-45.7	175.7	-176.9	-97.3	0	0	0	111.9	W161 P271 H295 M296 K301 Q302 K303	W161-Y299 HydrophobicContact CZ2-CD1 4.33Å; W161-Y299 AromaticContact CZ2-CG 3.99Å; W161-Y299 HydrophobicContact CZ2-CG 3.99Å; P271-Y299 HydrophobicContact CB-CE1 4.47Å; P271-Y299 HydrophobicContact CG-CD1 3.95Å; P271-Y299 HydrophobicContact CG-CD2 4.31Å; P271-Y299 HydrophobicContact CG-CE1 3.37Å; P271-Y299 HydrophobicContact CG-CE2 3.79Å; P271-Y299 HydrophobicContact CG-CG 4.39Å; P271-Y299 WeakPolarHBondContact CG-OH 3.38Å; H295-Y299 PolarHBondContact O-N 2.8Å; M296-Y299 PolarHBondContact O-N 2.85Å; Y299-K301 PolarHBondContact O-N 3.39Å; Y299-Q302 PolarHBondContact O-N 3.05Å; Y299-Q302 VanDerWaalsContact O-N 3.17Å; Y299-K303 PolarHBondContact O-N 3.44Å
300	Q	90.4	Very high	91.8	Very high	93 Å²	93	78.6 Å²	78.6	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-29.1	176.1	-74.6	175.6	-20	0	0	113.9	S194 M296	S194-Q300 PolarHBondContact O-NE2 2.97Å; S194-Q300 VanDerWaalsContact O-NE2 3.1Å; M296-Q300 WeakPolarHBondContact O-CG 3.49Å; M296-Q300 PolarHBondContact O-N 2.97Å
301	K	90.5	Very high	91.4	Very high	177 Å²	177	81.5 Å²	81.5	77%	0.77	38%	0.38	S	S	*	.	H	α-helix	trans	-81.8	-22.1	178	-74.4	176.2	-178.8	-176.6	0	114	R297 K298 Y299	R297-K301 WeakPolarHBondContact O-CG 3.32Å; R297-K301 PolarHBondContact O-N 3.07Å; K298-K301 PolarHBondContact O-N 3.09Å; Y299-K301 PolarHBondContact O-N 3.39Å
302	Q	82.2	Confident	91	Very high	144 Å²	144	86 Å²	86	67%	0.673	39%	0.392	S	S	*	.	H	α-helix	trans	-87.6	-15.3	-178.1	-72.1	177.5	-4.1	0	0	112.5	K298 Y299	K298-Q302 WeakPolarHBondContact O-CG 3.4Å; K298-Q302 PolarHBondContact O-N 3.4Å; Y299-Q302 PolarHBondContact O-N 3.05Å; Y299-Q302 VanDerWaalsContact O-N 3.17Å
303	K	67.8	Low	90.5	Very high	215 Å²	215	93.8 Å²	93.8	94%	0.935	43%	0.427	S	S	*	.			trans	-93.8	0	174.8	-164.9	176.6	-177.5	178	0	110.4	Y299	Y299-K303 PolarHBondContact O-N 3.44Å

Retrieved 303 of 303 residues in 1445.2 ms (Link to these results)

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