A0A3Q0KF71_SCHMA Loading...

rRNA 2'-O-methyltransferase fibrillarin

AlphaFold DB , UniProt , Accession A0A3Q0KF71, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 331 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.5	Very low	41.6	Very low	251 Å²	251	148.6 Å²	148.6	100%	1.236	88%	0.876	S	S	*	*				0	116.8	0	-84.2	163.7	159.7	0	0	108.4
2	K	45.5	Very low	41.5	Very low	199 Å²	199	142.9 Å²	142.9	87%	0.865	87%	0.871	S	S	*	*			trans	-65.8	178.5	168	-104.5	-172.8	178.8	-178	0	109.9
3	P	55.2	Low	40.9	Very low	100 Å²	100	152.3 Å²	152.3	65%	0.649	88%	0.881	S	S	*	*				-143.9	-146.3	-58.9	39.1	-16	0	0	0	110.2
4	E	45.7	Very low	40.9	Very low	175 Å²	175	147 Å²	147	82%	0.818	88%	0.876	S	S	*	*			trans	96.9	149.8	162	-59	-174.7	176.2	0	0	117.4
5	S	41.3	Very low	41	Very low	111 Å²	111	154.3 Å²	154.3	78%	0.776	88%	0.882	S	S	*	*				-176.4	150.9	-56.8	45.2	0	0	0	0	106.6
6	G	41.8	Very low	40.7	Very low	86 Å²	86	149.8 Å²	149.8	89%	0.887	88%	0.879	S	S	*	*			trans	99.7	137.1	166.9	0	0	0	0	0	113.5
7	G	37.8	Very low	40.6	Very low	84 Å²	84	145.2 Å²	145.2	87%	0.866	87%	0.871	S	S	*	*			cis	163.8	149.2	4.9	0	0	0	0	0	107.4
8	G	35.3	Very low	40.9	Very low	71 Å²	71	147.3 Å²	147.3	73%	0.732	87%	0.87	S	S	*	*			trans	140.3	94.3	165.4	0	0	0	0	0	115.3
9	F	36.1	Very low	41	Very low	218 Å²	218	151.6 Å²	151.6	96%	0.956	87%	0.87	S	S	*	*			trans	-134.5	125.5	155.9	-88.7	-83.1	0	0	0	110.1
10	R	37.5	Very low	41.4	Very low	254 Å²	254	151.7 Å²	151.7	96%	0.958	86%	0.862	S	S	*	*			trans	-127	129.7	171.4	-115	-172.6	-177.8	-172.8	2.4	108.6
11	G	33.5	Very low	41.3	Very low	86 Å²	86	150.4 Å²	150.4	89%	0.887	86%	0.863	S	S	*	*			trans	97	113.5	139.2	0	0	0	0	0	117.9
12	G	40.2	Very low	41	Very low	80 Å²	80	146.9 Å²	146.9	83%	0.825	84%	0.841	S	S	*	*			trans	178.3	86.4	163	0	0	0	0	0	113	G14	G12-G14 PolarHBondContact O-N 3.36Å
13	R	34.7	Very low	40.9	Very low	265 Å²	265	141.3 Å²	141.3	100%	1	84%	0.84	S	S	*	*			trans	-66.9	119.8	172.6	-84.8	177.3	169.9	171.3	-3.5	110.5
14	G	39.7	Very low	40.2	Very low	78 Å²	78	140.6 Å²	140.6	80%	0.804	85%	0.851	S	S	*	*			trans	-111.4	119.7	165.3	0	0	0	0	0	110.9	G12	G12-G14 PolarHBondContact O-N 3.36Å
15	R	42.9	Very low	39.8	Very low	257 Å²	257	140.9 Å²	140.9	97%	0.97	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-69.9	128.1	175.5	-106.2	178	170.9	176.6	-3.7	110.1
16	G	35.7	Very low	39.7	Very low	81 Å²	81	144.5 Å²	144.5	84%	0.835	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-75.3	132.6	179	0	0	0	0	0	113.7
17	G	40.1	Very low	39.6	Very low	72 Å²	72	145 Å²	145	74%	0.742	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-97.7	128	159.2	0	0	0	0	0	109.2	R19	G17-R19 PolarHBondContact O-N 2.85Å
18	Q	46.3	Very low	39.6	Very low	184 Å²	184	148.1 Å²	148.1	86%	0.86	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-69.5	118.1	-176	-76.8	152.2	-7	0	0	110.9
19	R	41.2	Very low	39.7	Very low	228 Å²	228	148.3 Å²	148.3	86%	0.86	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-102.5	119.2	166	-72.9	178.4	173.7	-176.7	-5.5	107.6	G17	G17-R19 PolarHBondContact O-N 2.85Å
20	H	50	Low	39.7	Very low	154 Å²	154	144.9 Å²	144.9	71%	0.713	84%	0.839	S	S	*	*			trans	-95.4	115	169.1	-78.7	-73.7	0	0	0	109.8	F22	H20-F22 HydrophobicContact CB-CD2 4.49Å; H20-F22 HydrophobicContact CB-CE2 4.01Å
21	S	39.1	Very low	39.8	Very low	125 Å²	125	139.4 Å²	139.4	87%	0.874	83%	0.829	S	S	*	*			trans	-104.3	115.4	172	-155.8	0	0	0	0	107.4
22	F	41.3	Very low	40.2	Very low	177 Å²	177	139 Å²	139	78%	0.776	81%	0.812	S	S	*	*			trans	-98.7	117.2	177.5	-75.6	-83.5	0	0	0	110	H20	H20-F22 HydrophobicContact CB-CD2 4.49Å; H20-F22 HydrophobicContact CB-CE2 4.01Å
23	G	43	Very low	40	Very low	82 Å²	82	146.9 Å²	146.9	85%	0.845	82%	0.817	S	S	*	*			trans	-147	134.9	168	0	0	0	0	0	110.4
24	G	41.1	Very low	40.1	Very low	85 Å²	85	138 Å²	138	88%	0.876	81%	0.808	S	S	*	*			trans	135.9	90.9	165.3	0	0	0	0	0	115.1
25	E	37.8	Very low	39.9	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	82%	0.815	S	S	*	*			trans	-76.2	170	168	-85.5	168.2	69.4	0	0	113.9
26	K	39.6	Very low	39.6	Very low	188 Å²	188	130 Å²	130	82%	0.817	81%	0.806	S	S	*	*			trans	93.5	135.4	159.4	-59.1	-174	-177.6	-179.7	0	115
27	S	38.7	Very low	39.7	Very low	97 Å²	97	138.5 Å²	138.5	68%	0.678	81%	0.812	S	S	*	*			cis	-173.5	148.3	6.2	-98.2	0	0	0	0	109.2
28	V	38.7	Very low	39.4	Very low	148 Å²	148	139.1 Å²	139.1	90%	0.897	82%	0.819	S	S	*	*			trans	54.7	128.2	138.7	-170	0	0	0	0	120.8
29	G	37	Very low	39.1	Very low	75 Å²	75	134.4 Å²	134.4	77%	0.773	82%	0.82	S	S	*	*			trans	167.2	96.8	157.9	0	0	0	0	0	113.9
30	D	35.7	Very low	38.8	Very low	147 Å²	147	135 Å²	135	79%	0.786	82%	0.822	S	S	*	*			trans	-66.2	147.1	173.1	-164.6	4	0	0	0	111.8
31	D	40.2	Very low	38.2	Very low	139 Å²	139	137.1 Å²	137.1	74%	0.743	83%	0.829	S	S	*	*			trans	171.2	115.2	134.3	-101.8	-49	0	0	0	114.6
32	S	40.5	Very low	38.2	Very low	77 Å²	77	134.7 Å²	134.7	54%	0.538	81%	0.813	S	S	.	*				70.2	113.8	122.3	-68.9	0	0	0	0	123
33	R	37	Very low	38.2	Very low	246 Å²	246	133.8 Å²	133.8	93%	0.928	81%	0.811	S	S	*	*				90.6	130.2	122	-69.5	174.5	-177.5	-175.7	0.3	122.2
34	G	36.3	Very low	38	Very low	79 Å²	79	140.8 Å²	140.8	81%	0.814	81%	0.812	S	S	*	*			trans	106.9	105.2	147.6	0	0	0	0	0	113.7
35	G	36.2	Very low	37.9	Very low	91 Å²	91	140.7 Å²	140.7	94%	0.938	81%	0.811	S	S	*	*				89.9	132.9	71.5	0	0	0	0	0	109.3
36	G	36.6	Very low	38	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	80%	0.802	S	S	*	*			cis	178.9	156.4	-0.2	0	0	0	0	0	108.3
37	R	36.8	Very low	37.9	Very low	258 Å²	258	134.9 Å²	134.9	97%	0.974	80%	0.801	S	S	*	*			trans	35.4	129.6	151.5	-74.1	-180	171.4	174.7	-2.5	122.1
38	G	35.3	Very low	38	Very low	85 Å²	85	141.2 Å²	141.2	88%	0.876	81%	0.811	S	S	*	*				128.5	129.4	112	0	0	0	0	0	117.9
39	G	39	Very low	38.1	Very low	85 Å²	85	138.2 Å²	138.2	88%	0.876	81%	0.809	S	S	*	*			trans	144	90.3	156.6	0	0	0	0	0	116.9
40	R	34.3	Very low	38.3	Very low	241 Å²	241	138 Å²	138	91%	0.909	81%	0.807	S	S	*	*			trans	-92.1	154.6	156.1	-74.8	-176.9	-177.2	-176.5	1	108.9
41	F	38	Very low	38.5	Very low	198 Å²	198	143.5 Å²	143.5	87%	0.868	82%	0.816	S	S	*	*			trans	172.2	106.3	148.6	-112.4	-96.5	0	0	0	105.8
42	S	39.4	Very low	38.4	Very low	75 Å²	75	140.5 Å²	140.5	52%	0.524	82%	0.819	S	S	.	*				91.1	137	70.1	78.9	0	0	0	0	115.1
43	E	41.8	Very low	38.5	Very low	157 Å²	157	140.2 Å²	140.2	73%	0.734	83%	0.828	S	S	*	*			trans	73.7	149.7	152.7	-64.3	156.3	126	0	0	117
44	R	38.8	Very low	38.7	Very low	229 Å²	229	135.6 Å²	135.6	86%	0.864	82%	0.822	S	S	*	*			cis	-175.4	146.7	20	-143.8	172.9	-172.5	-177.2	2.3	109.8
45	G	37.4	Very low	38.9	Very low	83 Å²	83	141.3 Å²	141.3	86%	0.856	82%	0.824	S	S	*	*			trans	60.9	150	143.7	0	0	0	0	0	120.3
46	G	39.9	Very low	38.9	Very low	65 Å²	65	140.9 Å²	140.9	67%	0.67	82%	0.82	S	S	*	*			cis	170.5	156.8	3.8	0	0	0	0	0	111.2
47	F	39.4	Very low	39	Very low	182 Å²	182	141 Å²	141	80%	0.798	82%	0.821	S	S	*	*			trans	67.1	116.5	140.1	-75.8	-86.8	0	0	0	124.5
48	R	40.9	Very low	39	Very low	230 Å²	230	141.4 Å²	141.4	87%	0.868	82%	0.822	S	S	*	*				72.1	130	121.7	-90	-176.6	-173.9	172.1	-2.8	123.6
49	G	39.9	Very low	39.3	Very low	84 Å²	84	141.3 Å²	141.3	87%	0.866	82%	0.822	S	S	*	*			trans	102.7	136.9	136.2	0	0	0	0	0	114.7
50	G	41.3	Very low	39.3	Very low	70 Å²	70	149.5 Å²	149.5	72%	0.722	83%	0.826	S	S	*	*			cis	155.6	152.9	5.1	0	0	0	0	0	109.3
51	R	40.6	Very low	39.6	Very low	263 Å²	263	142 Å²	142	99%	0.992	82%	0.824	S	S	*	*			trans	65.2	143.7	165.7	-70.1	177.4	172.2	174.4	-3.3	117.1
52	G	38	Very low	39.6	Very low	77 Å²	77	145 Å²	145	79%	0.794	83%	0.829	S	S	*	*			cis	145.4	144.8	10.3	0	0	0	0	0	109.2
53	G	41.2	Very low	39.6	Very low	71 Å²	71	144.9 Å²	144.9	73%	0.732	84%	0.84	S	S	*	*			trans	89.5	148.6	166.9	0	0	0	0	0	115.6
54	D	41.6	Very low	39.5	Very low	148 Å²	148	144.1 Å²	144.1	79%	0.791	84%	0.841	S	S	*	*			cis	-167.7	170.4	-7.8	-137.1	-58.6	0	0	0	108.7
55	F	39.8	Very low	39.5	Very low	200 Å²	200	142.2 Å²	142.2	88%	0.877	84%	0.839	S	S	*	*			trans	-52.8	154.1	-171.7	-80.4	-124.9	0	0	0	119.4
56	G	36.3	Very low	39.5	Very low	82 Å²	82	142.2 Å²	142.2	85%	0.845	84%	0.839	S	S	*	*				112.6	132.2	116.3	0	0	0	0	0	120.6
57	G	39.7	Very low	39.4	Very low	78 Å²	78	142.5 Å²	142.5	80%	0.804	84%	0.842	S	S	*	*			trans	109.5	86.9	149.4	0	0	0	0	0	117
58	R	37.5	Very low	39.4	Very low	266 Å²	266	146.2 Å²	146.2	100%	1.004	85%	0.851	S	S	*	*				39.6	116.4	96.9	-88	-174.2	179.8	172.6	1.6	116.7
59	G	40.2	Very low	39.2	Very low	83 Å²	83	138.9 Å²	138.9	86%	0.856	85%	0.847	S	S	*	*			trans	-172.8	105.1	158.5	0	0	0	0	0	112.7
60	R	39.7	Very low	39.2	Very low	258 Å²	258	146.8 Å²	146.8	97%	0.974	85%	0.851	S	S	*	*			trans	-81.2	150.4	174.4	-74	176.9	170.1	177.7	-3.1	110.7
61	G	40.8	Very low	39	Very low	83 Å²	83	147.5 Å²	147.5	86%	0.856	86%	0.858	S	S	*	*			trans	-156.4	104.9	161.9	0	0	0	0	0	112.2
62	R	36.9	Very low	38.8	Very low	261 Å²	261	138.4 Å²	138.4	99%	0.985	85%	0.846	S	S	*	*			trans	-93.3	150.5	166.6	-99.6	-175.5	175.7	-172.8	-1.6	108.9
63	G	40.4	Very low	38.6	Very low	73 Å²	73	144.1 Å²	144.1	75%	0.753	85%	0.849	S	S	*	*			trans	159.6	102.7	167.7	0	0	0	0	0	108
64	D	40.1	Very low	38.4	Very low	140 Å²	140	147.8 Å²	147.8	75%	0.749	85%	0.853	S	S	*	*			cis	89.2	130.1	44.3	-144.6	17.1	0	0	0	114.2
65	F	38.3	Very low	38.1	Very low	189 Å²	189	152.3 Å²	152.3	83%	0.829	86%	0.858	S	S	*	*			trans	54.5	122.4	168.1	-73.6	-80.2	0	0	0	123.8
66	G	36.3	Very low	37.7	Very low	83 Å²	83	145.8 Å²	145.8	86%	0.856	85%	0.848	S	S	*	*				115.8	127.1	110.7	0	0	0	0	0	119.1
67	G	39.1	Very low	37.8	Very low	72 Å²	72	148.5 Å²	148.5	74%	0.742	85%	0.848	S	S	*	*			trans	133.6	84.1	154.9	0	0	0	0	0	115.3
68	R	38	Very low	37.7	Very low	260 Å²	260	152.8 Å²	152.8	98%	0.981	85%	0.852	S	S	*	*				62	116	101.1	-84.3	-176.1	174.7	170	-0.4	115.9
69	G	38	Very low	37.7	Very low	76 Å²	76	151.6 Å²	151.6	78%	0.784	85%	0.847	S	S	*	*			trans	152.2	97.8	139.8	0	0	0	0	0	118.9
70	R	39.4	Very low	37.6	Very low	250 Å²	250	151.2 Å²	151.2	94%	0.943	84%	0.843	S	S	*	*				88.4	109.2	121.8	-136.6	178.8	-162.6	-173.4	3.8	120.1
71	G	37.3	Very low	37.4	Very low	85 Å²	85	149.4 Å²	149.4	88%	0.876	84%	0.837	S	S	*	*			trans	75.4	143.3	144.7	0	0	0	0	0	115.8
72	G	36.8	Very low	37.1	Very low	72 Å²	72	148.5 Å²	148.5	74%	0.742	83%	0.827	S	S	*	*			cis	-178.6	169.9	12.8	0	0	0	0	0	108.4
73	F	34	Very low	37.1	Very low	196 Å²	196	140 Å²	140	86%	0.86	82%	0.82	S	S	*	*			trans	-55.9	159.4	-170.8	-72.2	-107	0	0	0	116.1
74	N	35.4	Very low	37.2	Very low	149 Å²	149	145.6 Å²	145.6	80%	0.797	82%	0.819	S	S	*	*			trans	79.7	117.8	155.9	-65.1	-29.1	0	0	0	118.4
75	R	35.9	Very low	37.3	Very low	242 Å²	242	141.9 Å²	141.9	91%	0.913	81%	0.813	S	S	*	*				143.4	127.7	106.2	-159.9	174.5	-104.3	174.6	-7.1	109.6	T77	R75-T77 PolarHBondContact O-N 3.04Å
76	G	32.5	Very low	37.9	Very low	64 Å²	64	134.7 Å²	134.7	66%	0.66	79%	0.793	S	S	*	*			trans	-45	129.3	-165.8	0	0	0	0	0	115.8	L78	G76-L78 PolarHBondContact O-N 3.31Å
77	T	37.4	Very low	38.8	Very low	139 Å²	139	131.9 Å²	131.9	85%	0.853	76%	0.758	S	S	*	*			trans	-66	102.3	161.3	47.4	0	0	0	0	108	R75 R79	R75-T77 PolarHBondContact O-N 3.04Å; T77-R79 PolarHBondContact O-N 3.03Å; T77-R79 VanDerWaalsContact O-N 3.1Å
78	L	37.4	Very low	39.8	Very low	168 Å²	168	136.2 Å²	136.2	88%	0.88	75%	0.752	S	S	*	*			trans	-48.3	117.1	169	-86.4	98.6	0	0	0	109.1	G76 G80	G76-L78 PolarHBondContact O-N 3.31Å; L78-G80 PolarHBondContact O-N 3.37Å; L78-G80 VanDerWaalsContact O-N 3.12Å
79	R	38.8	Very low	41.1	Very low	241 Å²	241	127.6 Å²	127.6	91%	0.909	74%	0.744	S	S	*	*			trans	-43.3	119.9	163.1	-86.2	179.9	167.2	171.8	-3.7	108.8	T77 R81	T77-R79 PolarHBondContact O-N 3.03Å; T77-R79 VanDerWaalsContact O-N 3.1Å; R79-R81 PolarHBondContact O-N 3Å; R79-R81 VanDerWaalsContact O-N 3.07Å
80	G	37.2	Very low	42.5	Very low	75 Å²	75	128.1 Å²	128.1	77%	0.773	75%	0.75	S	S	*	*			trans	-42.5	116.3	174.6	0	0	0	0	0	110.6	L78 G82	L78-G80 PolarHBondContact O-N 3.37Å; L78-G80 VanDerWaalsContact O-N 3.12Å; G80-G82 VanDerWaalsContact C-N 3.25Å; G80-G82 PolarHBondContact O-N 3.3Å
81	R	35.4	Very low	44.1	Very low	220 Å²	220	120.8 Å²	120.8	83%	0.83	73%	0.725	S	S	*	*			trans	-61.6	83.7	176.6	-178.3	178	176.5	171.3	-2.7	108.9	R79	R79-R81 PolarHBondContact O-N 3Å; R79-R81 VanDerWaalsContact O-N 3.07Å
82	G	35.4	Very low	46.1	Very low	63 Å²	63	127 Å²	127	65%	0.649	73%	0.727	S	S	*	*			trans	-57	137.4	169.8	0	0	0	0	0	110.8	G80 R84	G80-G82 VanDerWaalsContact C-N 3.25Å; G80-G82 PolarHBondContact O-N 3.3Å; G82-R84 PolarHBondContact O-N 3.33Å
83	G	36.7	Very low	48.4	Very low	82 Å²	82	125.1 Å²	125.1	85%	0.845	70%	0.701	S	S	*	*			trans	-42.4	118.2	-171.6	0	0	0	0	0	114.5	G85	G83-G85 PolarHBondContact O-N 3.43Å; G83-G85 VanDerWaalsContact O-N 3.16Å
84	R	41.6	Very low	50.9	Low	191 Å²	191	120.8 Å²	120.8	72%	0.721	69%	0.687	S	S	*	*			trans	-86.4	37.8	-175.2	-158.5	-177.7	-176.7	174.9	1.4	112.4	G82	G82-R84 PolarHBondContact O-N 3.33Å
85	G	43.1	Very low	53.5	Low	62 Å²	62	115.6 Å²	115.6	64%	0.639	66%	0.659	S	S	*	*			trans	-129.1	54.4	-170.2	0	0	0	0	0	113.9	G83	G83-G85 PolarHBondContact O-N 3.43Å; G83-G85 VanDerWaalsContact O-N 3.16Å
86	G	50.5	Low	56.1	Low	39 Å²	39	107.2 Å²	107.2	40%	0.402	63%	0.63	S	S	.	*	S	Bend	trans	-147.6	149.4	170	0	0	0	0	0	111	R88	G86-R88 PolarHBondContact O-N 3.19Å
87	M	55.6	Low	58.9	Low	24 Å²	24	109.2 Å²	109.2	12%	0.118	63%	0.631	C	S	.	*			trans	-51.1	97.5	179.7	-168	146	100.1	0	0	112.5	V93 E110 K128 I130	M87-V93 HydrophobicContact CE-CG1 3.98Å; M87-V93 HydrophobicContact SD-CG1 4.03Å; M87-E110 PolarHBondContact N-OE2 3.46Å; M87-K128 VanDerWaalsContact O-CE 3.31Å; M87-K128 WeakPolarHBondContact O-CE 3.24Å; M87-K128 PolarHBondContact O-NZ 2.87Å; M87-I130 HydrophobicContact CE-CD1 4.21Å
88	R	59.3	Low	61.5	Low	162 Å²	162	104.8 Å²	104.8	61%	0.611	60%	0.601	S	S	*	*			trans	-62.8	138.9	172.8	-70.2	-176.2	177	-167.1	-6.4	109.3	G86	G86-R88 PolarHBondContact O-N 3.19Å
89	G	64.7	Low	64	Low	79 Å²	79	102.6 Å²	102.6	81%	0.814	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	151.4	173.7	0	0	0	0	0	111.9
90	G	68.4	Low	66.4	Low	88 Å²	88	91.8 Å²	91.8	91%	0.907	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	2	179.8	0	0	0	0	0	115.9
91	K	73.4	Confident	68.8	Low	96 Å²	96	93 Å²	93	42%	0.417	53%	0.526	S	S	.	.			trans	-82.2	135.2	170.9	-68.5	-179	-178.4	176.3	0	110.4
92	K	78.9	Confident	71.3	Confident	214 Å²	214	83.6 Å²	83.6	93%	0.93	50%	0.497	S	S	*	.			trans	-67.6	137.2	168.6	-62	-172.9	178.3	-172.5	0	109.3
93	V	84.7	Confident	74	Confident	33 Å²	33	80.7 Å²	80.7	20%	0.2	47%	0.467	C	S	.	.			trans	-133.2	147.7	177.5	-67.7	0	0	0	0	108.5	M87 A106 K107 I130	M87-V93 HydrophobicContact CE-CG1 3.98Å; M87-V93 HydrophobicContact SD-CG1 4.03Å; V93-A106 HydrophobicContact CB-CB 4.46Å; V93-A106 HydrophobicContact CG2-CB 4.38Å; V93-K107 WeakPolarHBondContact CA-O 3.42Å; V93-I130 HydrophobicContact CG2-CD1 3.97Å; V93-I130 HydrophobicContact CG2-CG1 4.18Å; V93-I130 HydrophobicContact CG2-CG2 3.6Å
94	L	87.1	Confident	76.7	Confident	105 Å²	105	79 Å²	79	55%	0.55	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.2	173.8	-174	89.5	0	0	0	108	E96 A106 K107	L94-E96 HydrophobicContact CD2-CG 3.79Å; L94-E96 VanDerWaalsContact CD2-OE1 3.3Å; L94-E96 WeakPolarHBondContact CD2-OE1 3.07Å; L94-E96 HydrophobicContact CG-CG 4.43Å; L94-A106 CarbonylContact O-C 3.54Å; L94-A106 WeakPolarHBondContact O-CA 3.43Å; L94-K107 HydrophobicContact CB-CB 4.43Å; L94-K107 PolarHBondContact N-O 3.42Å; L94-K107 PolarHBondContact O-N 2.83Å
95	I	89.4	Confident	79.2	Confident	41 Å²	41	71.3 Å²	71.3	21%	0.21	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	120.2	176.9	-57	-174.3	0	0	0	108.5	F104 I130 V132 Y142	I95-F104 HydrophobicContact CG2-CB 3.77Å; I95-F104 HydrophobicContact CG2-CD1 4.29Å; I95-F104 HydrophobicContact CG2-CG 4.27Å; I95-I130 HydrophobicContact CD1-CG2 4.03Å; I95-V132 HydrophobicContact CD1-CG2 3.5Å; I95-V132 VanDerWaalsContact CD1-CG2 3.5Å; I95-V132 HydrophobicContact CG1-CG2 4.36Å; I95-Y142 HydrophobicContact CD1-CD1 4.29Å; I95-Y142 HydrophobicContact CD1-CD2 3.2Å; I95-Y142 HydrophobicContact CD1-CE1 4.44Å; I95-Y142 HydrophobicContact CD1-CE2 3.39Å; I95-Y142 HydrophobicContact CD1-CG 3.68Å; I95-Y142 HydrophobicContact CG2-CD1 4.5Å; I95-Y142 HydrophobicContact CG2-CE1 4.12Å; I95-Y142 HydrophobicContact CG2-CE2 4.5Å
96	E	91	Very high	81.5	Confident	65 Å²	65	68.3 Å²	68.3	30%	0.304	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	145.8	175.3	-69.7	-177.2	-166.6	0	0	110.7	L94 F104 V105 K107	L94-E96 HydrophobicContact CD2-CG 3.79Å; L94-E96 VanDerWaalsContact CD2-OE1 3.3Å; L94-E96 WeakPolarHBondContact CD2-OE1 3.07Å; L94-E96 HydrophobicContact CG-CG 4.43Å; E96-F104 CarbonylContact O-C 3.52Å; E96-F104 WeakPolarHBondContact O-CA 3.45Å; E96-F104 WeakPolarHBondContact O-CB 3.38Å; E96-V105 PolarHBondContact N-O 2.92Å; E96-V105 PolarHBondContact O-N 3.17Å; E96-K107 VanDerWaalsContact CD-CE 3.41Å; E96-K107 WeakPolarHBondContact OE1-CD 3.36Å; E96-K107 WeakPolarHBondContact OE1-CE 3.41Å; E96-K107 IonicContact OE1-NZ 3.52Å; E96-K107 PolarHBondContact OE1-NZ 3.41Å; E96-K107 WeakPolarHBondContact OE2-CE 3.39Å; E96-K107 IonicContact OE2-NZ 3.03Å; E96-K107 PolarHBondContact OE2-NZ 3.17Å
97	P	91.5	Very high	83.3	Confident	106 Å²	106	70.5 Å²	70.5	69%	0.688	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	138.3	172.6	28.3	-33.7	0	0	0	110.9	F104	P97-F104 HydrophobicContact CB-CD1 4.3Å; P97-F104 HydrophobicContact CB-CE1 4.49Å
98	H	91.3	Very high	84.6	Confident	46 Å²	46	71.3 Å²	71.3	21%	0.213	39%	0.393	C	S	.	.			trans	-81.8	168.3	171.6	-170.7	-103.6	0	0	0	110.4	H100 I103 V105	H98-H100 AromaticContact CE1-CD2 3.35Å; H98-H100 PolarHBondContact CE1-CD2 3.28Å; H98-H100 AromaticContact ND1-CD2 3.43Å; H98-H100 PolarHBondContact ND1-CD2 3.26Å; H98-H100 AromaticContact ND1-CG 3.8Å; H98-H100 PolarHBondContact ND1-N 3.17Å; H98-H100 PolarHBondContact O-N 3.1Å; H98-H100 VanDerWaalsContact O-N 3.14Å; H98-I103 HydrophobicContact CB-CB 4.18Å; H98-I103 HydrophobicContact CB-CG2 4.1Å; H98-I103 WeakPolarHBondContact CB-O 3.28Å; H98-I103 PolarHBondContact N-O 2.68Å; H98-V105 HydrophobicContact CB-CG2 4.15Å
99	R	89.2	Confident	85.5	Confident	122 Å²	122	72.3 Å²	72.3	46%	0.46	40%	0.402	S	S	.	.	S	Bend	trans	-59.6	-20.3	172.1	58.7	171.1	170	154.2	14.6	114.2	I156 G159 L160 D161	R99-I156 PolarHBondContact NH2-O 3.45Å; R99-G159 PolarHBondContact NH1-O 2.97Å; R99-G159 PolarHBondContact NH2-O 3.44Å; R99-G159 VanDerWaalsContact NH2-O 3.12Å; R99-L160 PolarHBondContact NH1-O 2.93Å; R99-L160 PolarHBondContact NH2-O 2.86Å; R99-D161 IonicContact NH1-OD1 3.43Å; R99-D161 PolarHBondContact NH1-OD1 2.8Å
100	H	89	Confident	86.4	Confident	15 Å²	15	72.8 Å²	72.8	7%	0.069	38%	0.383	C	S	.	.	S	Bend	trans	-97.9	127.7	179	-67.2	-53.1	0	0	0	108.9	H98 I103 L160 D161 I163	H98-H100 AromaticContact CE1-CD2 3.35Å; H98-H100 PolarHBondContact CE1-CD2 3.28Å; H98-H100 AromaticContact ND1-CD2 3.43Å; H98-H100 PolarHBondContact ND1-CD2 3.26Å; H98-H100 AromaticContact ND1-CG 3.8Å; H98-H100 PolarHBondContact ND1-N 3.17Å; H98-H100 PolarHBondContact O-N 3.1Å; H98-H100 VanDerWaalsContact O-N 3.14Å; H100-I103 HydrophobicContact CB-CB 4.37Å; H100-I103 HydrophobicContact CB-CD1 3.95Å; H100-I103 HydrophobicContact CB-CG1 4.32Å; H100-I103 PolarHBondContact O-N 2.77Å; H100-L160 PolarHBondContact CE1-O 2.72Å; H100-L160 PolarHBondContact NE2-O 2.71Å; H100-D161 PolarHBondContact CE1-O 3.26Å; H100-D161 VanDerWaalsContact CE1-O 3.22Å; H100-I163 HydrophobicContact CB-CD1 4.03Å; H100-I163 HydrophobicContact CB-CG1 4.47Å
101	E	89.3	Confident	87.3	Confident	101 Å²	101	73.7 Å²	73.7	47%	0.472	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	136.1	178.4	-63.7	167.2	-150.5	0	0	110.9	I103 K166 P167	E101-I103 VanDerWaalsContact C-N 3.27Å; E101-I103 PolarHBondContact O-N 3.14Å; E101-K166 IonicContact OE1-NZ 2.71Å; E101-K166 PolarHBondContact OE1-NZ 3.5Å; E101-K166 WeakPolarHBondContact OE2-CD 3.26Å; E101-K166 IonicContact OE2-NZ 2.72Å; E101-P167 HydrophobicContact CB-CG 4.26Å
102	G	87.3	Confident	88.1	Confident	21 Å²	21	70.3 Å²	70.3	22%	0.216	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-2.9	-179.6	0	0	0	0	0	115.5
103	I	92.2	Very high	88.8	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	141	178.1	-54.2	-177.3	0	0	0	109.7	H98 H100 E101 L113 W145 I156 I163 V188	H98-I103 HydrophobicContact CB-CB 4.18Å; H98-I103 HydrophobicContact CB-CG2 4.1Å; H98-I103 WeakPolarHBondContact CB-O 3.28Å; H98-I103 PolarHBondContact N-O 2.68Å; H100-I103 HydrophobicContact CB-CB 4.37Å; H100-I103 HydrophobicContact CB-CD1 3.95Å; H100-I103 HydrophobicContact CB-CG1 4.32Å; H100-I103 PolarHBondContact O-N 2.77Å; E101-I103 VanDerWaalsContact C-N 3.27Å; E101-I103 PolarHBondContact O-N 3.14Å; I103-L113 HydrophobicContact CG2-CD1 3.44Å; I103-L113 VanDerWaalsContact CG2-CD1 3.44Å; I103-L113 HydrophobicContact CG2-CD2 4.27Å; I103-L113 HydrophobicContact CG2-CG 3.85Å; I103-W145 HydrophobicContact CD1-CZ3 3.98Å; I103-W145 HydrophobicContact CG1-CZ3 4.44Å; I103-I156 HydrophobicContact CD1-CD1 3.5Å; I103-I156 VanDerWaalsContact CD1-CD1 3.5Å; I103-I156 HydrophobicContact CD1-CG1 4.41Å; I103-I163 HydrophobicContact CD1-CD1 3.69Å; I103-V188 HydrophobicContact CD1-CG2 4.25Å; I103-V188 HydrophobicContact CG1-CG1 4.2Å; I103-V188 HydrophobicContact CG1-CG2 3.68Å
104	F	93.1	Very high	89.2	Confident	46 Å²	46	59.2 Å²	59.2	20%	0.202	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	160.3	-178.6	-52.2	-96.5	0	0	0	110.2	I95 E96 P97 V114 K116 Y142	I95-F104 HydrophobicContact CG2-CB 3.77Å; I95-F104 HydrophobicContact CG2-CD1 4.29Å; I95-F104 HydrophobicContact CG2-CG 4.27Å; E96-F104 CarbonylContact O-C 3.52Å; E96-F104 WeakPolarHBondContact O-CA 3.45Å; E96-F104 WeakPolarHBondContact O-CB 3.38Å; P97-F104 HydrophobicContact CB-CD1 4.3Å; P97-F104 HydrophobicContact CB-CE1 4.49Å; F104-V114 HydrophobicContact CB-CG2 3.76Å; F104-V114 PolarHBondContact N-O 3.11Å; F104-V114 VanDerWaalsContact O-CG2 3.28Å; F104-V114 WeakPolarHBondContact O-CG2 3.46Å; F104-V114 PolarHBondContact O-N 3.45Å; F104-V114 VanDerWaalsContact O-O 3.09Å; F104-K116 HydrophobicContact CE2-CB 4.23Å; F104-Y142 HydrophobicContact CB-CE1 4.4Å; F104-Y142 HydrophobicContact CD1-CE1 4.42Å; F104-Y142 HydrophobicContact CD2-CD1 4.2Å; F104-Y142 AromaticContact CD2-CE1 3.68Å; F104-Y142 HydrophobicContact CD2-CE1 3.68Å; F104-Y142 HydrophobicContact CE2-CE1 4Å; F104-Y142 AromaticContact CG-CE1 3.93Å; F104-Y142 HydrophobicContact CG-CE1 3.93Å; F104-Y142 HydrophobicContact CZ-CE1 4.49Å
105	V	93.3	Very high	89.5	Confident	30 Å²	30	54.2 Å²	54.2	18%	0.182	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.8	174.3	-178.5	0	0	0	0	108.2	E96 H98 K107 D111 C112 L113	E96-V105 PolarHBondContact N-O 2.92Å; E96-V105 PolarHBondContact O-N 3.17Å; H98-V105 HydrophobicContact CB-CG2 4.15Å; V105-K107 HydrophobicContact CG1-CG 4.4Å; V105-K107 PolarHBondContact O-N 2.95Å; V105-D111 HydrophobicContact CG1-CB 4.27Å; V105-C112 WeakPolarHBondContact CA-O 3.41Å; V105-L113 HydrophobicContact CG2-CD1 4.3Å
106	A	91.6	Very high	89.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	104.7	170.8	0	0	0	0	0	108.6	V93 L94 D111 C112 V114 I130	V93-A106 HydrophobicContact CB-CB 4.46Å; V93-A106 HydrophobicContact CG2-CB 4.38Å; L94-A106 CarbonylContact O-C 3.54Å; L94-A106 WeakPolarHBondContact O-CA 3.43Å; A106-D111 WeakPolarHBondContact O-CA 3.46Å; A106-C112 PolarHBondContact N-O 3.31Å; A106-C112 PolarHBondContact O-N 2.9Å; A106-V114 HydrophobicContact CB-CG1 3.91Å; A106-V114 HydrophobicContact CB-CG2 4.07Å; A106-I130 HydrophobicContact CB-CD1 3.73Å
107	K	88.7	Confident	89.7	Confident	84 Å²	84	54.4 Å²	54.4	37%	0.365	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	132.3	174.9	-70.3	-171.4	179.3	168	0	110.9	V93 L94 E96 V105 D111	V93-K107 WeakPolarHBondContact CA-O 3.42Å; L94-K107 HydrophobicContact CB-CB 4.43Å; L94-K107 PolarHBondContact N-O 3.42Å; L94-K107 PolarHBondContact O-N 2.83Å; E96-K107 VanDerWaalsContact CD-CE 3.41Å; E96-K107 WeakPolarHBondContact OE1-CD 3.36Å; E96-K107 WeakPolarHBondContact OE1-CE 3.41Å; E96-K107 IonicContact OE1-NZ 3.52Å; E96-K107 PolarHBondContact OE1-NZ 3.41Å; E96-K107 WeakPolarHBondContact OE2-CE 3.39Å; E96-K107 IonicContact OE2-NZ 3.03Å; E96-K107 PolarHBondContact OE2-NZ 3.17Å; V105-K107 HydrophobicContact CG1-CG 4.4Å; V105-K107 PolarHBondContact O-N 2.95Å; K107-D111 WeakPolarHBondContact CA-OD1 3.25Å
108	G	83.1	Confident	89.5	Confident	42 Å²	42	52.1 Å²	52.1	43%	0.433	26%	0.261	S	S	.	.	S	Bend	trans	-158.6	-141	-177.6	0	0	0	0	0	111.7	E110 D111	G108-E110 VanDerWaalsContact C-N 3.31Å; G108-D111 PolarHBondContact N-OD1 3.09Å
109	K	79.3	Confident	89.3	Confident	183 Å²	183	51.4 Å²	51.4	80%	0.796	26%	0.26	S	S	*	.	S	Bend	trans	-74.4	-29.3	166.6	-67	-161.4	179.5	-165.2	0	112.1
110	E	82.4	Confident	89.1	Confident	89 Å²	89	49.7 Å²	49.7	42%	0.416	26%	0.263	S	S	.	.	S	Bend	trans	-132.5	122.3	176.8	-70.3	164.9	-171.4	0	0	104.9	M87 G108	M87-E110 PolarHBondContact N-OE2 3.46Å; G108-E110 VanDerWaalsContact C-N 3.31Å
111	D	88.2	Confident	88.8	Confident	107 Å²	107	51.5 Å²	51.5	57%	0.572	29%	0.286	S	S	*	.			trans	-74.4	134.3	178.8	-66.4	-13.1	0	0	0	109.4	V105 A106 K107 G108	V105-D111 HydrophobicContact CG1-CB 4.27Å; A106-D111 WeakPolarHBondContact O-CA 3.46Å; K107-D111 WeakPolarHBondContact CA-OD1 3.25Å; G108-D111 PolarHBondContact N-OD1 3.09Å
112	C	89.6	Confident	88.6	Confident	25 Å²	25	49.2 Å²	49.2	17%	0.169	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.2	-177.5	-66.1	0	0	0	0	110.5	V105 A106 V144	V105-C112 WeakPolarHBondContact CA-O 3.41Å; A106-C112 PolarHBondContact N-O 3.31Å; A106-C112 PolarHBondContact O-N 2.9Å; C112-V144 HydrophobicContact CB-CG1 4.26Å
113	L	93.1	Very high	88.5	Confident	14 Å²	14	50.5 Å²	50.5	7%	0.073	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	135.5	169.2	-161.8	70.7	0	0	0	109.3	I103 V105 W145 A153 I156	I103-L113 HydrophobicContact CG2-CD1 3.44Å; I103-L113 VanDerWaalsContact CG2-CD1 3.44Å; I103-L113 HydrophobicContact CG2-CD2 4.27Å; I103-L113 HydrophobicContact CG2-CG 3.85Å; V105-L113 HydrophobicContact CG2-CD1 4.3Å; L113-W145 HydrophobicContact CB-CB 4.3Å; L113-W145 HydrophobicContact CD2-CB 4.3Å; L113-W145 HydrophobicContact CD2-CD2 4.16Å; L113-W145 HydrophobicContact CD2-CE3 3.7Å; L113-W145 HydrophobicContact CD2-CG 4.42Å; L113-W145 HydrophobicContact CG-CB 4.43Å; L113-W145 HydrophobicContact CG-CE3 4.38Å; L113-W145 PolarHBondContact O-N 3.3Å; L113-A153 HydrophobicContact CD2-CB 4.12Å; L113-I156 HydrophobicContact CD1-CG2 4.12Å; L113-I156 HydrophobicContact CD2-CB 4.29Å; L113-I156 HydrophobicContact CD2-CD1 4.27Å; L113-I156 HydrophobicContact CD2-CG2 4.01Å
114	V	93.7	Very high	88.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147.8	-177.5	-71.1	0	0	0	0	112	F104 A106 I130 Y142 R143 V144	F104-V114 HydrophobicContact CB-CG2 3.76Å; F104-V114 PolarHBondContact N-O 3.11Å; F104-V114 VanDerWaalsContact O-CG2 3.28Å; F104-V114 WeakPolarHBondContact O-CG2 3.46Å; F104-V114 PolarHBondContact O-N 3.45Å; F104-V114 VanDerWaalsContact O-O 3.09Å; A106-V114 HydrophobicContact CB-CG1 3.91Å; A106-V114 HydrophobicContact CB-CG2 4.07Å; V114-I130 HydrophobicContact CG1-CD1 3.85Å; V114-Y142 HydrophobicContact CG2-CD1 4.46Å; V114-R143 CarbonylContact C-O 3.56Å; V114-R143 WeakPolarHBondContact CA-O 3.43Å; V114-V144 HydrophobicContact CG1-CG2 4.06Å
115	T	93.5	Very high	87.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	147.6	173.4	56.8	0	0	0	0	110	N117 Y142 R143 W145 H184 D187 V188	T115-N117 PolarHBondContact O-N 2.87Å; T115-Y142 CarbonylContact O-C 3.49Å; T115-Y142 VanDerWaalsContact O-CA 3.24Å; T115-Y142 WeakPolarHBondContact O-CA 3.24Å; T115-R143 PolarHBondContact N-O 3.38Å; T115-R143 PolarHBondContact O-N 2.78Å; T115-W145 HydrophobicContact CG2-CD2 4.34Å; T115-W145 HydrophobicContact CG2-CE3 3.54Å; T115-W145 HydrophobicContact CG2-CZ3 3.76Å; T115-H184 HydrophobicContact CG2-CB 4.31Å; T115-H184 PolarHBondContact OG1-ND1 3.03Å; T115-D187 PolarHBondContact OG1-OD2 2.89Å; T115-D187 VanDerWaalsContact OG1-OD2 3.09Å; T115-V188 HydrophobicContact CG2-CG2 3.78Å
116	K	92	Very high	87.5	Confident	102 Å²	102	53.9 Å²	53.9	44%	0.443	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	121.3	175.3	-176.2	177.4	178.8	178	0	108.9	F104 V118 I140 Y142 D187	F104-K116 HydrophobicContact CE2-CB 4.23Å; K116-V118 PolarHBondContact O-N 2.92Å; K116-I140 HydrophobicContact CD-CG2 4.31Å; K116-I140 HydrophobicContact CG-CG2 4.08Å; K116-Y142 HydrophobicContact CB-CD1 4.29Å; K116-Y142 HydrophobicContact CB-CE1 4.08Å; K116-D187 VanDerWaalsContact O-CB 3.24Å; K116-D187 WeakPolarHBondContact O-CB 3.43Å
117	N	91.9	Very high	87.3	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.043	32%	0.317	C	S	.	.			trans	-69.8	123.4	-177	-166.8	6.6	0	0	0	110.5	T115 V119 E122 E141 R143	T115-N117 PolarHBondContact O-N 2.87Å; N117-V119 VanDerWaalsContact C-N 3.34Å; N117-V119 VanDerWaalsContact CG-O 3.25Å; N117-V119 PolarHBondContact ND2-O 3.48Å; N117-V119 PolarHBondContact OD1-N 3.26Å; N117-V119 VanDerWaalsContact OD1-N 3.14Å; N117-V119 PolarHBondContact OD1-O 3Å; N117-E122 PolarHBondContact ND2-O 3.21Å; N117-E141 HydrophobicContact CB-CB 4.13Å; N117-E141 HydrophobicContact CB-CG 4.33Å; N117-E141 WeakPolarHBondContact CB-O 3.47Å; N117-E141 PolarHBondContact N-O 3.47Å; N117-E141 PolarHBondContact ND2-OE2 3.42Å; N117-R143 HydrophobicContact CB-CG 3.94Å; N117-R143 VanDerWaalsContact OD1-CD 3.27Å; N117-R143 WeakPolarHBondContact OD1-CD 3.43Å
118	V	87.1	Confident	87.3	Confident	58 Å²	58	55.9 Å²	55.9	35%	0.352	32%	0.322	S	S	.	.	S	Bend	trans	-71.3	-33.1	173.4	173.7	0	0	0	0	111.2	K116 D187	K116-V118 PolarHBondContact O-N 2.92Å; V118-D187 PolarHBondContact N-OD1 2.78Å
119	V	87.1	Confident	87.6	Confident	30 Å²	30	58.1 Å²	58.1	18%	0.182	32%	0.317	C	S	.	.	S	Bend	trans	-114.5	85.6	-177	-172	0	0	0	0	109.7	N117 G121 E122 H214 R215	N117-V119 VanDerWaalsContact C-N 3.34Å; N117-V119 VanDerWaalsContact CG-O 3.25Å; N117-V119 PolarHBondContact ND2-O 3.48Å; N117-V119 PolarHBondContact OD1-N 3.26Å; N117-V119 VanDerWaalsContact OD1-N 3.14Å; N117-V119 PolarHBondContact OD1-O 3Å; V119-G121 PolarHBondContact O-N 3.35Å; V119-E122 HydrophobicContact CG1-CB 4.13Å; V119-E122 PolarHBondContact O-N 2.71Å; V119-H214 HydrophobicContact CG1-CB 4.47Å; V119-H214 HydrophobicContact CG2-CB 4.35Å; V119-H214 WeakPolarHBondContact CG2-O 3.48Å; V119-R215 HydrophobicContact CG2-CG 3.92Å
120	V	86.1	Confident	88.1	Confident	87 Å²	87	50.4 Å²	50.4	53%	0.527	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	133.6	-178.4	-176.7	0	0	0	0	110.8	E141	V120-E141 HydrophobicContact CG1-CB 4.1Å
121	G	82.9	Confident	88.3	Confident	53 Å²	53	50.7 Å²	50.7	55%	0.546	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	-13.6	176.5	0	0	0	0	0	115	V119 R129 E141	V119-G121 PolarHBondContact O-N 3.35Å; G121-R129 PolarHBondContact O-NH1 3.35Å; G121-R129 PolarHBondContact O-NH2 3.13Å; G121-E141 PolarHBondContact N-OE2 3.02Å
122	E	83.7	Confident	88.2	Confident	52 Å²	52	48.3 Å²	48.3	24%	0.243	29%	0.286	C	S	.	.			trans	-104.8	146.8	176.6	-156.5	179.1	136	0	0	112.5	N117 V119 R129 H214	N117-E122 PolarHBondContact ND2-O 3.21Å; V119-E122 HydrophobicContact CG1-CB 4.13Å; V119-E122 PolarHBondContact O-N 2.71Å; E122-R129 VanDerWaalsContact C-NH1 3.34Å; E122-R129 WeakPolarHBondContact O-CD 3.14Å; E122-R129 PolarHBondContact O-NH1 3.04Å; E122-R129 VanDerWaalsContact O-NH1 3.13Å; E122-H214 IonicContact OE1-CD2 3.17Å; E122-H214 PolarHBondContact OE1-CD2 2.82Å; E122-H214 IonicContact OE1-CE1 3.89Å; E122-H214 IonicContact OE1-CG 3.35Å; E122-H214 IonicContact OE1-ND1 3.79Å; E122-H214 IonicContact OE1-NE2 3.61Å; E122-H214 IonicContact OE2-CD2 3.73Å; E122-H214 IonicContact OE2-CE1 3.42Å; E122-H214 PolarHBondContact OE2-CE1 3.01Å; E122-H214 IonicContact OE2-CG 3.15Å; E122-H214 IonicContact OE2-ND1 2.92Å; E122-H214 PolarHBondContact OE2-ND1 3.45Å; E122-H214 IonicContact OE2-NE2 3.93Å
123	S	86.2	Confident	87.8	Confident	48 Å²	48	54.3 Å²	54.3	34%	0.336	31%	0.311	S	S	.	.			trans	-120.3	138.7	167.3	61.1	0	0	0	0	108.4
124	V	84.7	Confident	86.9	Confident	37 Å²	37	57.4 Å²	57.4	22%	0.224	33%	0.328	C	S	.	.	S	Bend	trans	-82	-41.8	-173.5	174.4	0	0	0	0	112	E127 R143 V211	V124-E127 PolarHBondContact N-OE1 2.81Å; V124-E127 PolarHBondContact N-OE2 2.89Å; V124-R143 VanDerWaalsContact CG2-NH2 3.3Å; V124-V211 HydrophobicContact CG1-CG1 4.45Å; V124-V211 HydrophobicContact CG1-CG2 3.65Å
125	Y	86.1	Confident	85.7	Confident	49 Å²	49	65.6 Å²	65.6	19%	0.192	37%	0.371	C	S	.	.	S	Bend	trans	-133.9	19	-174.1	59.3	-95.2	0	0	0	112.8	E127 V144 T180 H184	Y125-E127 VanDerWaalsContact CD1-OE2 3.3Å; Y125-E127 WeakPolarHBondContact CD1-OE2 3.24Å; Y125-E127 HydrophobicContact CD2-CB 4.19Å; Y125-E127 WeakPolarHBondContact CD2-OE2 3.39Å; Y125-E127 HydrophobicContact CE1-CB 4.45Å; Y125-E127 HydrophobicContact CE1-CG 4.36Å; Y125-E127 HydrophobicContact CE2-CB 3.61Å; Y125-E127 HydrophobicContact CE2-CG 4.37Å; Y125-E127 VanDerWaalsContact CG-OE2 3.29Å; Y125-E127 PolarHBondContact N-OE2 2.78Å; Y125-V144 PolarHBondContact OH-O 3.48Å; Y125-T180 HydrophobicContact CD1-CG2 3.93Å; Y125-T180 HydrophobicContact CG-CG2 4.2Å; Y125-H184 AromaticContact CE1-NE2 3.64Å; Y125-H184 AromaticContact CZ-NE2 3.7Å; Y125-H184 PolarHBondContact OH-NE2 3.32Å
126	G	86.3	Confident	84.3	Confident	64 Å²	64	70.2 Å²	70.2	66%	0.66	41%	0.41	S	S	*	.	S	Bend	trans	80.6	24.8	-179.8	0	0	0	0	0	114.1
127	E	87.7	Confident	83.2	Confident	18 Å²	18	68.3 Å²	68.3	8%	0.084	42%	0.419	C	S	.	.			trans	-64.4	154.6	171.7	65	-76.2	-172.9	0	0	112.8	V124 Y125 R143	V124-E127 PolarHBondContact N-OE1 2.81Å; V124-E127 PolarHBondContact N-OE2 2.89Å; Y125-E127 VanDerWaalsContact CD1-OE2 3.3Å; Y125-E127 WeakPolarHBondContact CD1-OE2 3.24Å; Y125-E127 HydrophobicContact CD2-CB 4.19Å; Y125-E127 WeakPolarHBondContact CD2-OE2 3.39Å; Y125-E127 HydrophobicContact CE1-CB 4.45Å; Y125-E127 HydrophobicContact CE1-CG 4.36Å; Y125-E127 HydrophobicContact CE2-CB 3.61Å; Y125-E127 HydrophobicContact CE2-CG 4.37Å; Y125-E127 VanDerWaalsContact CG-OE2 3.29Å; Y125-E127 PolarHBondContact N-OE2 2.78Å; E127-R143 HydrophobicContact CG-CB 4.36Å; E127-R143 IonicContact OE1-CZ 2.82Å; E127-R143 IonicContact OE1-NE 2.87Å; E127-R143 PolarHBondContact OE1-NE 2.83Å; E127-R143 IonicContact OE1-NH2 3.71Å; E127-R143 PolarHBondContact OE1-NH2 3.18Å
128	K	88.6	Confident	82.5	Confident	107 Å²	107	69.5 Å²	69.5	47%	0.465	43%	0.434	S	S	.	.			trans	-69.7	145.2	173.1	-68	177.2	-171.5	164.3	0	109.7	M87 V144	M87-K128 VanDerWaalsContact O-CE 3.31Å; M87-K128 WeakPolarHBondContact O-CE 3.24Å; M87-K128 PolarHBondContact O-NZ 2.87Å; K128-V144 HydrophobicContact CB-CB 4.41Å; K128-V144 HydrophobicContact CB-CG2 3.96Å; K128-V144 WeakPolarHBondContact O-CB 3.49Å; K128-V144 WeakPolarHBondContact O-CG2 3.27Å; K128-V144 PolarHBondContact O-N 2.88Å
129	R	89.6	Confident	82.3	Confident	89 Å²	89	73.9 Å²	73.9	34%	0.336	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147	-179.8	-57	-177.3	-67.7	151.9	-3.8	109.7	G121 E122 E141 Y142 R143	G121-R129 PolarHBondContact O-NH1 3.35Å; G121-R129 PolarHBondContact O-NH2 3.13Å; E122-R129 VanDerWaalsContact C-NH1 3.34Å; E122-R129 WeakPolarHBondContact O-CD 3.14Å; E122-R129 PolarHBondContact O-NH1 3.04Å; E122-R129 VanDerWaalsContact O-NH1 3.13Å; R129-E141 HydrophobicContact CB-CG 4.03Å; R129-E141 VanDerWaalsContact CB-OE1 3.24Å; R129-E141 WeakPolarHBondContact CB-OE1 3.48Å; R129-E141 WeakPolarHBondContact CD-OE1 3.34Å; R129-E141 IonicContact CZ-OE1 2.63Å; R129-E141 IonicContact NE-OE1 3.76Å; R129-E141 PolarHBondContact NE-OE1 3.45Å; R129-E141 VanDerWaalsContact NH1-CD 3.25Å; R129-E141 IonicContact NH1-OE1 3.58Å; R129-E141 PolarHBondContact NH1-OE1 3.09Å; R129-E141 IonicContact NH1-OE2 3.08Å; R129-E141 PolarHBondContact NH1-OE2 2.86Å; R129-E141 IonicContact NH2-OE1 2.82Å; R129-Y142 CarbonylContact C-O 3.5Å; R129-Y142 VanDerWaalsContact CA-O 3.22Å; R129-Y142 WeakPolarHBondContact CA-O 3.49Å; R129-R143 HydrophobicContact CG-CG 4.24Å
130	I	88.8	Confident	82.3	Confident	21 Å²	21	74.1 Å²	74.1	11%	0.108	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.3	-178.7	-63	155.9	0	0	0	106.4	M87 V93 I95 A106 V114 V132 E141 Y142 V144	M87-I130 HydrophobicContact CE-CD1 4.21Å; V93-I130 HydrophobicContact CG2-CD1 3.97Å; V93-I130 HydrophobicContact CG2-CG1 4.18Å; V93-I130 HydrophobicContact CG2-CG2 3.6Å; I95-I130 HydrophobicContact CD1-CG2 4.03Å; A106-I130 HydrophobicContact CB-CD1 3.73Å; V114-I130 HydrophobicContact CG1-CD1 3.85Å; I130-V132 HydrophobicContact CG2-CG2 4.29Å; I130-E141 CarbonylContact O-C 3.51Å; I130-E141 WeakPolarHBondContact O-CA 3.42Å; I130-Y142 PolarHBondContact N-O 3.36Å; I130-Y142 PolarHBondContact O-N 3.27Å; I130-V144 HydrophobicContact CD1-CG2 4.22Å
131	S	87	Confident	82.6	Confident	95 Å²	95	70.9 Å²	70.9	66%	0.664	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.6	173.7	54.4	0	0	0	0	109.8
132	V	85.9	Confident	83.1	Confident	58 Å²	58	69.7 Å²	69.7	35%	0.352	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.1	170.7	-179	0	0	0	0	107.7	I95 I130 I140 Y142	I95-V132 HydrophobicContact CD1-CG2 3.5Å; I95-V132 VanDerWaalsContact CD1-CG2 3.5Å; I95-V132 HydrophobicContact CG1-CG2 4.36Å; I130-V132 HydrophobicContact CG2-CG2 4.29Å; V132-I140 PolarHBondContact N-O 2.99Å; V132-I140 PolarHBondContact O-N 3.22Å; V132-I140 VanDerWaalsContact O-O 3.14Å; V132-Y142 HydrophobicContact CB-CE2 4.48Å; V132-Y142 HydrophobicContact CG2-CD2 4.33Å; V132-Y142 HydrophobicContact CG2-CE2 4.26Å
133	E	81.5	Confident	83.5	Confident	151 Å²	151	67.2 Å²	67.2	71%	0.706	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	122.5	170.2	-66.1	-179.3	167.8	0	0	107.5
134	D	74.2	Confident	83.8	Confident	78 Å²	78	66.1 Å²	66.1	42%	0.417	39%	0.385	S	S	.	.			trans	-75.8	157.5	174.2	-158.6	2.2	0	0	0	109.7	A136 G137 G138 I140	D134-A136 PolarHBondContact O-N 3Å; D134-G137 PolarHBondContact O-N 2.98Å; D134-G138 WeakPolarHBondContact CB-O 3.19Å; D134-G138 PolarHBondContact N-O 3.22Å; D134-I140 HydrophobicContact CB-CD1 4.02Å; D134-I140 HydrophobicContact CB-CG1 4.37Å
135	D	68.7	Low	84.3	Confident	172 Å²	172	64.5 Å²	64.5	92%	0.92	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.6	-177.6	-67	-34.9	0	0	0	112.1	G137	D135-G137 VanDerWaalsContact C-N 3.31Å
136	A	65.4	Low	84.5	Confident	97 Å²	97	64.7 Å²	64.7	80%	0.802	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	7.3	174.6	0	0	0	0	0	114.5	D134 G138	D134-A136 PolarHBondContact O-N 3Å; A136-G138 PolarHBondContact O-N 2.88Å
137	G	68.9	Low	84.8	Confident	63 Å²	63	62.7 Å²	62.7	65%	0.649	36%	0.355	S	S	*	.	S	Bend	trans	76.7	4.3	-176.8	0	0	0	0	0	114.7	D134 D135	D134-G137 PolarHBondContact O-N 2.98Å; D135-G137 VanDerWaalsContact C-N 3.31Å
138	G	76.8	Confident	85	Confident	33 Å²	33	68.2 Å²	68.2	34%	0.34	38%	0.379	S	S	.	.			trans	-71.2	137.6	173.9	0	0	0	0	0	111.5	D134 A136	D134-G138 WeakPolarHBondContact CB-O 3.19Å; D134-G138 PolarHBondContact N-O 3.22Å; A136-G138 PolarHBondContact O-N 2.88Å
139	K	82.6	Confident	85	Confident	150 Å²	150	70.2 Å²	70.2	65%	0.652	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	105.9	173.2	-69.3	-176.8	179.8	179.2	0	109.6
140	I	87.8	Confident	85.1	Confident	35 Å²	35	66.1 Å²	66.1	18%	0.179	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.6	171.8	-58.1	174.8	0	0	0	107.9	K116 V132 D134 Y142	K116-I140 HydrophobicContact CD-CG2 4.31Å; K116-I140 HydrophobicContact CG-CG2 4.08Å; V132-I140 PolarHBondContact N-O 2.99Å; V132-I140 PolarHBondContact O-N 3.22Å; V132-I140 VanDerWaalsContact O-O 3.14Å; D134-I140 HydrophobicContact CB-CD1 4.02Å; D134-I140 HydrophobicContact CB-CG1 4.37Å; I140-Y142 HydrophobicContact CB-CE2 4.32Å; I140-Y142 HydrophobicContact CG2-CD2 4.1Å; I140-Y142 HydrophobicContact CG2-CE2 3.49Å; I140-Y142 VanDerWaalsContact CG2-CE2 3.49Å
141	E	91.3	Very high	85.2	Confident	19 Å²	19	66.9 Å²	66.9	9%	0.089	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.6	175.8	-173	174.7	-142	0	0	110.5	N117 V120 G121 R129 I130	N117-E141 HydrophobicContact CB-CB 4.13Å; N117-E141 HydrophobicContact CB-CG 4.33Å; N117-E141 WeakPolarHBondContact CB-O 3.47Å; N117-E141 PolarHBondContact N-O 3.47Å; N117-E141 PolarHBondContact ND2-OE2 3.42Å; V120-E141 HydrophobicContact CG1-CB 4.1Å; G121-E141 PolarHBondContact N-OE2 3.02Å; R129-E141 HydrophobicContact CB-CG 4.03Å; R129-E141 VanDerWaalsContact CB-OE1 3.24Å; R129-E141 WeakPolarHBondContact CB-OE1 3.48Å; R129-E141 WeakPolarHBondContact CD-OE1 3.34Å; R129-E141 IonicContact CZ-OE1 2.63Å; R129-E141 IonicContact NE-OE1 3.76Å; R129-E141 PolarHBondContact NE-OE1 3.45Å; R129-E141 VanDerWaalsContact NH1-CD 3.25Å; R129-E141 IonicContact NH1-OE1 3.58Å; R129-E141 PolarHBondContact NH1-OE1 3.09Å; R129-E141 IonicContact NH1-OE2 3.08Å; R129-E141 PolarHBondContact NH1-OE2 2.86Å; R129-E141 IonicContact NH2-OE1 2.82Å; I130-E141 CarbonylContact O-C 3.51Å; I130-E141 WeakPolarHBondContact O-CA 3.42Å
142	Y	92.6	Very high	85.5	Confident	28 Å²	28	62.4 Å²	62.4	11%	0.11	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.9	173.6	-66.6	-93.7	0	0	0	109.9	I95 F104 V114 T115 K116 R129 I130 V132 I140	I95-Y142 HydrophobicContact CD1-CD1 4.29Å; I95-Y142 HydrophobicContact CD1-CD2 3.2Å; I95-Y142 HydrophobicContact CD1-CE1 4.44Å; I95-Y142 HydrophobicContact CD1-CE2 3.39Å; I95-Y142 HydrophobicContact CD1-CG 3.68Å; I95-Y142 HydrophobicContact CG2-CD1 4.5Å; I95-Y142 HydrophobicContact CG2-CE1 4.12Å; I95-Y142 HydrophobicContact CG2-CE2 4.5Å; F104-Y142 HydrophobicContact CB-CE1 4.4Å; F104-Y142 HydrophobicContact CD1-CE1 4.42Å; F104-Y142 HydrophobicContact CD2-CD1 4.2Å; F104-Y142 AromaticContact CD2-CE1 3.68Å; F104-Y142 HydrophobicContact CD2-CE1 3.68Å; F104-Y142 HydrophobicContact CE2-CE1 4Å; F104-Y142 AromaticContact CG-CE1 3.93Å; F104-Y142 HydrophobicContact CG-CE1 3.93Å; F104-Y142 HydrophobicContact CZ-CE1 4.49Å; V114-Y142 HydrophobicContact CG2-CD1 4.46Å; T115-Y142 CarbonylContact O-C 3.49Å; T115-Y142 VanDerWaalsContact O-CA 3.24Å; T115-Y142 WeakPolarHBondContact O-CA 3.24Å; K116-Y142 HydrophobicContact CB-CD1 4.29Å; K116-Y142 HydrophobicContact CB-CE1 4.08Å; R129-Y142 CarbonylContact C-O 3.5Å; R129-Y142 VanDerWaalsContact CA-O 3.22Å; R129-Y142 WeakPolarHBondContact CA-O 3.49Å; I130-Y142 PolarHBondContact N-O 3.36Å; I130-Y142 PolarHBondContact O-N 3.27Å; V132-Y142 HydrophobicContact CB-CE2 4.48Å; V132-Y142 HydrophobicContact CG2-CD2 4.33Å; V132-Y142 HydrophobicContact CG2-CE2 4.26Å; I140-Y142 HydrophobicContact CB-CE2 4.32Å; I140-Y142 HydrophobicContact CG2-CD2 4.1Å; I140-Y142 HydrophobicContact CG2-CE2 3.49Å; I140-Y142 VanDerWaalsContact CG2-CE2 3.49Å
143	R	93.2	Very high	85.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.6	178.5	-70	169.2	62.5	-143.2	3	109.9	V114 T115 N117 V124 E127 R129 W145 S183 D187	V114-R143 CarbonylContact C-O 3.56Å; V114-R143 WeakPolarHBondContact CA-O 3.43Å; T115-R143 PolarHBondContact N-O 3.38Å; T115-R143 PolarHBondContact O-N 2.78Å; N117-R143 HydrophobicContact CB-CG 3.94Å; N117-R143 VanDerWaalsContact OD1-CD 3.27Å; N117-R143 WeakPolarHBondContact OD1-CD 3.43Å; V124-R143 VanDerWaalsContact CG2-NH2 3.3Å; E127-R143 HydrophobicContact CG-CB 4.36Å; E127-R143 IonicContact OE1-CZ 2.82Å; E127-R143 IonicContact OE1-NE 2.87Å; E127-R143 PolarHBondContact OE1-NE 2.83Å; E127-R143 IonicContact OE1-NH2 3.71Å; E127-R143 PolarHBondContact OE1-NH2 3.18Å; R129-R143 HydrophobicContact CG-CG 4.24Å; R143-W145 PolarHBondContact O-N 3.1Å; R143-S183 PolarHBondContact NH1-O 3.08Å; R143-S183 PolarHBondContact NH1-OG 2.84Å; R143-S183 PolarHBondContact NH2-OG 2.76Å; R143-D187 IonicContact CZ-OD2 3.79Å; R143-D187 IonicContact NE-OD2 3.14Å; R143-D187 IonicContact NH1-OD1 3.83Å; R143-D187 IonicContact NH1-OD2 2.67Å; R143-D187 PolarHBondContact NH1-OD2 3.28Å
144	V	93.2	Very high	86.4	Confident	24 Å²	24	52.4 Å²	52.4	15%	0.145	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.3	176.3	175.9	0	0	0	0	109.9	C112 V114 Y125 K128 I130	C112-V144 HydrophobicContact CB-CG1 4.26Å; V114-V144 HydrophobicContact CG1-CG2 4.06Å; Y125-V144 PolarHBondContact OH-O 3.48Å; K128-V144 HydrophobicContact CB-CB 4.41Å; K128-V144 HydrophobicContact CB-CG2 3.96Å; K128-V144 WeakPolarHBondContact O-CB 3.49Å; K128-V144 WeakPolarHBondContact O-CG2 3.27Å; K128-V144 PolarHBondContact O-N 2.88Å; I130-V144 HydrophobicContact CD1-CG2 4.22Å
145	W	93.9	Very high	87.3	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.015	27%	0.27	C	S	.	.			trans	-95.2	110.9	176.7	-160.4	-1.3	0	0	0	110.2	I103 L113 T115 R143 P147 S150 L152 A153 I156 T181 H184 V188	I103-W145 HydrophobicContact CD1-CZ3 3.98Å; I103-W145 HydrophobicContact CG1-CZ3 4.44Å; L113-W145 HydrophobicContact CB-CB 4.3Å; L113-W145 HydrophobicContact CD2-CB 4.3Å; L113-W145 HydrophobicContact CD2-CD2 4.16Å; L113-W145 HydrophobicContact CD2-CE3 3.7Å; L113-W145 HydrophobicContact CD2-CG 4.42Å; L113-W145 HydrophobicContact CG-CB 4.43Å; L113-W145 HydrophobicContact CG-CE3 4.38Å; L113-W145 PolarHBondContact O-N 3.3Å; T115-W145 HydrophobicContact CG2-CD2 4.34Å; T115-W145 HydrophobicContact CG2-CE3 3.54Å; T115-W145 HydrophobicContact CG2-CZ3 3.76Å; R143-W145 PolarHBondContact O-N 3.1Å; W145-P147 VanDerWaalsContact O-CD 3.31Å; W145-P147 WeakPolarHBondContact O-CD 3.29Å; W145-S150 PolarHBondContact NE1-OG 3.3Å; W145-L152 HydrophobicContact CH2-CD2 3.04Å; W145-L152 HydrophobicContact CH2-CG 4.48Å; W145-L152 HydrophobicContact CZ2-CB 4.43Å; W145-L152 HydrophobicContact CZ2-CD2 3.33Å; W145-L152 HydrophobicContact CZ2-CG 4.5Å; W145-L152 HydrophobicContact CZ3-CD2 3.99Å; W145-A153 HydrophobicContact CD2-CB 3.81Å; W145-A153 HydrophobicContact CG-CB 3.74Å; W145-I156 HydrophobicContact CH2-CD1 4.29Å; W145-I156 HydrophobicContact CZ3-CD1 3.99Å; W145-T181 HydrophobicContact CZ2-CG2 4.2Å; W145-H184 AromaticContact CD1-CD2 3.42Å; W145-H184 VanDerWaalsContact CD1-CD2 3.42Å; W145-H184 AromaticContact CD1-CG 3.69Å; W145-H184 AromaticContact CD1-NE2 3.68Å; W145-H184 HydrophobicContact CD2-CB 3.79Å; W145-H184 AromaticContact CD2-CG 3.86Å; W145-H184 VanDerWaalsContact CE2-CB 3.41Å; W145-H184 AromaticContact CE2-CG 3.76Å; W145-H184 HydrophobicContact CE3-CB 4.22Å; W145-H184 HydrophobicContact CG-CB 4.26Å; W145-H184 AromaticContact CG-CD2 3.96Å; W145-H184 AromaticContact CG-CG 3.8Å; W145-H184 AromaticContact CG-ND1 3.84Å; W145-H184 HydrophobicContact CH2-CB 3.88Å; W145-H184 HydrophobicContact CZ2-CB 3.49Å; W145-H184 VanDerWaalsContact CZ2-CB 3.49Å; W145-H184 HydrophobicContact CZ3-CB 4.26Å; W145-H184 AromaticContact NE1-CD2 3.5Å; W145-H184 AromaticContact NE1-CG 3.65Å; W145-V188 HydrophobicContact CH2-CG2 4.48Å; W145-V188 HydrophobicContact CZ3-CG2 4.1Å
146	N	91.7	Very high	88.4	Confident	53 Å²	53	40.6 Å²	40.6	28%	0.283	23%	0.226	S	C	.	.			trans	-83.3	115.4	-176	-172.8	-10	0	0	0	112	F148 R149 S150	N146-F148 PolarHBondContact O-N 2.85Å; N146-F148 WeakPolarHBondContact OD1-CB 3.04Å; N146-F148 WeakPolarHBondContact OD1-CD2 3.33Å; N146-F148 PolarHBondContact OD1-N 2.88Å; N146-R149 HydrophobicContact CB-CB 4.36Å; N146-R149 PolarHBondContact O-N 3.37Å; N146-R149 VanDerWaalsContact O-N 3.12Å; N146-S150 PolarHBondContact O-N 2.95Å; N146-S150 VanDerWaalsContact O-N 3.11Å
147	P	92	Very high	89.7	Confident	22 Å²	22	39.6 Å²	39.6	14%	0.143	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.8	177.8	28.8	-36.1	0	0	0	113.7	W145 R149 A153 A154 V157 F310	W145-P147 VanDerWaalsContact O-CD 3.31Å; W145-P147 WeakPolarHBondContact O-CD 3.29Å; P147-R149 VanDerWaalsContact C-N 3.27Å; P147-R149 PolarHBondContact O-N 2.81Å; P147-A153 HydrophobicContact CB-CB 4.29Å; P147-A154 HydrophobicContact CB-CB 4.41Å; P147-V157 HydrophobicContact CB-CG2 4.38Å; P147-F310 HydrophobicContact CB-CD1 3.69Å; P147-F310 HydrophobicContact CB-CD2 4.29Å; P147-F310 HydrophobicContact CB-CE1 3.59Å; P147-F310 HydrophobicContact CB-CE2 4.18Å; P147-F310 HydrophobicContact CB-CG 4.05Å; P147-F310 HydrophobicContact CB-CZ 3.84Å; P147-F310 HydrophobicContact CG-CD1 3.83Å; P147-F310 HydrophobicContact CG-CE1 3.37Å; P147-F310 HydrophobicContact CG-CZ 3.86Å
148	F	90.7	Very high	90.6	Very high	134 Å²	134	38.9 Å²	38.9	59%	0.588	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-10.4	174.5	-64.8	-81.5	0	0	0	114	N146 F310	N146-F148 PolarHBondContact O-N 2.85Å; N146-F148 WeakPolarHBondContact OD1-CB 3.04Å; N146-F148 WeakPolarHBondContact OD1-CD2 3.33Å; N146-F148 PolarHBondContact OD1-N 2.88Å; F148-F310 HydrophobicContact CD1-CB 4.49Å; F148-F310 AromaticContact CD1-CD1 3.88Å; F148-F310 HydrophobicContact CD1-CD1 3.88Å; F148-F310 HydrophobicContact CD2-CD1 4.13Å; F148-F310 HydrophobicContact CD2-CE1 4.41Å; F148-F310 AromaticContact CE1-CD1 3.68Å; F148-F310 HydrophobicContact CE1-CD1 3.68Å; F148-F310 HydrophobicContact CE1-CE1 4.34Å; F148-F310 AromaticContact CE2-CD1 3.94Å; F148-F310 HydrophobicContact CE2-CD1 3.94Å; F148-F310 AromaticContact CE2-CE1 3.94Å; F148-F310 HydrophobicContact CE2-CE1 3.94Å; F148-F310 HydrophobicContact CG-CD1 4.1Å; F148-F310 AromaticContact CZ-CD1 3.71Å; F148-F310 HydrophobicContact CZ-CD1 3.71Å; F148-F310 AromaticContact CZ-CE1 3.91Å; F148-F310 HydrophobicContact CZ-CE1 3.91Å
149	R	89	Confident	91.1	Very high	149 Å²	149	38.6 Å²	38.6	56%	0.562	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-21.5	177.5	-71.2	-168.7	177.9	-175.3	-0.6	113.4	N146 P147	N146-R149 HydrophobicContact CB-CB 4.36Å; N146-R149 PolarHBondContact O-N 3.37Å; N146-R149 VanDerWaalsContact O-N 3.12Å; P147-R149 VanDerWaalsContact C-N 3.27Å; P147-R149 PolarHBondContact O-N 2.81Å
150	S	92.5	Very high	91.3	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.021	16%	0.158	C	C	.	.			trans	-122.8	115.4	-176.6	167.5	0	0	0	0	109.9	W145 N146 L152 A153 A154 T181	W145-S150 PolarHBondContact NE1-OG 3.3Å; N146-S150 PolarHBondContact O-N 2.95Å; N146-S150 VanDerWaalsContact O-N 3.11Å; S150-L152 PolarHBondContact O-N 2.64Å; S150-L152 PolarHBondContact OG-N 2.8Å; S150-A153 PolarHBondContact O-N 3.36Å; S150-A153 VanDerWaalsContact O-N 3.08Å; S150-A153 PolarHBondContact OG-N 2.94Å; S150-A153 VanDerWaalsContact OG-N 3.15Å; S150-A154 PolarHBondContact O-N 3.22Å; S150-T181 WeakPolarHBondContact CB-OG1 3.5Å; S150-T181 VanDerWaalsContact OG-CG2 3.31Å; S150-T181 WeakPolarHBondContact OG-CG2 3.19Å; S150-T181 PolarHBondContact OG-OG1 3.07Å
151	K	91.5	Very high	91.2	Very high	36 Å²	36	34.6 Å²	34.6	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-59.5	-35.1	176.2	-52	-159.6	-176	87.9	0	112.1	A154 G155 D244 S271 L307 E311 M316	K151-A154 PolarHBondContact O-N 3.44Å; K151-G155 PolarHBondContact O-N 3Å; K151-D244 WeakPolarHBondContact CD-OD1 3Å; K151-D244 WeakPolarHBondContact CE-OD1 3.41Å; K151-D244 IonicContact NZ-OD1 3.99Å; K151-D244 PolarHBondContact NZ-OD1 3.31Å; K151-D244 IonicContact NZ-OD2 3.43Å; K151-D244 PolarHBondContact NZ-OD2 3.29Å; K151-S271 WeakPolarHBondContact CD-OG 3.43Å; K151-L307 HydrophobicContact CB-CD1 3.95Å; K151-E311 WeakPolarHBondContact CD-OE2 3.31Å; K151-E311 WeakPolarHBondContact CE-OE2 3.5Å; K151-E311 WeakPolarHBondContact CG-OE2 3.5Å; K151-M316 HydrophobicContact CB-CE 4.15Å; K151-M316 WeakPolarHBondContact O-CE 3.36Å
152	L	92.7	Very high	90.9	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-68	-38.9	176.4	-172.5	129.3	0	0	0	111.8	W145 S150 G155 I156 I165 T181 F242	W145-L152 HydrophobicContact CH2-CD2 3.04Å; W145-L152 HydrophobicContact CH2-CG 4.48Å; W145-L152 HydrophobicContact CZ2-CB 4.43Å; W145-L152 HydrophobicContact CZ2-CD2 3.33Å; W145-L152 HydrophobicContact CZ2-CG 4.5Å; W145-L152 HydrophobicContact CZ3-CD2 3.99Å; S150-L152 PolarHBondContact O-N 2.64Å; S150-L152 PolarHBondContact OG-N 2.8Å; L152-G155 PolarHBondContact O-N 2.67Å; L152-I156 HydrophobicContact CD2-CD1 3.57Å; L152-I156 HydrophobicContact CG-CD1 4.25Å; L152-I156 WeakPolarHBondContact O-CD1 3.3Å; L152-I156 VanDerWaalsContact O-CG1 3.31Å; L152-I156 WeakPolarHBondContact O-CG1 3.29Å; L152-I156 PolarHBondContact O-N 3.39Å; L152-I165 HydrophobicContact CD1-CD1 3.82Å; L152-T181 HydrophobicContact CB-CG2 4.34Å; L152-F242 HydrophobicContact CB-CE2 3.85Å; L152-F242 HydrophobicContact CB-CZ 3.8Å; L152-F242 HydrophobicContact CD1-CD2 3.4Å; L152-F242 VanDerWaalsContact CD1-CD2 3.4Å; L152-F242 HydrophobicContact CD1-CE2 3.33Å; L152-F242 HydrophobicContact CD1-CG 4.22Å; L152-F242 HydrophobicContact CD1-CZ 4.05Å; L152-F242 HydrophobicContact CG-CE2 4.11Å
153	A	93	Very high	90.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-41.1	173.9	0	0	0	0	0	111.7	L113 W145 P147 S150 G155 I156 V157	L113-A153 HydrophobicContact CD2-CB 4.12Å; W145-A153 HydrophobicContact CD2-CB 3.81Å; W145-A153 HydrophobicContact CG-CB 3.74Å; P147-A153 HydrophobicContact CB-CB 4.29Å; S150-A153 PolarHBondContact O-N 3.36Å; S150-A153 VanDerWaalsContact O-N 3.08Å; S150-A153 PolarHBondContact OG-N 2.94Å; S150-A153 VanDerWaalsContact OG-N 3.15Å; A153-G155 VanDerWaalsContact C-N 3.3Å; A153-G155 PolarHBondContact O-N 3.09Å; A153-I156 PolarHBondContact O-N 3.14Å; A153-V157 VanDerWaalsContact O-CG2 3.3Å; A153-V157 WeakPolarHBondContact O-CG2 3.08Å; A153-V157 PolarHBondContact O-N 3.38Å
154	A	93.4	Very high	90.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-44	172.4	0	0	0	0	0	111.6	P147 S150 K151 V157 N158 L307 F310	P147-A154 HydrophobicContact CB-CB 4.41Å; S150-A154 PolarHBondContact O-N 3.22Å; K151-A154 PolarHBondContact O-N 3.44Å; A154-V157 PolarHBondContact O-N 3.45Å; A154-N158 VanDerWaalsContact O-CB 3.29Å; A154-N158 WeakPolarHBondContact O-CB 3.34Å; A154-N158 PolarHBondContact O-N 3.15Å; A154-L307 HydrophobicContact CB-CB 4.44Å; A154-L307 HydrophobicContact CB-CD2 4.18Å; A154-F310 HydrophobicContact CB-CB 3.83Å; A154-F310 HydrophobicContact CB-CD2 3.67Å; A154-F310 HydrophobicContact CB-CG 3.94Å
155	G	92.3	Very high	90.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-41.5	177.4	0	0	0	0	0	113.3	K151 L152 A153 N158 G159 L160 L307	K151-G155 PolarHBondContact O-N 3Å; L152-G155 PolarHBondContact O-N 2.67Å; A153-G155 VanDerWaalsContact C-N 3.3Å; A153-G155 PolarHBondContact O-N 3.09Å; G155-N158 PolarHBondContact O-N 2.92Å; G155-G159 PolarHBondContact O-N 3.37Å; G155-L160 VanDerWaalsContact C-CD1 3.43Å; G155-L160 VanDerWaalsContact CA-CD1 3.43Å; G155-L160 WeakPolarHBondContact O-CB 3.46Å; G155-L160 VanDerWaalsContact O-CG 3.28Å; G155-L160 WeakPolarHBondContact O-CG 3.43Å; G155-L160 PolarHBondContact O-N 3.4Å; G155-L307 VanDerWaalsContact CA-CD2 3.48Å
156	I	92.4	Very high	90.3	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-62.3	-46.3	176.6	-70.6	157.9	0	0	0	111.2	R99 I103 L113 W145 L152 A153 N158 G159 I163	R99-I156 PolarHBondContact NH2-O 3.45Å; I103-I156 HydrophobicContact CD1-CD1 3.5Å; I103-I156 VanDerWaalsContact CD1-CD1 3.5Å; I103-I156 HydrophobicContact CD1-CG1 4.41Å; L113-I156 HydrophobicContact CD1-CG2 4.12Å; L113-I156 HydrophobicContact CD2-CB 4.29Å; L113-I156 HydrophobicContact CD2-CD1 4.27Å; L113-I156 HydrophobicContact CD2-CG2 4.01Å; W145-I156 HydrophobicContact CH2-CD1 4.29Å; W145-I156 HydrophobicContact CZ3-CD1 3.99Å; L152-I156 HydrophobicContact CD2-CD1 3.57Å; L152-I156 HydrophobicContact CG-CD1 4.25Å; L152-I156 WeakPolarHBondContact O-CD1 3.3Å; L152-I156 VanDerWaalsContact O-CG1 3.31Å; L152-I156 WeakPolarHBondContact O-CG1 3.29Å; L152-I156 PolarHBondContact O-N 3.39Å; A153-I156 PolarHBondContact O-N 3.14Å; I156-N158 VanDerWaalsContact C-N 3.32Å; I156-G159 PolarHBondContact O-N 2.77Å; I156-I163 HydrophobicContact CG1-CG2 3.91Å
157	V	91.7	Very high	90.4	Very high	75 Å²	75	44.4 Å²	44.4	46%	0.455	22%	0.223	S	C	.	.	H	α-helix	trans	-66.1	-35.9	179.3	175.8	0	0	0	0	111.2	P147 A153 A154 G159 F310	P147-V157 HydrophobicContact CB-CG2 4.38Å; A153-V157 VanDerWaalsContact O-CG2 3.3Å; A153-V157 WeakPolarHBondContact O-CG2 3.08Å; A153-V157 PolarHBondContact O-N 3.38Å; A154-V157 PolarHBondContact O-N 3.45Å; V157-G159 PolarHBondContact O-N 3.47Å; V157-F310 HydrophobicContact CB-CE2 4.03Å; V157-F310 HydrophobicContact CB-CZ 4.26Å; V157-F310 HydrophobicContact CG1-CE2 3.77Å; V157-F310 HydrophobicContact CG1-CZ 3.72Å
158	N	89.6	Confident	90.4	Very high	48 Å²	48	45 Å²	45	26%	0.257	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-2.5	179.1	-80.4	5.5	0	0	0	114.8	A154 G155 I156 V305 T306 L307 E308 F310	A154-N158 VanDerWaalsContact O-CB 3.29Å; A154-N158 WeakPolarHBondContact O-CB 3.34Å; A154-N158 PolarHBondContact O-N 3.15Å; G155-N158 PolarHBondContact O-N 2.92Å; I156-N158 VanDerWaalsContact C-N 3.32Å; N158-V305 HydrophobicContact CB-CG1 3.73Å; N158-T306 PolarHBondContact ND2-O 3.29Å; N158-L307 VanDerWaalsContact ND2-CA 3.31Å; N158-L307 WeakPolarHBondContact ND2-CA 3.15Å; N158-E308 PolarHBondContact ND2-O 3.44Å; N158-F310 WeakPolarHBondContact OD1-CE2 3.31Å
159	G	86.6	Confident	90.5	Very high	28 Å²	28	39.1 Å²	39.1	29%	0.289	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	110.6	11.2	170.3	0	0	0	0	0	116.3	R99 G155 I156 V157 D161	R99-G159 PolarHBondContact NH1-O 2.97Å; R99-G159 PolarHBondContact NH2-O 3.44Å; R99-G159 VanDerWaalsContact NH2-O 3.12Å; G155-G159 PolarHBondContact O-N 3.37Å; I156-G159 PolarHBondContact O-N 2.77Å; V157-G159 PolarHBondContact O-N 3.47Å; G159-D161 PolarHBondContact O-N 2.98Å; G159-D161 VanDerWaalsContact O-N 3.09Å
160	L	87.1	Confident	90.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.			trans	-49	117.1	175.6	-80	172.3	0	0	0	113.2	R99 H100 G155 E303 V305 M316 T318	R99-L160 PolarHBondContact NH1-O 2.93Å; R99-L160 PolarHBondContact NH2-O 2.86Å; H100-L160 PolarHBondContact CE1-O 2.72Å; H100-L160 PolarHBondContact NE2-O 2.71Å; G155-L160 VanDerWaalsContact C-CD1 3.43Å; G155-L160 VanDerWaalsContact CA-CD1 3.43Å; G155-L160 WeakPolarHBondContact O-CB 3.46Å; G155-L160 VanDerWaalsContact O-CG 3.28Å; G155-L160 WeakPolarHBondContact O-CG 3.43Å; G155-L160 PolarHBondContact O-N 3.4Å; L160-E303 VanDerWaalsContact CA-OE1 3.32Å; L160-E303 WeakPolarHBondContact CA-OE1 3.42Å; L160-V305 HydrophobicContact CD2-CB 3.88Å; L160-V305 HydrophobicContact CD2-CG2 3.62Å; L160-V305 HydrophobicContact CG-CB 4.25Å; L160-V305 HydrophobicContact CG-CG2 4.15Å; L160-M316 HydrophobicContact CD1-CB 4.16Å; L160-M316 HydrophobicContact CD1-CG 3.81Å; L160-M316 HydrophobicContact CD1-SD 3.22Å; L160-M316 WeakPolarHBondContact CD1-SD 3.39Å; L160-M316 HydrophobicContact CD2-CB 4.48Å; L160-M316 HydrophobicContact CD2-CG 4.43Å; L160-T318 HydrophobicContact CD2-CG2 3.97Å
161	D	84.4	Confident	91.1	Very high	101 Å²	101	37.3 Å²	37.3	54%	0.54	20%	0.201	S	C	.	.	S	Bend	trans	-69	-41.2	-171.8	-77.2	-25.1	0	0	0	112.5	R99 H100 G159 E303	R99-D161 IonicContact NH1-OD1 3.43Å; R99-D161 PolarHBondContact NH1-OD1 2.8Å; H100-D161 PolarHBondContact CE1-O 3.26Å; H100-D161 VanDerWaalsContact CE1-O 3.22Å; G159-D161 PolarHBondContact O-N 2.98Å; G159-D161 VanDerWaalsContact O-N 3.09Å; D161-E303 VanDerWaalsContact N-CD 3.29Å; D161-E303 PolarHBondContact N-OE1 3.41Å; D161-E303 PolarHBondContact N-OE2 3.27Å
162	Q	85.5	Confident	91.3	Very high	117 Å²	117	35.6 Å²	35.6	55%	0.547	19%	0.194	S	C	.	.			trans	-141	113.1	179.9	-64.4	-172.4	-14	0	0	111.8	H164	Q162-H164 PolarHBondContact O-CD2 3.07Å; Q162-H164 PolarHBondContact OE1-CE1 2.9Å
163	I	88.2	Confident	91.5	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	19%	0.194	C	C	.	.			trans	-83.1	-17.6	174.3	59.3	172.8	0	0	0	113	H100 I103 I156 I165 V269	H100-I163 HydrophobicContact CB-CD1 4.03Å; H100-I163 HydrophobicContact CB-CG1 4.47Å; I103-I163 HydrophobicContact CD1-CD1 3.69Å; I156-I163 HydrophobicContact CG1-CG2 3.91Å; I163-I165 HydrophobicContact CD1-CB 4.17Å; I163-I165 HydrophobicContact CG1-CB 4.33Å; I163-I165 PolarHBondContact O-N 3.01Å; I163-V269 WeakPolarHBondContact O-CG2 3.46Å
164	H	89.5	Confident	91.6	Very high	33 Å²	33	35.8 Å²	35.8	15%	0.153	19%	0.194	C	C	.	.			trans	55.9	15.7	-176	-55.7	-77.9	0	0	0	115.6	Q162 H267	Q162-H164 PolarHBondContact O-CD2 3.07Å; Q162-H164 PolarHBondContact OE1-CE1 2.9Å; H164-H267 HydrophobicContact CB-CB 3.63Å; H164-H267 AromaticContact CD2-CG 3.44Å; H164-H267 VanDerWaalsContact CD2-CG 3.44Å; H164-H267 AromaticContact CD2-ND1 3.44Å; H164-H267 PolarHBondContact CD2-ND1 2.87Å; H164-H267 AromaticContact CE1-CD2 3.75Å; H164-H267 AromaticContact CE1-CE1 3.08Å; H164-H267 PolarHBondContact CE1-CE1 2.92Å; H164-H267 AromaticContact CE1-CG 3.63Å; H164-H267 AromaticContact CE1-ND1 3.22Å; H164-H267 PolarHBondContact CE1-ND1 3.04Å; H164-H267 AromaticContact CE1-NE2 3.42Å; H164-H267 PolarHBondContact CE1-NE2 3.12Å; H164-H267 AromaticContact CG-CD2 3.55Å; H164-H267 AromaticContact CG-CG 3.28Å; H164-H267 AromaticContact CG-ND1 3.65Å; H164-H267 AromaticContact ND1-CD2 3.29Å; H164-H267 PolarHBondContact ND1-CD2 2.99Å; H164-H267 VanDerWaalsContact ND1-CD2 3.29Å; H164-H267 AromaticContact ND1-CE1 3.47Å; H164-H267 PolarHBondContact ND1-CE1 3.2Å; H164-H267 AromaticContact ND1-CG 3.41Å; H164-H267 AromaticContact ND1-ND1 3.53Å; H164-H267 AromaticContact ND1-NE2 3.33Å; H164-H267 PolarHBondContact ND1-NE2 3.1Å; H164-H267 AromaticContact NE2-CE1 3.48Å; H164-H267 PolarHBondContact NE2-CE1 3.03Å; H164-H267 AromaticContact NE2-CG 3.64Å; H164-H267 AromaticContact NE2-ND1 3.13Å; H164-H267 PolarHBondContact NE2-ND1 2.97Å; H164-H267 VanDerWaalsContact NE2-ND1 3.13Å
165	I	91.5	Very high	91.7	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	20%	0.203	C	C	.	.			trans	-101.9	110	169.7	-59.7	171.9	0	0	0	106.1	L152 I163 V171 V185 V188 V189	L152-I165 HydrophobicContact CD1-CD1 3.82Å; I163-I165 HydrophobicContact CD1-CB 4.17Å; I163-I165 HydrophobicContact CG1-CB 4.33Å; I163-I165 PolarHBondContact O-N 3.01Å; I165-V171 HydrophobicContact CG1-CG2 4.09Å; I165-V171 HydrophobicContact CG2-CG2 4.06Å; I165-V185 HydrophobicContact CD1-CG1 4.22Å; I165-V185 HydrophobicContact CD1-CG2 4.49Å; I165-V185 HydrophobicContact CG2-CG1 4.28Å; I165-V188 HydrophobicContact CG2-CB 4.44Å; I165-V188 HydrophobicContact CG2-CG1 3.92Å; I165-V189 HydrophobicContact CG2-CG2 3.64Å
166	K	91.4	Very high	91.7	Very high	104 Å²	104	36.8 Å²	36.8	45%	0.452	21%	0.205	S	C	.	.			trans	-119.3	158.2	-179.9	-65.5	-177.1	172	-129.7	0	110.2	E101 G168 S169	E101-K166 IonicContact OE1-NZ 2.71Å; E101-K166 PolarHBondContact OE1-NZ 3.5Å; E101-K166 WeakPolarHBondContact OE2-CD 3.26Å; E101-K166 IonicContact OE2-NZ 2.72Å; K166-G168 PolarHBondContact O-N 2.94Å; K166-S169 PolarHBondContact N-OG 3.35Å; K166-S169 VanDerWaalsContact N-OG 3.09Å; K166-S169 VanDerWaalsContact O-CB 3.26Å; K166-S169 WeakPolarHBondContact O-CB 3.36Å; K166-S169 PolarHBondContact O-N 2.69Å; K166-S169 PolarHBondContact O-OG 2.99Å
167	P	93	Very high	91.7	Very high	70 Å²	70	38.9 Å²	38.9	46%	0.455	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	131	166.5	-25.1	34.9	0	0	0	110.7	E101 S169 V189	E101-P167 HydrophobicContact CB-CG 4.26Å; P167-S169 VanDerWaalsContact C-N 3.32Å; P167-S169 PolarHBondContact O-N 2.9Å; P167-V189 CarbonylContact C-O 3.43Å; P167-V189 WeakPolarHBondContact CA-O 3.47Å
168	G	92.8	Very high	91.6	Very high	34 Å²	34	37.3 Å²	37.3	35%	0.351	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-5.3	-176.3	0	0	0	0	0	116.1	K166 V189	K166-G168 PolarHBondContact O-N 2.94Å; G168-V189 PolarHBondContact N-O 3.38Å
169	S	93.5	Very high	91.6	Very high	11 Å²	11	35 Å²	35	8%	0.077	20%	0.202	C	C	.	.			trans	-72.8	151.5	178.8	64.3	0	0	0	0	112.9	K166 P167 V189 G193 V194	K166-S169 PolarHBondContact N-OG 3.35Å; K166-S169 VanDerWaalsContact N-OG 3.09Å; K166-S169 VanDerWaalsContact O-CB 3.26Å; K166-S169 WeakPolarHBondContact O-CB 3.36Å; K166-S169 PolarHBondContact O-N 2.69Å; K166-S169 PolarHBondContact O-OG 2.99Å; P167-S169 VanDerWaalsContact C-N 3.32Å; P167-S169 PolarHBondContact O-N 2.9Å; S169-V189 WeakPolarHBondContact O-CG1 3.45Å; S169-G193 WeakPolarHBondContact O-CA 3.28Å; S169-V194 PolarHBondContact O-N 3.39Å
170	R	95.6	Very high	91.8	Very high	115 Å²	115	35.5 Å²	35.5	43%	0.434	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.4	170.9	-63.8	-179.6	-175.3	-171.6	-1	109.7	V194 V238 D239 C240	R170-V194 WeakPolarHBondContact CA-O 3.29Å; R170-V238 HydrophobicContact CB-CB 4.39Å; R170-V238 HydrophobicContact CB-CG1 4.31Å; R170-D239 PolarHBondContact N-OD2 3.27Å; R170-D239 PolarHBondContact O-N 2.75Å; R170-C240 PolarHBondContact O-N 3.43Å
171	V	96.7	Very high	92.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	128.8	-175.1	-175.8	0	0	0	0	110.3	I165 V185 V189 V194 V195 Y196 C240	I165-V171 HydrophobicContact CG1-CG2 4.09Å; I165-V171 HydrophobicContact CG2-CG2 4.06Å; V171-V185 HydrophobicContact CB-CG1 4.43Å; V171-V185 HydrophobicContact CG1-CG1 4.18Å; V171-V185 HydrophobicContact CG2-CG1 4.47Å; V171-V189 HydrophobicContact CG2-CG2 3.83Å; V171-V194 PolarHBondContact N-O 2.96Å; V171-V195 CarbonylContact O-C 3.54Å; V171-V195 WeakPolarHBondContact O-CA 3.45Å; V171-Y196 PolarHBondContact O-N 3.27Å; V171-C240 WeakPolarHBondContact CA-O 3.33Å; V171-C240 HydrophobicContact CG2-CB 4.5Å
172	L	96.8	Very high	92.6	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.5	167.3	176.5	64.6	0	0	0	109.1	L174 V198 V235 V238 C240 I241 F242 N257 Y261	L172-L174 HydrophobicContact CD1-CD2 4.21Å; L172-L174 HydrophobicContact CD2-CD2 4.04Å; L172-L174 HydrophobicContact CG-CD2 3.89Å; L172-L174 HydrophobicContact CG-CG 4.36Å; L172-V198 HydrophobicContact CD1-CG2 3.71Å; L172-V235 HydrophobicContact CD1-CG1 4.26Å; L172-V235 HydrophobicContact CD1-CG2 4.41Å; L172-V238 HydrophobicContact CB-CB 4.39Å; L172-V238 HydrophobicContact CB-CG1 4.06Å; L172-V238 HydrophobicContact CB-CG2 3.93Å; L172-C240 PolarHBondContact N-O 3.46Å; L172-I241 HydrophobicContact CB-CG1 4.14Å; L172-I241 HydrophobicContact CD2-CD1 4.27Å; L172-I241 HydrophobicContact CD2-CG1 4.19Å; L172-I241 CarbonylContact O-C 3.53Å; L172-I241 WeakPolarHBondContact O-CA 3.49Å; L172-F242 PolarHBondContact O-N 2.89Å; L172-N257 HydrophobicContact CD2-CB 4.37Å; L172-Y261 HydrophobicContact CD2-CD2 3.91Å; L172-Y261 HydrophobicContact CD2-CG 4.42Å
173	Y	96.7	Very high	93	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.016	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	112.8	179	-159.7	-69.3	0	0	0	109.5	G175 A176 T181 V182 V185 Y196 V198 F242 D244	Y173-G175 WeakPolarHBondContact CE1-O 3.3Å; Y173-A176 HydrophobicContact CD1-CB 4.05Å; Y173-T181 HydrophobicContact CE2-CG2 3.99Å; Y173-T181 VanDerWaalsContact OH-CB 3.3Å; Y173-T181 WeakPolarHBondContact OH-CB 3.5Å; Y173-T181 VanDerWaalsContact OH-CG2 3.29Å; Y173-T181 WeakPolarHBondContact OH-CG2 3.39Å; Y173-V182 HydrophobicContact CD1-CG2 3.85Å; Y173-V182 HydrophobicContact CD2-CG2 3.98Å; Y173-V182 HydrophobicContact CE1-CG2 4.01Å; Y173-V182 HydrophobicContact CE2-CG2 4.13Å; Y173-V182 HydrophobicContact CG-CG2 3.84Å; Y173-V185 HydrophobicContact CD2-CG2 4.26Å; Y173-V185 HydrophobicContact CE2-CG2 4.05Å; Y173-Y196 PolarHBondContact N-O 2.91Å; Y173-V198 PolarHBondContact O-N 3.09Å; Y173-F242 CarbonylContact C-O 3.56Å; Y173-F242 WeakPolarHBondContact CA-O 3.46Å; Y173-F242 HydrophobicContact CD1-CD1 4.32Å; Y173-F242 HydrophobicContact CD2-CB 4.13Å; Y173-F242 AromaticContact CD2-CD1 3.66Å; Y173-F242 HydrophobicContact CD2-CD1 3.66Å; Y173-F242 HydrophobicContact CD2-CG 4.24Å; Y173-F242 AromaticContact CE1-CD1 3.91Å; Y173-F242 HydrophobicContact CE1-CD1 3.91Å; Y173-F242 HydrophobicContact CE1-CE1 4.2Å; Y173-F242 HydrophobicContact CE2-CB 4.42Å; Y173-F242 AromaticContact CE2-CD1 3.18Å; Y173-F242 HydrophobicContact CE2-CD1 3.18Å; Y173-F242 AromaticContact CE2-CE1 3.64Å; Y173-F242 HydrophobicContact CE2-CE1 3.64Å; Y173-F242 HydrophobicContact CE2-CG 4.03Å; Y173-F242 HydrophobicContact CG-CD1 4.21Å; Y173-F242 AromaticContact CZ-CD1 3.32Å; Y173-F242 AromaticContact CZ-CE1 3.44Å; Y173-F242 VanDerWaalsContact CZ-CE1 3.44Å; Y173-F242 WeakPolarHBondContact OH-CE1 3.37Å; Y173-D244 HydrophobicContact CE1-CB 4.44Å
174	L	95.6	Very high	93.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.5	178.1	-55.7	176.9	0	0	0	109.7	L172 V198 A225 I241 F242 A243 D244 V245 I253 N257	L172-L174 HydrophobicContact CD1-CD2 4.21Å; L172-L174 HydrophobicContact CD2-CD2 4.04Å; L172-L174 HydrophobicContact CG-CD2 3.89Å; L172-L174 HydrophobicContact CG-CG 4.36Å; L174-V198 HydrophobicContact CD2-CB 4.12Å; L174-V198 HydrophobicContact CD2-CG2 4.05Å; L174-A225 HydrophobicContact CD2-CB 4.26Å; L174-I241 HydrophobicContact CD1-CG2 3.79Å; L174-I241 HydrophobicContact CG-CG2 4.14Å; L174-F242 PolarHBondContact N-O 2.97Å; L174-A243 HydrophobicContact CB-CB 4.47Å; L174-A243 HydrophobicContact CD1-CB 4.47Å; L174-D244 PolarHBondContact O-N 2.73Å; L174-V245 HydrophobicContact CB-CG2 3.84Å; L174-I253 HydrophobicContact CD1-CG2 4.45Å; L174-N257 HydrophobicContact CD1-CB 3.94Å
175	G	94.1	Very high	93.5	Very high	18 Å²	18	23.8 Å²	23.8	19%	0.186	14%	0.142	C	C	.	.			trans	85.7	51.1	-176.8	0	0	0	0	0	112.4	Y173 A177 V198	Y173-G175 WeakPolarHBondContact CE1-O 3.3Å; G175-A177 PolarHBondContact O-N 3.35Å; G175-V198 PolarHBondContact N-O 2.87Å
176	A	92.2	Very high	93.6	Very high	4 Å²	4	23.5 Å²	23.5	3%	0.033	14%	0.141	C	C	.	.			trans	-65.2	-18.1	-175.9	0	0	0	0	0	114.8	Y173 S178 G179 V182 A197 V198 E199 L208	Y173-A176 HydrophobicContact CD1-CB 4.05Å; A176-S178 PolarHBondContact O-N 3Å; A176-G179 PolarHBondContact O-N 2.84Å; A176-V182 HydrophobicContact CB-CG2 3.65Å; A176-A197 HydrophobicContact CB-CB 3.84Å; A176-V198 PolarHBondContact N-O 3.3Å; A176-E199 HydrophobicContact CB-CB 4.31Å; A176-E199 PolarHBondContact N-OE2 3.05Å; A176-L208 HydrophobicContact CB-CD1 4.15Å; A176-L208 HydrophobicContact CB-CD2 3.84Å
177	A	92.4	Very high	93.8	Very high	45 Å²	45	19 Å²	19	37%	0.372	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	-125.3	-174.7	0	0	0	0	0	111	G175 G179 E199 S204	G175-A177 PolarHBondContact O-N 3.35Å; A177-G179 VanDerWaalsContact C-N 3.29Å; A177-G179 PolarHBondContact O-N 3.42Å; A177-E199 WeakPolarHBondContact CA-OE2 3.49Å; A177-E199 PolarHBondContact N-OE2 3.03Å; A177-S204 WeakPolarHBondContact O-CB 3.22Å
178	S	89.6	Confident	93.8	Very high	43 Å²	43	15.9 Å²	15.9	30%	0.301	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	3.3	179.8	63.5	0	0	0	0	114.2	A176	A176-S178 PolarHBondContact O-N 3Å
179	G	89.4	Confident	93.9	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	82.7	12.2	177.3	0	0	0	0	0	116	A176 A177 V182 S183	A176-G179 PolarHBondContact O-N 2.84Å; A177-G179 VanDerWaalsContact C-N 3.29Å; A177-G179 PolarHBondContact O-N 3.42Å; G179-V182 PolarHBondContact O-N 3.06Å; G179-S183 WeakPolarHBondContact O-CB 3.42Å; G179-S183 PolarHBondContact O-N 2.83Å
180	T	91.5	Very high	93.8	Very high	37 Å²	37	14.7 Å²	14.7	23%	0.227	9%	0.091	C	C	.	.	H	α-helix	trans	-59.7	-55	179.3	50.2	0	0	0	0	111.9	Y125 S183 H184	Y125-T180 HydrophobicContact CD1-CG2 3.93Å; Y125-T180 HydrophobicContact CG-CG2 4.2Å; T180-S183 PolarHBondContact O-OG 3.48Å; T180-H184 PolarHBondContact O-CD2 3.03Å
181	T	93.3	Very high	93.5	Very high	8 Å²	8	13.2 Å²	13.2	5%	0.049	10%	0.103	C	C	.	.	H	α-helix	trans	-72.4	-36.8	177.6	-56.2	0	0	0	0	111.8	W145 S150 L152 Y173 S183 H184 V185	W145-T181 HydrophobicContact CZ2-CG2 4.2Å; S150-T181 WeakPolarHBondContact CB-OG1 3.5Å; S150-T181 VanDerWaalsContact OG-CG2 3.31Å; S150-T181 WeakPolarHBondContact OG-CG2 3.19Å; S150-T181 PolarHBondContact OG-OG1 3.07Å; L152-T181 HydrophobicContact CB-CG2 4.34Å; Y173-T181 HydrophobicContact CE2-CG2 3.99Å; Y173-T181 VanDerWaalsContact OH-CB 3.3Å; Y173-T181 WeakPolarHBondContact OH-CB 3.5Å; Y173-T181 VanDerWaalsContact OH-CG2 3.29Å; Y173-T181 WeakPolarHBondContact OH-CG2 3.39Å; T181-S183 PolarHBondContact O-N 2.58Å; T181-H184 PolarHBondContact O-N 2.86Å; T181-V185 HydrophobicContact CG2-CG2 4.38Å; T181-V185 PolarHBondContact O-N 3Å
182	V	94.5	Very high	93.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.1	-39.5	176.1	179.1	0	0	0	0	111.1	Y173 A176 G179 H184 V185 S186 V195 A197 L208 V218	Y173-V182 HydrophobicContact CD1-CG2 3.85Å; Y173-V182 HydrophobicContact CD2-CG2 3.98Å; Y173-V182 HydrophobicContact CE1-CG2 4.01Å; Y173-V182 HydrophobicContact CE2-CG2 4.13Å; Y173-V182 HydrophobicContact CG-CG2 3.84Å; A176-V182 HydrophobicContact CB-CG2 3.65Å; G179-V182 PolarHBondContact O-N 3.06Å; V182-H184 VanDerWaalsContact C-N 3.26Å; V182-H184 PolarHBondContact O-N 3.21Å; V182-V185 PolarHBondContact O-N 2.94Å; V182-S186 WeakPolarHBondContact O-CB 3.38Å; V182-S186 PolarHBondContact O-N 3.01Å; V182-V195 HydrophobicContact CG1-CG1 3.96Å; V182-A197 HydrophobicContact CG1-CB 3.87Å; V182-A197 HydrophobicContact CG2-CB 4.33Å; V182-L208 HydrophobicContact CG1-CD1 4.38Å; V182-V218 HydrophobicContact CG1-CG1 3.91Å; V182-V218 HydrophobicContact CG1-CG2 4.34Å
183	S	93.9	Very high	93.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-32.2	177.4	76.5	0	0	0	0	113.3	R143 G179 T180 T181 D187	R143-S183 PolarHBondContact NH1-O 3.08Å; R143-S183 PolarHBondContact NH1-OG 2.84Å; R143-S183 PolarHBondContact NH2-OG 2.76Å; G179-S183 WeakPolarHBondContact O-CB 3.42Å; G179-S183 PolarHBondContact O-N 2.83Å; T180-S183 PolarHBondContact O-OG 3.48Å; T181-S183 PolarHBondContact O-N 2.58Å; S183-D187 PolarHBondContact O-N 3.22Å
184	H	94.5	Very high	93.1	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-80.5	-36	175.1	-72.3	-75.7	0	0	0	111.7	T115 Y125 W145 T180 T181 V182 S186 D187 V188	T115-H184 HydrophobicContact CG2-CB 4.31Å; T115-H184 PolarHBondContact OG1-ND1 3.03Å; Y125-H184 AromaticContact CE1-NE2 3.64Å; Y125-H184 AromaticContact CZ-NE2 3.7Å; Y125-H184 PolarHBondContact OH-NE2 3.32Å; W145-H184 AromaticContact CD1-CD2 3.42Å; W145-H184 VanDerWaalsContact CD1-CD2 3.42Å; W145-H184 AromaticContact CD1-CG 3.69Å; W145-H184 AromaticContact CD1-NE2 3.68Å; W145-H184 HydrophobicContact CD2-CB 3.79Å; W145-H184 AromaticContact CD2-CG 3.86Å; W145-H184 VanDerWaalsContact CE2-CB 3.41Å; W145-H184 AromaticContact CE2-CG 3.76Å; W145-H184 HydrophobicContact CE3-CB 4.22Å; W145-H184 HydrophobicContact CG-CB 4.26Å; W145-H184 AromaticContact CG-CD2 3.96Å; W145-H184 AromaticContact CG-CG 3.8Å; W145-H184 AromaticContact CG-ND1 3.84Å; W145-H184 HydrophobicContact CH2-CB 3.88Å; W145-H184 HydrophobicContact CZ2-CB 3.49Å; W145-H184 VanDerWaalsContact CZ2-CB 3.49Å; W145-H184 HydrophobicContact CZ3-CB 4.26Å; W145-H184 AromaticContact NE1-CD2 3.5Å; W145-H184 AromaticContact NE1-CG 3.65Å; T180-H184 PolarHBondContact O-CD2 3.03Å; T181-H184 PolarHBondContact O-N 2.86Å; V182-H184 VanDerWaalsContact C-N 3.26Å; V182-H184 PolarHBondContact O-N 3.21Å; H184-S186 VanDerWaalsContact C-N 3.3Å; H184-S186 PolarHBondContact O-N 2.65Å; H184-D187 WeakPolarHBondContact O-CB 3.2Å; H184-D187 PolarHBondContact O-N 2.94Å; H184-V188 WeakPolarHBondContact O-CG2 3.21Å; H184-V188 PolarHBondContact O-N 2.98Å
185	V	94.5	Very high	93.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-41.8	173.2	175.4	0	0	0	0	110.7	I165 V171 Y173 T181 V182 V188 V189 V195	I165-V185 HydrophobicContact CD1-CG1 4.22Å; I165-V185 HydrophobicContact CD1-CG2 4.49Å; I165-V185 HydrophobicContact CG2-CG1 4.28Å; V171-V185 HydrophobicContact CB-CG1 4.43Å; V171-V185 HydrophobicContact CG1-CG1 4.18Å; V171-V185 HydrophobicContact CG2-CG1 4.47Å; Y173-V185 HydrophobicContact CD2-CG2 4.26Å; Y173-V185 HydrophobicContact CE2-CG2 4.05Å; T181-V185 HydrophobicContact CG2-CG2 4.38Å; T181-V185 PolarHBondContact O-N 3Å; V182-V185 PolarHBondContact O-N 2.94Å; V185-V188 PolarHBondContact O-N 2.99Å; V185-V189 HydrophobicContact CG1-CG2 4.31Å; V185-V189 WeakPolarHBondContact O-CB 3.44Å; V185-V189 VanDerWaalsContact O-CG2 3.29Å; V185-V189 WeakPolarHBondContact O-CG2 3.35Å; V185-V189 PolarHBondContact O-N 3.32Å; V185-V195 HydrophobicContact CG1-CG1 4.29Å; V185-V195 HydrophobicContact CG1-CG2 3.97Å
186	S	94.6	Very high	93.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-43.3	172.5	159.6	0	0	0	0	112.3	V182 H184 V188 V189 G190 R215 N217	V182-S186 WeakPolarHBondContact O-CB 3.38Å; V182-S186 PolarHBondContact O-N 3.01Å; H184-S186 VanDerWaalsContact C-N 3.3Å; H184-S186 PolarHBondContact O-N 2.65Å; S186-V188 VanDerWaalsContact C-N 3.34Å; S186-V188 PolarHBondContact O-N 2.85Å; S186-V189 PolarHBondContact O-N 2.92Å; S186-G190 PolarHBondContact O-N 3.4Å; S186-R215 WeakPolarHBondContact OG-CD 3.3Å; S186-N217 PolarHBondContact O-ND2 2.79Å; S186-N217 PolarHBondContact OG-ND2 2.87Å; S186-N217 PolarHBondContact OG-OD1 3.02Å
187	D	93.8	Very high	93.5	Very high	9 Å²	9	22.3 Å²	22.3	5%	0.048	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-38.9	174.4	-72.3	-10.8	0	0	0	112.9	T115 K116 V118 R143 S183 H184 R215	T115-D187 PolarHBondContact OG1-OD2 2.89Å; T115-D187 VanDerWaalsContact OG1-OD2 3.09Å; K116-D187 VanDerWaalsContact O-CB 3.24Å; K116-D187 WeakPolarHBondContact O-CB 3.43Å; V118-D187 PolarHBondContact N-OD1 2.78Å; R143-D187 IonicContact CZ-OD2 3.79Å; R143-D187 IonicContact NE-OD2 3.14Å; R143-D187 IonicContact NH1-OD1 3.83Å; R143-D187 IonicContact NH1-OD2 2.67Å; R143-D187 PolarHBondContact NH1-OD2 3.28Å; S183-D187 PolarHBondContact O-N 3.22Å; H184-D187 WeakPolarHBondContact O-CB 3.2Å; H184-D187 PolarHBondContact O-N 2.94Å; D187-R215 IonicContact OD1-NE 3.98Å
188	V	94.3	Very high	93.6	Very high	5 Å²	5	20.2 Å²	20.2	3%	0.03	13%	0.129	C	C	.	.	H	α-helix	trans	-72.2	-41.7	179.3	174.6	0	0	0	0	112	I103 T115 W145 I165 H184 V185 S186 G190	I103-V188 HydrophobicContact CD1-CG2 4.25Å; I103-V188 HydrophobicContact CG1-CG1 4.2Å; I103-V188 HydrophobicContact CG1-CG2 3.68Å; T115-V188 HydrophobicContact CG2-CG2 3.78Å; W145-V188 HydrophobicContact CH2-CG2 4.48Å; W145-V188 HydrophobicContact CZ3-CG2 4.1Å; I165-V188 HydrophobicContact CG2-CB 4.44Å; I165-V188 HydrophobicContact CG2-CG1 3.92Å; H184-V188 WeakPolarHBondContact O-CG2 3.21Å; H184-V188 PolarHBondContact O-N 2.98Å; V185-V188 PolarHBondContact O-N 2.99Å; S186-V188 VanDerWaalsContact C-N 3.34Å; S186-V188 PolarHBondContact O-N 2.85Å; V188-G190 VanDerWaalsContact C-N 3.31Å
189	V	94.1	Very high	93.9	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	12%	0.12	C	C	.	.	H	α-helix	trans	-69.4	-31.7	179.5	170.3	0	0	0	0	111.3	I165 P167 G168 S169 V171 V185 S186 G193 V195	I165-V189 HydrophobicContact CG2-CG2 3.64Å; P167-V189 CarbonylContact C-O 3.43Å; P167-V189 WeakPolarHBondContact CA-O 3.47Å; G168-V189 PolarHBondContact N-O 3.38Å; S169-V189 WeakPolarHBondContact O-CG1 3.45Å; V171-V189 HydrophobicContact CG2-CG2 3.83Å; V185-V189 HydrophobicContact CG1-CG2 4.31Å; V185-V189 WeakPolarHBondContact O-CB 3.44Å; V185-V189 VanDerWaalsContact O-CG2 3.29Å; V185-V189 WeakPolarHBondContact O-CG2 3.35Å; V185-V189 PolarHBondContact O-N 3.32Å; S186-V189 PolarHBondContact O-N 2.92Å; V189-G193 VanDerWaalsContact CG1-C 3.41Å; V189-V195 HydrophobicContact CB-CG2 4.34Å; V189-V195 HydrophobicContact CG2-CG2 4.14Å
190	G	91.1	Very high	94.1	Very high	19 Å²	19	26 Å²	26	20%	0.196	15%	0.15	C	C	.	.			trans	74.4	-169.6	179.7	0	0	0	0	0	113.3	S186 V188 N217	S186-G190 PolarHBondContact O-N 3.4Å; V188-G190 VanDerWaalsContact C-N 3.31Å; G190-N217 PolarHBondContact O-ND2 2.8Å
191	A	90.4	Very high	94.2	Very high	83 Å²	83	26.2 Å²	26.2	69%	0.686	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-27.1	-175.6	0	0	0	0	0	113.6
192	D	92.2	Very high	94.2	Very high	153 Å²	153	32.7 Å²	32.7	82%	0.818	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-17.3	-176.3	-60.9	-43.2	0	0	0	113.5
193	G	93.5	Very high	94.2	Very high	2 Å²	2	42.4 Å²	42.4	2%	0.021	22%	0.219	C	C	.	.	S	Bend	trans	-109	176.2	177.8	0	0	0	0	0	112.5	S169 V189 N217	S169-G193 WeakPolarHBondContact O-CA 3.28Å; V189-G193 VanDerWaalsContact CG1-C 3.41Å; G193-N217 WeakPolarHBondContact O-CB 3.45Å
194	V	95.4	Very high	94.2	Very high	38 Å²	38	43.9 Å²	43.9	23%	0.23	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	135.1	-172.6	-178.4	0	0	0	0	109.7	S169 R170 V171 Y196 N217 V219	S169-V194 PolarHBondContact O-N 3.39Å; R170-V194 WeakPolarHBondContact CA-O 3.29Å; V171-V194 PolarHBondContact N-O 2.96Å; V194-Y196 HydrophobicContact CB-CE2 4.32Å; V194-Y196 HydrophobicContact CG1-CD1 4.47Å; V194-Y196 HydrophobicContact CG1-CD2 4.26Å; V194-Y196 HydrophobicContact CG1-CE1 4.07Å; V194-Y196 HydrophobicContact CG1-CE2 3.83Å; V194-N217 WeakPolarHBondContact CA-O 3.47Å; V194-V219 HydrophobicContact CG1-CG2 4.01Å
195	V	96.5	Very high	94.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	110.4	174.2	-174.2	0	0	0	0	109.3	V171 V182 V185 V189 N217 V218 V219	V171-V195 CarbonylContact O-C 3.54Å; V171-V195 WeakPolarHBondContact O-CA 3.45Å; V182-V195 HydrophobicContact CG1-CG1 3.96Å; V185-V195 HydrophobicContact CG1-CG1 4.29Å; V185-V195 HydrophobicContact CG1-CG2 3.97Å; V189-V195 HydrophobicContact CB-CG2 4.34Å; V189-V195 HydrophobicContact CG2-CG2 4.14Å; V195-N217 PolarHBondContact N-O 2.88Å; V195-V218 HydrophobicContact CB-CG2 4.44Å; V195-V218 WeakPolarHBondContact O-CA 3.32Å; V195-V219 PolarHBondContact O-N 3.35Å
196	Y	96.7	Very high	94	Very high	24 Å²	24	52.3 Å²	52.3	9%	0.094	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	111.7	171.7	-60.4	-81.5	0	0	0	108.7	V171 Y173 V194 V219 I221 L234 V235 V238	V171-Y196 PolarHBondContact O-N 3.27Å; Y173-Y196 PolarHBondContact N-O 2.91Å; V194-Y196 HydrophobicContact CB-CE2 4.32Å; V194-Y196 HydrophobicContact CG1-CD1 4.47Å; V194-Y196 HydrophobicContact CG1-CD2 4.26Å; V194-Y196 HydrophobicContact CG1-CE1 4.07Å; V194-Y196 HydrophobicContact CG1-CE2 3.83Å; Y196-V219 HydrophobicContact CD1-CB 3.89Å; Y196-V219 HydrophobicContact CD1-CG1 4.19Å; Y196-V219 HydrophobicContact CD1-CG2 4.3Å; Y196-V219 HydrophobicContact CE1-CB 4.3Å; Y196-V219 HydrophobicContact CE1-CG2 4.25Å; Y196-I221 HydrophobicContact CD1-CD1 4.29Å; Y196-L234 VanDerWaalsContact CE1-O 3.28Å; Y196-L234 WeakPolarHBondContact CE1-O 3.5Å; Y196-V235 HydrophobicContact CD1-CB 4.4Å; Y196-V235 HydrophobicContact CD1-CG1 4.44Å; Y196-V235 HydrophobicContact CD1-CG2 3.93Å; Y196-V235 HydrophobicContact CD2-CG1 4.13Å; Y196-V235 HydrophobicContact CE2-CG1 4.45Å; Y196-V235 HydrophobicContact CG-CG1 4.12Å; Y196-V235 HydrophobicContact CG-CG2 4.12Å; Y196-V238 HydrophobicContact CD2-CG1 3.82Å; Y196-V238 HydrophobicContact CE2-CG1 3.96Å
197	A	96.6	Very high	93.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	104.2	-174.3	0	0	0	0	0	110.5	A176 V182 L208 V218 V219 I221	A176-A197 HydrophobicContact CB-CB 3.84Å; V182-A197 HydrophobicContact CG1-CB 3.87Å; V182-A197 HydrophobicContact CG2-CB 4.33Å; A197-L208 HydrophobicContact CB-CD1 3.9Å; A197-L208 HydrophobicContact CB-CD2 3.85Å; A197-L208 HydrophobicContact CB-CG 4.36Å; A197-V218 HydrophobicContact CB-CG1 4.15Å; A197-V219 PolarHBondContact N-O 3.43Å; A197-I221 PolarHBondContact O-N 3.26Å
198	V	96	Very high	93.9	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	124.2	-179.1	-176.3	0	0	0	0	110	L172 Y173 L174 G175 A176 I221 E223 A225 Y231	L172-V198 HydrophobicContact CD1-CG2 3.71Å; Y173-V198 PolarHBondContact O-N 3.09Å; L174-V198 HydrophobicContact CD2-CB 4.12Å; L174-V198 HydrophobicContact CD2-CG2 4.05Å; G175-V198 PolarHBondContact N-O 2.87Å; A176-V198 PolarHBondContact N-O 3.3Å; V198-I221 WeakPolarHBondContact CA-O 3.31Å; V198-I221 HydrophobicContact CG2-CB 4.23Å; V198-I221 HydrophobicContact CG2-CD1 4.38Å; V198-I221 HydrophobicContact CG2-CG2 4.43Å; V198-E223 WeakPolarHBondContact CG1-O 3.38Å; V198-A225 HydrophobicContact CG1-CB 4.06Å; V198-Y231 HydrophobicContact CG1-CE1 4.43Å; V198-Y231 HydrophobicContact CG2-CE2 4.26Å
199	E	95.5	Very high	93.9	Very high	23 Å²	23	58.9 Å²	58.9	11%	0.107	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	136.5	176.6	-177.3	50.7	-149	0	0	111.2	A176 A177 S201 L208 I221 I222 E223	A176-E199 HydrophobicContact CB-CB 4.31Å; A176-E199 PolarHBondContact N-OE2 3.05Å; A177-E199 WeakPolarHBondContact CA-OE2 3.49Å; A177-E199 PolarHBondContact N-OE2 3.03Å; E199-S201 WeakPolarHBondContact OE1-CB 3.34Å; E199-S201 PolarHBondContact OE1-N 3.3Å; E199-L208 HydrophobicContact CB-CD2 4.02Å; E199-I221 PolarHBondContact N-O 3.14Å; E199-I222 CarbonylContact O-C 3.59Å; E199-I222 WeakPolarHBondContact O-CA 3.35Å; E199-E223 CarbonylContact C-O 3.59Å; E199-E223 PolarHBondContact O-N 2.8Å; E199-E223 VanDerWaalsContact O-N 3.07Å
200	F	93.9	Very high	93.8	Very high	143 Å²	143	62.5 Å²	62.5	63%	0.627	32%	0.315	S	S	*	.			trans	-85.1	-38.8	-179.6	175.9	-113.6	0	0	0	112.3	H202 D224	F200-H202 PolarHBondContact O-N 2.8Å; F200-D224 HydrophobicContact CD2-CB 3.72Å; F200-D224 HydrophobicContact CE2-CB 4.04Å
201	S	93.3	Very high	93.9	Very high	41 Å²	41	62.2 Å²	62.2	29%	0.287	31%	0.309	S	S	.	.			trans	-73.9	126.5	-173.8	173.2	0	0	0	0	111.8	E199 R203 S204 G205	E199-S201 WeakPolarHBondContact OE1-CB 3.34Å; E199-S201 PolarHBondContact OE1-N 3.3Å; S201-R203 VanDerWaalsContact C-N 3.29Å; S201-R203 PolarHBondContact O-N 3.29Å; S201-R203 PolarHBondContact OG-N 2.7Å; S201-S204 WeakPolarHBondContact CB-OG 3.47Å; S201-S204 PolarHBondContact O-N 2.94Å; S201-S204 PolarHBondContact OG-N 2.75Å; S201-S204 PolarHBondContact OG-OG 3.3Å; S201-G205 WeakPolarHBondContact O-CA 3.33Å; S201-G205 PolarHBondContact O-N 3.27Å
202	H	93.1	Very high	94	Very high	144 Å²	144	59 Å²	59	67%	0.667	28%	0.282	S	S	*	.	H	α-helix	trans	-63	-33.3	173.8	-62.6	-56.8	0	0	0	113.3	F200 R206	F200-H202 PolarHBondContact O-N 2.8Å; H202-R206 WeakPolarHBondContact O-CG 3.26Å; H202-R206 PolarHBondContact O-N 3.3Å; H202-R206 VanDerWaalsContact O-N 3.09Å
203	R	94.3	Very high	94	Very high	204 Å²	204	58.9 Å²	58.9	77%	0.77	27%	0.274	S	S	*	.	H	α-helix	trans	-67.6	-52.5	178.5	-178.9	-175.5	-69.8	-95.8	2.4	110	S201 G205 R206	S201-R203 VanDerWaalsContact C-N 3.29Å; S201-R203 PolarHBondContact O-N 3.29Å; S201-R203 PolarHBondContact OG-N 2.7Å; R203-G205 VanDerWaalsContact C-N 3.25Å; R203-G205 PolarHBondContact O-N 3.43Å; R203-R206 WeakPolarHBondContact O-CB 3.21Å; R203-R206 PolarHBondContact O-N 3.14Å; R203-R206 VanDerWaalsContact O-N 3.15Å
204	S	92.9	Very high	93.8	Very high	30 Å²	30	63.1 Å²	63.1	21%	0.21	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-36.4	177.5	-47.7	0	0	0	0	111.2	A177 S201 R206 D207 L208	A177-S204 WeakPolarHBondContact O-CB 3.22Å; S201-S204 WeakPolarHBondContact CB-OG 3.47Å; S201-S204 PolarHBondContact O-N 2.94Å; S201-S204 PolarHBondContact OG-N 2.75Å; S201-S204 PolarHBondContact OG-OG 3.3Å; S204-R206 VanDerWaalsContact C-N 3.3Å; S204-R206 PolarHBondContact O-N 3.47Å; S204-D207 WeakPolarHBondContact O-CB 3.43Å; S204-D207 PolarHBondContact O-N 3Å; S204-D207 VanDerWaalsContact O-N 3.14Å; S204-L208 PolarHBondContact O-N 3.05Å
205	G	92.6	Very high	93.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.4	-31.9	174.7	0	0	0	0	0	113.9	S201 R203 L208 L209	S201-G205 WeakPolarHBondContact O-CA 3.33Å; S201-G205 PolarHBondContact O-N 3.27Å; R203-G205 VanDerWaalsContact C-N 3.25Å; R203-G205 PolarHBondContact O-N 3.43Å; G205-L208 PolarHBondContact O-N 3.23Å; G205-L209 WeakPolarHBondContact O-CB 3.22Å; G205-L209 VanDerWaalsContact O-CG 3.25Å; G205-L209 WeakPolarHBondContact O-CG 3.46Å; G205-L209 PolarHBondContact O-N 2.81Å
206	R	93.3	Very high	93.4	Very high	179 Å²	179	67.7 Å²	67.7	68%	0.675	32%	0.322	S	S	*	.	H	α-helix	trans	-65.4	-41.9	172.4	-72.9	171.8	-177.4	-174	0.5	111.8	H202 R203 S204 L209 N210	H202-R206 WeakPolarHBondContact O-CG 3.26Å; H202-R206 PolarHBondContact O-N 3.3Å; H202-R206 VanDerWaalsContact O-N 3.09Å; R203-R206 WeakPolarHBondContact O-CB 3.21Å; R203-R206 PolarHBondContact O-N 3.14Å; R203-R206 VanDerWaalsContact O-N 3.15Å; S204-R206 VanDerWaalsContact C-N 3.3Å; S204-R206 PolarHBondContact O-N 3.47Å; R206-L209 PolarHBondContact O-N 3.45Å; R206-N210 PolarHBondContact O-N 2.81Å; R206-N210 VanDerWaalsContact O-N 3.09Å; R206-N210 PolarHBondContact O-ND2 3.35Å
207	D	93.1	Very high	93.3	Very high	80 Å²	80	66.9 Å²	66.9	43%	0.428	32%	0.319	S	S	.	.	H	α-helix	trans	-66.7	-43.9	176.6	-61.9	-31.9	0	0	0	110.4	S204 L209 N210 V211	S204-D207 WeakPolarHBondContact O-CB 3.43Å; S204-D207 PolarHBondContact O-N 3Å; S204-D207 VanDerWaalsContact O-N 3.14Å; D207-L209 PolarHBondContact O-N 2.97Å; D207-N210 WeakPolarHBondContact O-CB 3.37Å; D207-N210 PolarHBondContact O-N 2.85Å; D207-N210 VanDerWaalsContact O-N 3.11Å; D207-V211 WeakPolarHBondContact O-CG2 3.42Å; D207-V211 PolarHBondContact O-N 2.75Å
208	L	94	Very high	93.2	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.6	-42.9	175.3	-177.4	64.7	0	0	0	112.3	A176 V182 A197 E199 S204 G205 N210 V211 A212 P220	A176-L208 HydrophobicContact CB-CD1 4.15Å; A176-L208 HydrophobicContact CB-CD2 3.84Å; V182-L208 HydrophobicContact CG1-CD1 4.38Å; A197-L208 HydrophobicContact CB-CD1 3.9Å; A197-L208 HydrophobicContact CB-CD2 3.85Å; A197-L208 HydrophobicContact CB-CG 4.36Å; E199-L208 HydrophobicContact CB-CD2 4.02Å; S204-L208 PolarHBondContact O-N 3.05Å; G205-L208 PolarHBondContact O-N 3.23Å; L208-N210 VanDerWaalsContact C-N 3.31Å; L208-N210 PolarHBondContact O-N 2.82Å; L208-V211 PolarHBondContact O-N 2.79Å; L208-A212 WeakPolarHBondContact O-CB 3.48Å; L208-A212 PolarHBondContact O-N 2.91Å; L208-P220 HydrophobicContact CD2-CB 4.05Å; L208-P220 HydrophobicContact CG-CB 4Å
209	L	93.9	Very high	93.2	Very high	72 Å²	72	69.7 Å²	69.7	38%	0.377	34%	0.336	S	S	.	.	H	α-helix	trans	-60.1	-40.8	174.1	-80.4	166.4	0	0	0	111.8	G205 R206 D207 A212 K213 P220 I222	G205-L209 WeakPolarHBondContact O-CB 3.22Å; G205-L209 VanDerWaalsContact O-CG 3.25Å; G205-L209 WeakPolarHBondContact O-CG 3.46Å; G205-L209 PolarHBondContact O-N 2.81Å; R206-L209 PolarHBondContact O-N 3.45Å; D207-L209 PolarHBondContact O-N 2.97Å; L209-A212 PolarHBondContact O-N 3.15Å; L209-K213 WeakPolarHBondContact O-CG 3.43Å; L209-K213 PolarHBondContact O-N 3.5Å; L209-P220 HydrophobicContact CD2-CB 4.09Å; L209-P220 HydrophobicContact CD2-CG 3.53Å; L209-P220 HydrophobicContact CG-CB 4.47Å; L209-P220 HydrophobicContact CG-CG 4.38Å; L209-I222 HydrophobicContact CD1-CD1 3.64Å; L209-I222 HydrophobicContact CG-CD1 4.13Å
210	N	92.3	Very high	93.2	Very high	77 Å²	77	70.3 Å²	70.3	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-42.3	176.4	-71.1	-30	0	0	0	111.5	R206 D207 L208 A212 K213 H214	R206-N210 PolarHBondContact O-N 2.81Å; R206-N210 VanDerWaalsContact O-N 3.09Å; R206-N210 PolarHBondContact O-ND2 3.35Å; D207-N210 WeakPolarHBondContact O-CB 3.37Å; D207-N210 PolarHBondContact O-N 2.85Å; D207-N210 VanDerWaalsContact O-N 3.11Å; L208-N210 VanDerWaalsContact C-N 3.31Å; L208-N210 PolarHBondContact O-N 2.82Å; N210-A212 VanDerWaalsContact C-N 3.31Å; N210-A212 PolarHBondContact O-N 3.01Å; N210-K213 PolarHBondContact O-N 2.82Å; N210-K213 PolarHBondContact OD1-NZ 3.1Å; N210-H214 PolarHBondContact O-CD2 3.39Å
211	V	91.4	Very high	93.3	Very high	13 Å²	13	63.7 Å²	63.7	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-40.4	174.3	178.4	0	0	0	0	111.7	V124 D207 L208 H214 R215	V124-V211 HydrophobicContact CG1-CG1 4.45Å; V124-V211 HydrophobicContact CG1-CG2 3.65Å; D207-V211 WeakPolarHBondContact O-CG2 3.42Å; D207-V211 PolarHBondContact O-N 2.75Å; L208-V211 PolarHBondContact O-N 2.79Å; V211-H214 PolarHBondContact O-N 2.87Å; V211-R215 PolarHBondContact O-N 3.48Å
212	A	92.6	Very high	93.4	Very high	14 Å²	14	64.2 Å²	64.2	12%	0.116	31%	0.312	C	S	.	.	H	α-helix	trans	-70.2	-27.1	-179.8	0	0	0	0	0	113.6	L208 L209 N210 H214 R215 V218 P220	L208-A212 WeakPolarHBondContact O-CB 3.48Å; L208-A212 PolarHBondContact O-N 2.91Å; L209-A212 PolarHBondContact O-N 3.15Å; N210-A212 VanDerWaalsContact C-N 3.31Å; N210-A212 PolarHBondContact O-N 3.01Å; A212-H214 PolarHBondContact O-N 2.63Å; A212-R215 CarbonylContact O-C 3.59Å; A212-R215 PolarHBondContact O-N 3.48Å; A212-V218 HydrophobicContact CB-CB 4.29Å; A212-V218 HydrophobicContact CB-CG1 4.17Å; A212-P220 HydrophobicContact CB-CB 4.27Å; A212-P220 HydrophobicContact CB-CG 3.72Å
213	K	92.1	Very high	93.5	Very high	151 Å²	151	60.8 Å²	60.8	66%	0.657	30%	0.297	S	S	*	.	H	α-helix	trans	-58.7	-36.3	173.4	-75.9	171.6	-173.6	165.2	0	112.4	L209 N210	L209-K213 WeakPolarHBondContact O-CG 3.43Å; L209-K213 PolarHBondContact O-N 3.5Å; N210-K213 PolarHBondContact O-N 2.82Å; N210-K213 PolarHBondContact OD1-NZ 3.1Å
214	H	90.1	Very high	93.4	Very high	91 Å²	91	52.4 Å²	52.4	42%	0.421	27%	0.267	S	S	.	.	H	α-helix	trans	-86.5	-26.1	-179.2	-61.2	-76	0	0	0	112	V119 E122 N210 V211 A212	V119-H214 HydrophobicContact CG1-CB 4.47Å; V119-H214 HydrophobicContact CG2-CB 4.35Å; V119-H214 WeakPolarHBondContact CG2-O 3.48Å; E122-H214 IonicContact OE1-CD2 3.17Å; E122-H214 PolarHBondContact OE1-CD2 2.82Å; E122-H214 IonicContact OE1-CE1 3.89Å; E122-H214 IonicContact OE1-CG 3.35Å; E122-H214 IonicContact OE1-ND1 3.79Å; E122-H214 IonicContact OE1-NE2 3.61Å; E122-H214 IonicContact OE2-CD2 3.73Å; E122-H214 IonicContact OE2-CE1 3.42Å; E122-H214 PolarHBondContact OE2-CE1 3.01Å; E122-H214 IonicContact OE2-CG 3.15Å; E122-H214 IonicContact OE2-ND1 2.92Å; E122-H214 PolarHBondContact OE2-ND1 3.45Å; E122-H214 IonicContact OE2-NE2 3.93Å; N210-H214 PolarHBondContact O-CD2 3.39Å; V211-H214 PolarHBondContact O-N 2.87Å; A212-H214 PolarHBondContact O-N 2.63Å
215	R	92	Very high	93.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.262	C	S	.	.			trans	-112.8	100.2	-176.7	-72.5	174.2	177.4	66.7	10.3	111.6	V119 S186 D187 V211 A212 N217 V218	V119-R215 HydrophobicContact CG2-CG 3.92Å; S186-R215 WeakPolarHBondContact OG-CD 3.3Å; D187-R215 IonicContact OD1-NE 3.98Å; V211-R215 PolarHBondContact O-N 3.48Å; A212-R215 CarbonylContact O-C 3.59Å; A212-R215 PolarHBondContact O-N 3.48Å; R215-N217 PolarHBondContact O-N 3.39Å; R215-N217 VanDerWaalsContact O-N 3.17Å; R215-V218 HydrophobicContact CB-CB 4.42Å; R215-V218 HydrophobicContact CB-CG2 3.94Å; R215-V218 PolarHBondContact O-N 3.29Å; R215-V218 VanDerWaalsContact O-N 3.1Å
216	T	92.1	Very high	93.5	Very high	135 Å²	135	55.4 Å²	55.4	83%	0.828	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.7	-176	52.9	0	0	0	0	114.7
217	N	94.4	Very high	93.6	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.037	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-1.8	177.5	64.5	-18.3	0	0	0	114.1	S186 G190 G193 V194 V195 R215	S186-N217 PolarHBondContact O-ND2 2.79Å; S186-N217 PolarHBondContact OG-ND2 2.87Å; S186-N217 PolarHBondContact OG-OD1 3.02Å; G190-N217 PolarHBondContact O-ND2 2.8Å; G193-N217 WeakPolarHBondContact O-CB 3.45Å; V194-N217 WeakPolarHBondContact CA-O 3.47Å; V195-N217 PolarHBondContact N-O 2.88Å; R215-N217 PolarHBondContact O-N 3.39Å; R215-N217 VanDerWaalsContact O-N 3.17Å
218	V	95.3	Very high	93.6	Very high	8 Å²	8	46.8 Å²	46.8	5%	0.048	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.8	177.8	-178.7	0	0	0	0	110	V182 V195 A197 A212 R215 P220	V182-V218 HydrophobicContact CG1-CG1 3.91Å; V182-V218 HydrophobicContact CG1-CG2 4.34Å; V195-V218 HydrophobicContact CB-CG2 4.44Å; V195-V218 WeakPolarHBondContact O-CA 3.32Å; A197-V218 HydrophobicContact CB-CG1 4.15Å; A212-V218 HydrophobicContact CB-CB 4.29Å; A212-V218 HydrophobicContact CB-CG1 4.17Å; R215-V218 HydrophobicContact CB-CB 4.42Å; R215-V218 HydrophobicContact CB-CG2 3.94Å; R215-V218 PolarHBondContact O-N 3.29Å; R215-V218 VanDerWaalsContact O-N 3.1Å; V218-P220 WeakPolarHBondContact O-CD 3.33Å
219	V	95.3	Very high	93.5	Very high	51 Å²	51	51 Å²	51	31%	0.309	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	105.6	174.2	-177.9	0	0	0	0	108.7	V194 V195 Y196 A197 I221	V194-V219 HydrophobicContact CG1-CG2 4.01Å; V195-V219 PolarHBondContact O-N 3.35Å; Y196-V219 HydrophobicContact CD1-CB 3.89Å; Y196-V219 HydrophobicContact CD1-CG1 4.19Å; Y196-V219 HydrophobicContact CD1-CG2 4.3Å; Y196-V219 HydrophobicContact CE1-CB 4.3Å; Y196-V219 HydrophobicContact CE1-CG2 4.25Å; A197-V219 PolarHBondContact N-O 3.43Å; V219-I221 HydrophobicContact CG1-CG1 4.37Å
220	P	95.7	Very high	93.5	Very high	37 Å²	37	52.9 Å²	52.9	24%	0.24	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	129.6	179.4	31.6	-32.8	0	0	0	110.6	L208 L209 A212 V218	L208-P220 HydrophobicContact CD2-CB 4.05Å; L208-P220 HydrophobicContact CG-CB 4Å; L209-P220 HydrophobicContact CD2-CB 4.09Å; L209-P220 HydrophobicContact CD2-CG 3.53Å; L209-P220 HydrophobicContact CG-CB 4.47Å; L209-P220 HydrophobicContact CG-CG 4.38Å; A212-P220 HydrophobicContact CB-CB 4.27Å; A212-P220 HydrophobicContact CB-CG 3.72Å; V218-P220 WeakPolarHBondContact O-CD 3.33Å
221	I	95.6	Very high	93.7	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	108.2	-179.5	-59.8	175.9	0	0	0	107.7	Y196 A197 V198 E199 V219 E223 Y231 L234 V235	Y196-I221 HydrophobicContact CD1-CD1 4.29Å; A197-I221 PolarHBondContact O-N 3.26Å; V198-I221 WeakPolarHBondContact CA-O 3.31Å; V198-I221 HydrophobicContact CG2-CB 4.23Å; V198-I221 HydrophobicContact CG2-CD1 4.38Å; V198-I221 HydrophobicContact CG2-CG2 4.43Å; E199-I221 PolarHBondContact N-O 3.14Å; V219-I221 HydrophobicContact CG1-CG1 4.37Å; I221-E223 HydrophobicContact CG2-CB 4.08Å; I221-E223 PolarHBondContact O-N 3.46Å; I221-Y231 HydrophobicContact CG2-CD1 4.2Å; I221-Y231 HydrophobicContact CG2-CD2 4.5Å; I221-Y231 HydrophobicContact CG2-CG 3.9Å; I221-L234 HydrophobicContact CD1-CB 4.16Å; I221-L234 HydrophobicContact CD1-CD1 4.5Å; I221-L234 HydrophobicContact CG1-CD1 4.19Å; I221-L234 HydrophobicContact CG2-CD1 4.42Å; I221-V235 HydrophobicContact CD1-CG2 3.23Å
222	I	95	Very high	93.7	Very high	52 Å²	52	56.8 Å²	56.8	27%	0.267	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	77.7	-179.9	-52.9	175.7	0	0	0	108.9	E199 L209	E199-I222 CarbonylContact O-C 3.59Å; E199-I222 WeakPolarHBondContact O-CA 3.35Å; L209-I222 HydrophobicContact CD1-CD1 3.64Å; L209-I222 HydrophobicContact CG-CD1 4.13Å
223	E	94.8	Very high	93.7	Very high	72 Å²	72	64.4 Å²	64.4	34%	0.336	31%	0.308	S	S	.	.	S	Bend	trans	-146.9	163.1	-179.3	-86.1	-63.1	166.9	0	0	111.5	V198 E199 I221 A225 K230 Y231	V198-E223 WeakPolarHBondContact CG1-O 3.38Å; E199-E223 CarbonylContact C-O 3.59Å; E199-E223 PolarHBondContact O-N 2.8Å; E199-E223 VanDerWaalsContact O-N 3.07Å; I221-E223 HydrophobicContact CG2-CB 4.08Å; I221-E223 PolarHBondContact O-N 3.46Å; E223-A225 PolarHBondContact O-N 3.42Å; E223-K230 HydrophobicContact CG-CB 4.44Å; E223-K230 WeakPolarHBondContact OE2-CD 3.49Å; E223-K230 IonicContact OE2-NZ 3.04Å; E223-Y231 HydrophobicContact CB-CD1 3.74Å; E223-Y231 HydrophobicContact CB-CE1 4.32Å; E223-Y231 HydrophobicContact CG-CD1 4.39Å
224	D	93.7	Very high	93.8	Very high	28 Å²	28	62.1 Å²	62.1	15%	0.15	30%	0.303	C	S	.	.			trans	-75.2	118.4	175.9	-175.8	-0.1	0	0	0	111.5	F200 R226 H227	F200-D224 HydrophobicContact CD2-CB 3.72Å; F200-D224 HydrophobicContact CE2-CB 4.04Å; D224-R226 PolarHBondContact O-N 3.22Å; D224-R226 WeakPolarHBondContact OD1-CB 3.3Å; D224-R226 WeakPolarHBondContact OD1-CG 3.47Å; D224-R226 PolarHBondContact OD1-N 3.33Å; D224-H227 PolarHBondContact O-N 3.29Å; D224-H227 IonicContact OD2-CE1 2.6Å; D224-H227 PolarHBondContact OD2-CE1 3.47Å; D224-H227 IonicContact OD2-ND1 2.75Å; D224-H227 PolarHBondContact OD2-ND1 3.08Å; D224-H227 VanDerWaalsContact OD2-ND1 3.14Å
225	A	94	Very high	93.9	Very high	11 Å²	11	58.2 Å²	58.2	9%	0.091	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.8	177.2	0	0	0	0	0	113.8	L174 V198 E223 H227 I253 N257	L174-A225 HydrophobicContact CD2-CB 4.26Å; V198-A225 HydrophobicContact CG1-CB 4.06Å; E223-A225 PolarHBondContact O-N 3.42Å; A225-H227 PolarHBondContact O-N 3.07Å; A225-I253 HydrophobicContact CB-CG2 3.82Å; A225-N257 PolarHBondContact O-ND2 3.48Å
226	R	93.3	Very high	93.9	Very high	82 Å²	82	59.7 Å²	59.7	31%	0.309	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.7	173.6	-66.8	176.3	164.5	146.1	7.8	113.5	D224 P228 D249 I253	D224-R226 PolarHBondContact O-N 3.22Å; D224-R226 WeakPolarHBondContact OD1-CB 3.3Å; D224-R226 WeakPolarHBondContact OD1-CG 3.47Å; D224-R226 PolarHBondContact OD1-N 3.33Å; R226-P228 VanDerWaalsContact C-CD 3.45Å; R226-P228 WeakPolarHBondContact O-CD 3.31Å; R226-D249 IonicContact CZ-OD1 3.71Å; R226-D249 IonicContact CZ-OD2 3.69Å; R226-D249 IonicContact NE-OD1 2.8Å; R226-D249 PolarHBondContact NE-OD1 3.44Å; R226-D249 IonicContact NE-OD2 3.45Å; R226-D249 PolarHBondContact NE-OD2 3.29Å; R226-D249 IonicContact NH2-OD1 2.73Å; R226-D249 PolarHBondContact NH2-OD1 3.13Å; R226-D249 IonicContact NH2-OD2 3.71Å; R226-I253 HydrophobicContact CG-CD1 3.8Å; R226-I253 HydrophobicContact CG-CG1 3.79Å
227	H	94.2	Very high	94	Very high	75 Å²	75	57.5 Å²	57.5	35%	0.347	28%	0.282	S	S	.	.			trans	-123.2	67.3	-171	-58.3	106	0	0	0	111.4	D224 A225 H229 K230	D224-H227 PolarHBondContact O-N 3.29Å; D224-H227 IonicContact OD2-CE1 2.6Å; D224-H227 PolarHBondContact OD2-CE1 3.47Å; D224-H227 IonicContact OD2-ND1 2.75Å; D224-H227 PolarHBondContact OD2-ND1 3.08Å; D224-H227 VanDerWaalsContact OD2-ND1 3.14Å; A225-H227 PolarHBondContact O-N 3.07Å; H227-H229 AromaticContact CD2-CE1 3.83Å; H227-H229 PolarHBondContact O-N 2.9Å; H227-K230 HydrophobicContact CB-CD 4.05Å; H227-K230 HydrophobicContact CB-CG 4.09Å; H227-K230 WeakPolarHBondContact O-CB 3.35Å; H227-K230 PolarHBondContact O-N 3.22Å
228	P	93.6	Very high	94.1	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.013	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58.8	-27.5	-175	19.4	-29.4	0	0	0	113.9	R226 K230 Y231 R232 V256 Y260 Y261	R226-P228 VanDerWaalsContact C-CD 3.45Å; R226-P228 WeakPolarHBondContact O-CD 3.31Å; P228-K230 PolarHBondContact O-N 3.1Å; P228-K230 VanDerWaalsContact O-N 3.07Å; P228-Y231 HydrophobicContact CB-CE2 4.25Å; P228-Y231 PolarHBondContact O-N 2.84Å; P228-R232 PolarHBondContact O-N 2.6Å; P228-V256 HydrophobicContact CG-CB 4.24Å; P228-V256 HydrophobicContact CG-CG1 3.44Å; P228-V256 VanDerWaalsContact CG-CG1 3.44Å; P228-Y260 HydrophobicContact CB-CD2 4.39Å; P228-Y260 HydrophobicContact CB-CG 4.17Å; P228-Y260 HydrophobicContact CG-CD2 3.94Å; P228-Y260 HydrophobicContact CG-CE2 4.24Å; P228-Y260 HydrophobicContact CG-CG 4.23Å; P228-Y261 HydrophobicContact CB-CD2 4.48Å; P228-Y261 HydrophobicContact CB-CE2 3.58Å; P228-Y261 PolarHBondContact O-OH 2.9Å
229	H	93.2	Very high	94.1	Very high	88 Å²	88	59.1 Å²	59.1	41%	0.407	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-56.9	-24.4	176	64.4	-91.2	0	0	0	114.2	H227 R232 Y260	H227-H229 AromaticContact CD2-CE1 3.83Å; H227-H229 PolarHBondContact O-N 2.9Å; H229-R232 WeakPolarHBondContact O-CD 3.31Å; H229-R232 VanDerWaalsContact O-CG 3.29Å; H229-R232 WeakPolarHBondContact O-CG 3.29Å; H229-Y260 HydrophobicContact CB-CE1 4.33Å
230	K	93.8	Very high	94.1	Very high	113 Å²	113	56.7 Å²	56.7	49%	0.491	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-69.8	-35.7	179.2	-69	-172.1	176	-174.9	0	113.3	E223 H227 P228	E223-K230 HydrophobicContact CG-CB 4.44Å; E223-K230 WeakPolarHBondContact OE2-CD 3.49Å; E223-K230 IonicContact OE2-NZ 3.04Å; H227-K230 HydrophobicContact CB-CD 4.05Å; H227-K230 HydrophobicContact CB-CG 4.09Å; H227-K230 WeakPolarHBondContact O-CB 3.35Å; H227-K230 PolarHBondContact O-N 3.22Å; P228-K230 PolarHBondContact O-N 3.1Å; P228-K230 VanDerWaalsContact O-N 3.07Å
231	Y	95.1	Very high	94.1	Very high	2 Å²	2	55 Å²	55	1%	0.008	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-108.7	18.8	-179.6	51.8	-93	0	0	0	113.3	V198 I221 E223 P228 M233 L234 V235 N257 Y261	V198-Y231 HydrophobicContact CG1-CE1 4.43Å; V198-Y231 HydrophobicContact CG2-CE2 4.26Å; I221-Y231 HydrophobicContact CG2-CD1 4.2Å; I221-Y231 HydrophobicContact CG2-CD2 4.5Å; I221-Y231 HydrophobicContact CG2-CG 3.9Å; E223-Y231 HydrophobicContact CB-CD1 3.74Å; E223-Y231 HydrophobicContact CB-CE1 4.32Å; E223-Y231 HydrophobicContact CG-CD1 4.39Å; P228-Y231 HydrophobicContact CB-CE2 4.25Å; P228-Y231 PolarHBondContact O-N 2.84Å; Y231-M233 PolarHBondContact O-N 3.43Å; Y231-M233 VanDerWaalsContact O-N 3.1Å; Y231-L234 PolarHBondContact O-N 3.12Å; Y231-V235 HydrophobicContact CD2-CG2 3.74Å; Y231-V235 HydrophobicContact CE2-CG2 4.34Å; Y231-V235 PolarHBondContact O-N 3.47Å; Y231-N257 PolarHBondContact OH-OD1 2.87Å; Y231-Y261 VanDerWaalsContact C-OH 3.3Å; Y231-Y261 AromaticContact CD2-CE2 3.88Å; Y231-Y261 HydrophobicContact CD2-CE2 3.88Å; Y231-Y261 AromaticContact CD2-CZ 3.82Å; Y231-Y261 VanDerWaalsContact CD2-OH 3.29Å; Y231-Y261 WeakPolarHBondContact CD2-OH 3.14Å; Y231-Y261 HydrophobicContact CE2-CD2 4.33Å; Y231-Y261 AromaticContact CE2-CE2 3.38Å; Y231-Y261 HydrophobicContact CE2-CE2 3.38Å; Y231-Y261 AromaticContact CE2-CZ 3.84Å; Y231-Y261 PolarHBondContact O-OH 2.82Å
232	R	92.4	Very high	94.1	Very high	170 Å²	170	54.8 Å²	54.8	64%	0.642	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-23.4	179.1	76	-177.7	-176.2	-176.6	-0.4	114.8	P228 H229 Y261	P228-R232 PolarHBondContact O-N 2.6Å; H229-R232 WeakPolarHBondContact O-CD 3.31Å; H229-R232 VanDerWaalsContact O-CG 3.29Å; H229-R232 WeakPolarHBondContact O-CG 3.29Å; R232-Y261 WeakPolarHBondContact CA-OH 3.22Å; R232-Y261 PolarHBondContact N-OH 3.11Å; R232-Y261 VanDerWaalsContact N-OH 3.08Å
233	M	92.8	Very high	94.1	Very high	173 Å²	173	52.3 Å²	52.3	85%	0.852	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-17.7	177.9	-64.7	-173.8	66.6	0	0	112.9	Y231	Y231-M233 PolarHBondContact O-N 3.43Å; Y231-M233 VanDerWaalsContact O-N 3.1Å
234	L	92.9	Very high	94	Very high	104 Å²	104	50.3 Å²	50.3	55%	0.545	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-36.3	-175	-59.2	177.2	0	0	0	112.3	Y196 I221 Y231	Y196-L234 VanDerWaalsContact CE1-O 3.28Å; Y196-L234 WeakPolarHBondContact CE1-O 3.5Å; I221-L234 HydrophobicContact CD1-CB 4.16Å; I221-L234 HydrophobicContact CD1-CD1 4.5Å; I221-L234 HydrophobicContact CG1-CD1 4.19Å; I221-L234 HydrophobicContact CG2-CD1 4.42Å; Y231-L234 PolarHBondContact O-N 3.12Å
235	V	92.5	Very high	93.9	Very high	9 Å²	9	49.8 Å²	49.8	6%	0.055	24%	0.24	C	C	.	.			trans	-99.7	118	-173	-176.6	0	0	0	0	110.3	L172 Y196 I221 Y231 V238 Y261	L172-V235 HydrophobicContact CD1-CG1 4.26Å; L172-V235 HydrophobicContact CD1-CG2 4.41Å; Y196-V235 HydrophobicContact CD1-CB 4.4Å; Y196-V235 HydrophobicContact CD1-CG1 4.44Å; Y196-V235 HydrophobicContact CD1-CG2 3.93Å; Y196-V235 HydrophobicContact CD2-CG1 4.13Å; Y196-V235 HydrophobicContact CE2-CG1 4.45Å; Y196-V235 HydrophobicContact CG-CG1 4.12Å; Y196-V235 HydrophobicContact CG-CG2 4.12Å; I221-V235 HydrophobicContact CD1-CG2 3.23Å; Y231-V235 HydrophobicContact CD2-CG2 3.74Å; Y231-V235 HydrophobicContact CE2-CG2 4.34Å; Y231-V235 PolarHBondContact O-N 3.47Å; V235-V238 HydrophobicContact CG1-CG1 4.22Å; V235-Y261 HydrophobicContact CB-CD1 3.75Å; V235-Y261 HydrophobicContact CB-CE1 3.59Å; V235-Y261 HydrophobicContact CB-CE2 4.47Å; V235-Y261 HydrophobicContact CB-CG 4.25Å; V235-Y261 HydrophobicContact CG1-CD1 3.53Å; V235-Y261 HydrophobicContact CG1-CD2 4.18Å; V235-Y261 HydrophobicContact CG1-CE1 3.93Å; V235-Y261 HydrophobicContact CG1-CG 3.67Å; V235-Y261 WeakPolarHBondContact O-CD1 3.3Å; V235-Y261 WeakPolarHBondContact O-CE1 3.47Å
236	G	92.2	Very high	93.5	Very high	30 Å²	30	51.8 Å²	51.8	31%	0.309	26%	0.256	S	S	.	.			trans	-82.5	-178.9	168.8	0	0	0	0	0	112.8	V238	G236-V238 WeakPolarHBondContact O-CG1 3.47Å; G236-V238 PolarHBondContact O-N 2.94Å
237	M	94.8	Very high	93.3	Very high	90 Å²	90	51.5 Å²	51.5	44%	0.443	26%	0.259	S	S	.	.			trans	-60.7	126.4	175.7	-65.4	-61.1	-67.3	0	0	111.6	Y261 L262 K263	M237-Y261 CarbonylContact C-O 3.52Å; M237-Y261 VanDerWaalsContact CA-O 3.3Å; M237-Y261 WeakPolarHBondContact CA-O 3.36Å; M237-L262 WeakPolarHBondContact CE-O 3.44Å; M237-K263 HydrophobicContact CB-CG 3.92Å; M237-K263 HydrophobicContact CE-CB 4.35Å; M237-K263 HydrophobicContact CE-CG 3.93Å
238	V	96	Very high	93.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	155.2	-177.6	-61	0	0	0	0	112.4	R170 L172 Y196 V235 G236 I241 Y261 L262 K263	R170-V238 HydrophobicContact CB-CB 4.39Å; R170-V238 HydrophobicContact CB-CG1 4.31Å; L172-V238 HydrophobicContact CB-CB 4.39Å; L172-V238 HydrophobicContact CB-CG1 4.06Å; L172-V238 HydrophobicContact CB-CG2 3.93Å; Y196-V238 HydrophobicContact CD2-CG1 3.82Å; Y196-V238 HydrophobicContact CE2-CG1 3.96Å; V235-V238 HydrophobicContact CG1-CG1 4.22Å; G236-V238 WeakPolarHBondContact O-CG1 3.47Å; G236-V238 PolarHBondContact O-N 2.94Å; V238-I241 HydrophobicContact CG2-CG1 4.15Å; V238-Y261 WeakPolarHBondContact CG2-O 3.16Å; V238-Y261 PolarHBondContact N-O 3.3Å; V238-L262 HydrophobicContact CG2-CD1 4.19Å; V238-K263 WeakPolarHBondContact O-CG 3.46Å; V238-K263 PolarHBondContact O-N 3.34Å
239	D	95.1	Very high	93	Very high	49 Å²	49	53.6 Å²	53.6	26%	0.262	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-35.7	179.7	-56.3	-57.5	0	0	0	111.8	R170 L262 K263 G266 H267	R170-D239 PolarHBondContact N-OD2 3.27Å; R170-D239 PolarHBondContact O-N 2.75Å; D239-L262 WeakPolarHBondContact O-CD1 3.22Å; D239-K263 WeakPolarHBondContact OD1-CD 3.39Å; D239-K263 WeakPolarHBondContact OD1-CE 3.36Å; D239-K263 IonicContact OD1-NZ 2.71Å; D239-K263 PolarHBondContact OD1-NZ 3.09Å; D239-K263 IonicContact OD2-NZ 3.21Å; D239-G266 WeakPolarHBondContact O-CA 3.39Å; D239-H267 PolarHBondContact O-N 3.03Å
240	C	95	Very high	92.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	139.8	-178.1	-170.9	0	0	0	0	111.7	R170 V171 L172 H267	R170-C240 PolarHBondContact O-N 3.43Å; V171-C240 WeakPolarHBondContact CA-O 3.33Å; V171-C240 HydrophobicContact CG2-CB 4.5Å; L172-C240 PolarHBondContact N-O 3.46Å; C240-H267 CarbonylContact C-O 3.59Å; C240-H267 VanDerWaalsContact CA-O 3.22Å; C240-H267 WeakPolarHBondContact CA-O 3.44Å
241	I	96.2	Very high	92.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.2	166.3	-66.3	176	0	0	0	108.4	L172 L174 V238 N257 A258 L262 H267 A268 V269	L172-I241 HydrophobicContact CB-CG1 4.14Å; L172-I241 HydrophobicContact CD2-CD1 4.27Å; L172-I241 HydrophobicContact CD2-CG1 4.19Å; L172-I241 CarbonylContact O-C 3.53Å; L172-I241 WeakPolarHBondContact O-CA 3.49Å; L174-I241 HydrophobicContact CD1-CG2 3.79Å; L174-I241 HydrophobicContact CG-CG2 4.14Å; V238-I241 HydrophobicContact CG2-CG1 4.15Å; I241-N257 HydrophobicContact CD1-CB 4.36Å; I241-A258 HydrophobicContact CD1-CB 3.89Å; I241-L262 HydrophobicContact CD1-CB 3.95Å; I241-L262 HydrophobicContact CD1-CD2 4.1Å; I241-L262 HydrophobicContact CD1-CG 4.43Å; I241-L262 HydrophobicContact CG1-CD1 4.23Å; I241-L262 HydrophobicContact CG1-CD2 4.43Å; I241-H267 PolarHBondContact N-O 3.2Å; I241-A268 HydrophobicContact CB-CB 4.4Å; I241-A268 CarbonylContact O-C 3.51Å; I241-A268 WeakPolarHBondContact O-CA 3.38Å; I241-V269 PolarHBondContact O-N 3.45Å
242	F	95.9	Very high	92.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.5	164.9	-175.3	-96.5	0	0	0	109.4	L152 L172 Y173 L174 D244 V269 M316	L152-F242 HydrophobicContact CB-CE2 3.85Å; L152-F242 HydrophobicContact CB-CZ 3.8Å; L152-F242 HydrophobicContact CD1-CD2 3.4Å; L152-F242 VanDerWaalsContact CD1-CD2 3.4Å; L152-F242 HydrophobicContact CD1-CE2 3.33Å; L152-F242 HydrophobicContact CD1-CG 4.22Å; L152-F242 HydrophobicContact CD1-CZ 4.05Å; L152-F242 HydrophobicContact CG-CE2 4.11Å; L172-F242 PolarHBondContact O-N 2.89Å; Y173-F242 CarbonylContact C-O 3.56Å; Y173-F242 WeakPolarHBondContact CA-O 3.46Å; Y173-F242 HydrophobicContact CD1-CD1 4.32Å; Y173-F242 HydrophobicContact CD2-CB 4.13Å; Y173-F242 AromaticContact CD2-CD1 3.66Å; Y173-F242 HydrophobicContact CD2-CD1 3.66Å; Y173-F242 HydrophobicContact CD2-CG 4.24Å; Y173-F242 AromaticContact CE1-CD1 3.91Å; Y173-F242 HydrophobicContact CE1-CD1 3.91Å; Y173-F242 HydrophobicContact CE1-CE1 4.2Å; Y173-F242 HydrophobicContact CE2-CB 4.42Å; Y173-F242 AromaticContact CE2-CD1 3.18Å; Y173-F242 HydrophobicContact CE2-CD1 3.18Å; Y173-F242 AromaticContact CE2-CE1 3.64Å; Y173-F242 HydrophobicContact CE2-CE1 3.64Å; Y173-F242 HydrophobicContact CE2-CG 4.03Å; Y173-F242 HydrophobicContact CG-CD1 4.21Å; Y173-F242 AromaticContact CZ-CD1 3.32Å; Y173-F242 AromaticContact CZ-CE1 3.44Å; Y173-F242 VanDerWaalsContact CZ-CE1 3.44Å; Y173-F242 WeakPolarHBondContact OH-CE1 3.37Å; L174-F242 PolarHBondContact N-O 2.97Å; F242-D244 HydrophobicContact CD1-CB 4.41Å; F242-D244 HydrophobicContact CE1-CB 3.75Å; F242-D244 HydrophobicContact CZ-CB 4.48Å; F242-V269 CarbonylContact C-O 3.6Å; F242-V269 WeakPolarHBondContact CA-O 3.42Å; F242-V269 HydrophobicContact CD2-CB 3.87Å; F242-V269 HydrophobicContact CD2-CG1 3.75Å; F242-V269 HydrophobicContact CE2-CB 4.43Å; F242-V269 HydrophobicContact CE2-CG1 3.81Å; F242-M316 HydrophobicContact CE2-CE 4.02Å; F242-M316 HydrophobicContact CE2-SD 4.21Å; F242-M316 HydrophobicContact CZ-CE 4.23Å
243	A	95	Very high	92.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	112.5	-177.5	0	0	0	0	0	111.5	L174 V254 V269 I270 S271	L174-A243 HydrophobicContact CB-CB 4.47Å; L174-A243 HydrophobicContact CD1-CB 4.47Å; A243-V254 HydrophobicContact CB-CG2 3.48Å; A243-V254 VanDerWaalsContact CB-CG2 3.48Å; A243-V269 PolarHBondContact N-O 2.9Å; A243-I270 HydrophobicContact CB-CG1 4.35Å; A243-I270 HydrophobicContact CB-CG2 4.41Å; A243-S271 PolarHBondContact O-N 3.08Å
244	D	93.2	Very high	92.9	Very high	30 Å²	30	33.2 Å²	33.2	16%	0.16	19%	0.185	C	C	.	.			trans	-119.4	42.3	173.8	-163.6	10.6	0	0	0	111.7	K151 Y173 L174 F242	K151-D244 WeakPolarHBondContact CD-OD1 3Å; K151-D244 WeakPolarHBondContact CE-OD1 3.41Å; K151-D244 IonicContact NZ-OD1 3.99Å; K151-D244 PolarHBondContact NZ-OD1 3.31Å; K151-D244 IonicContact NZ-OD2 3.43Å; K151-D244 PolarHBondContact NZ-OD2 3.29Å; Y173-D244 HydrophobicContact CE1-CB 4.44Å; L174-D244 PolarHBondContact O-N 2.73Å; F242-D244 HydrophobicContact CD1-CB 4.41Å; F242-D244 HydrophobicContact CE1-CB 3.75Å; F242-D244 HydrophobicContact CZ-CB 4.48Å
245	V	90	Very high	93	Very high	18 Å²	18	28.6 Å²	28.6	11%	0.109	16%	0.162	C	C	.	.			trans	-91.2	116.8	-178.8	-177.5	0	0	0	0	109.5	L174 Q247 Q250 I253	L174-V245 HydrophobicContact CB-CG2 3.84Å; V245-Q247 VanDerWaalsContact C-N 3.32Å; V245-Q247 HydrophobicContact CG1-CB 3.91Å; V245-Q247 HydrophobicContact CG1-CG 3.52Å; V245-Q247 PolarHBondContact O-N 3.4Å; V245-Q247 VanDerWaalsContact O-N 3.14Å; V245-Q250 PolarHBondContact O-NE2 2.93Å; V245-I253 HydrophobicContact CG1-CD1 4.04Å
246	A	87.4	Confident	93.1	Very high	52 Å²	52	30.1 Å²	30.1	43%	0.43	17%	0.171	S	C	.	.			trans	-87.1	65.4	175.8	0	0	0	0	0	111.5	C276	A246-C276 HydrophobicContact CB-CB 4.33Å
247	Q	89.2	Confident	93.3	Very high	77 Å²	77	28.7 Å²	28.7	36%	0.36	16%	0.156	S	C	.	.	S	Bend	trans	-126	148.3	177.3	-65.6	-66.8	-61.4	0	0	110.9	V245 D249 Q250 I253	V245-Q247 VanDerWaalsContact C-N 3.32Å; V245-Q247 HydrophobicContact CG1-CB 3.91Å; V245-Q247 HydrophobicContact CG1-CG 3.52Å; V245-Q247 PolarHBondContact O-N 3.4Å; V245-Q247 VanDerWaalsContact O-N 3.14Å; Q247-D249 WeakPolarHBondContact CB-OD1 3.3Å; Q247-D249 PolarHBondContact O-N 2.97Å; Q247-Q250 VanDerWaalsContact O-CB 3.3Å; Q247-Q250 WeakPolarHBondContact O-CB 3.39Å; Q247-Q250 PolarHBondContact O-N 3.05Å; Q247-I253 HydrophobicContact CB-CD1 4.19Å; Q247-I253 HydrophobicContact CG-CD1 4.37Å
248	P	89.5	Confident	93.3	Very high	80 Å²	80	24.4 Å²	24.4	52%	0.519	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.9	175.7	-22.4	32.5	0	0	0	113.6	Q250	P248-Q250 VanDerWaalsContact C-N 3.28Å; P248-Q250 PolarHBondContact O-N 3.1Å
249	D	90.1	Very high	93.2	Very high	40 Å²	40	30.4 Å²	30.4	21%	0.214	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	26.6	177.7	67.4	-39	0	0	0	113.4	R226 Q247 S251 R252 I253	R226-D249 IonicContact CZ-OD1 3.71Å; R226-D249 IonicContact CZ-OD2 3.69Å; R226-D249 IonicContact NE-OD1 2.8Å; R226-D249 PolarHBondContact NE-OD1 3.44Å; R226-D249 IonicContact NE-OD2 3.45Å; R226-D249 PolarHBondContact NE-OD2 3.29Å; R226-D249 IonicContact NH2-OD1 2.73Å; R226-D249 PolarHBondContact NH2-OD1 3.13Å; R226-D249 IonicContact NH2-OD2 3.71Å; Q247-D249 WeakPolarHBondContact CB-OD1 3.3Å; Q247-D249 PolarHBondContact O-N 2.97Å; D249-S251 PolarHBondContact O-N 3.01Å; D249-R252 WeakPolarHBondContact O-CB 3.33Å; D249-R252 PolarHBondContact O-N 2.9Å; D249-R252 VanDerWaalsContact O-N 3.14Å; D249-R252 IonicContact OD2-CZ 3.41Å; D249-R252 IonicContact OD2-NE 3.32Å; D249-R252 PolarHBondContact OD2-NE 3.42Å; D249-R252 IonicContact OD2-NH2 3.67Å; D249-R252 PolarHBondContact OD2-NH2 2.86Å; D249-I253 WeakPolarHBondContact O-CG1 3.41Å; D249-I253 PolarHBondContact O-N 3.31Å
250	Q	92.3	Very high	93.1	Very high	3 Å²	3	33.1 Å²	33.1	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-53.7	-51.4	-176.3	-178.3	177.5	23.3	0	0	112.8	V245 Q247 P248 R252 I253 V254 I270 S271	V245-Q250 PolarHBondContact O-NE2 2.93Å; Q247-Q250 VanDerWaalsContact O-CB 3.3Å; Q247-Q250 WeakPolarHBondContact O-CB 3.39Å; Q247-Q250 PolarHBondContact O-N 3.05Å; P248-Q250 VanDerWaalsContact C-N 3.28Å; P248-Q250 PolarHBondContact O-N 3.1Å; Q250-R252 VanDerWaalsContact C-N 3.26Å; Q250-R252 PolarHBondContact O-N 2.97Å; Q250-I253 WeakPolarHBondContact O-CB 3.48Å; Q250-I253 PolarHBondContact O-N 2.98Å; Q250-I253 VanDerWaalsContact O-N 3.1Å; Q250-V254 WeakPolarHBondContact O-CG2 3.24Å; Q250-V254 PolarHBondContact O-N 3.21Å; Q250-I270 HydrophobicContact CG-CG2 4.36Å; Q250-S271 PolarHBondContact NE2-O 3.16Å
251	S	91.5	Very high	93.1	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.028	17%	0.172	C	C	.	.	H	α-helix	trans	-54.7	-42.8	178.5	-87.1	0	0	0	0	112.4	D249 V254 G255 E290 L297	D249-S251 PolarHBondContact O-N 3.01Å; S251-V254 PolarHBondContact O-N 3.22Å; S251-G255 PolarHBondContact O-N 3.43Å; S251-E290 WeakPolarHBondContact CB-OE2 3.29Å; S251-E290 PolarHBondContact OG-OE2 2.9Å; S251-L297 WeakPolarHBondContact O-CD1 3.3Å
252	R	93.3	Very high	93.1	Very high	107 Å²	107	33.6 Å²	33.6	40%	0.404	17%	0.173	S	C	.	.	H	α-helix	trans	-64.2	-45.2	177.5	-171.6	-167.8	67.5	79.5	0.5	111.1	D249 Q250 V254 G255 V256	D249-R252 WeakPolarHBondContact O-CB 3.33Å; D249-R252 PolarHBondContact O-N 2.9Å; D249-R252 VanDerWaalsContact O-N 3.14Å; D249-R252 IonicContact OD2-CZ 3.41Å; D249-R252 IonicContact OD2-NE 3.32Å; D249-R252 PolarHBondContact OD2-NE 3.42Å; D249-R252 IonicContact OD2-NH2 3.67Å; D249-R252 PolarHBondContact OD2-NH2 2.86Å; Q250-R252 VanDerWaalsContact C-N 3.26Å; Q250-R252 PolarHBondContact O-N 2.97Å; R252-V254 VanDerWaalsContact C-N 3.32Å; R252-V254 PolarHBondContact O-N 3.41Å; R252-G255 PolarHBondContact O-N 2.98Å; R252-V256 HydrophobicContact CG-CG2 4.38Å; R252-V256 WeakPolarHBondContact O-CG2 3.48Å; R252-V256 PolarHBondContact O-N 3.28Å
253	I	94.7	Very high	93	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-57.4	-46.9	177.9	-67.4	169.2	0	0	0	110.4	L174 A225 R226 V245 Q247 D249 Q250 N257	L174-I253 HydrophobicContact CD1-CG2 4.45Å; A225-I253 HydrophobicContact CB-CG2 3.82Å; R226-I253 HydrophobicContact CG-CD1 3.8Å; R226-I253 HydrophobicContact CG-CG1 3.79Å; V245-I253 HydrophobicContact CG1-CD1 4.04Å; Q247-I253 HydrophobicContact CB-CD1 4.19Å; Q247-I253 HydrophobicContact CG-CD1 4.37Å; D249-I253 WeakPolarHBondContact O-CG1 3.41Å; D249-I253 PolarHBondContact O-N 3.31Å; Q250-I253 WeakPolarHBondContact O-CB 3.48Å; Q250-I253 PolarHBondContact O-N 2.98Å; Q250-I253 VanDerWaalsContact O-N 3.1Å; I253-N257 WeakPolarHBondContact O-CB 3.3Å; I253-N257 PolarHBondContact O-N 3.32Å; I253-N257 VanDerWaalsContact O-N 3.1Å; I253-N257 PolarHBondContact O-ND2 2.95Å
254	V	94.9	Very high	92.8	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-64.4	-42.9	177.8	178.7	0	0	0	0	111.2	A243 Q250 S251 R252 N257 A258 A268 I270 F299	A243-V254 HydrophobicContact CB-CG2 3.48Å; A243-V254 VanDerWaalsContact CB-CG2 3.48Å; Q250-V254 WeakPolarHBondContact O-CG2 3.24Å; Q250-V254 PolarHBondContact O-N 3.21Å; S251-V254 PolarHBondContact O-N 3.22Å; R252-V254 VanDerWaalsContact C-N 3.32Å; R252-V254 PolarHBondContact O-N 3.41Å; V254-N257 PolarHBondContact O-N 3.35Å; V254-A258 VanDerWaalsContact O-CB 3.3Å; V254-A258 WeakPolarHBondContact O-CB 3.45Å; V254-A258 PolarHBondContact O-N 2.89Å; V254-A268 HydrophobicContact CG1-CB 4.32Å; V254-I270 HydrophobicContact CB-CD1 4.42Å; V254-I270 HydrophobicContact CG1-CD1 3.89Å; V254-I270 HydrophobicContact CG1-CG1 4.25Å; V254-I270 HydrophobicContact CG2-CD1 4.35Å; V254-I270 HydrophobicContact CG2-CG1 4.34Å; V254-F299 HydrophobicContact CG1-CE2 4.32Å; V254-F299 HydrophobicContact CG1-CZ 3.96Å
255	G	94.2	Very high	92.7	Very high	7 Å²	7	42.4 Å²	42.4	7%	0.072	22%	0.221	C	C	.	.	H	α-helix	trans	-57.8	-52.1	177.9	0	0	0	0	0	113.7	S251 R252 N257 A258 E259	S251-G255 PolarHBondContact O-N 3.43Å; R252-G255 PolarHBondContact O-N 2.98Å; G255-N257 VanDerWaalsContact C-N 3.35Å; G255-N257 PolarHBondContact O-N 3.09Å; G255-A258 PolarHBondContact O-N 2.83Å; G255-E259 PolarHBondContact O-N 2.85Å
256	V	94.9	Very high	92.9	Very high	40 Å²	40	41.9 Å²	41.9	24%	0.242	22%	0.219	C	C	.	.	H	α-helix	trans	-67.5	-37.3	-179.4	-171.2	0	0	0	0	110.7	P228 R252 E259 Y260	P228-V256 HydrophobicContact CG-CB 4.24Å; P228-V256 HydrophobicContact CG-CG1 3.44Å; P228-V256 VanDerWaalsContact CG-CG1 3.44Å; R252-V256 HydrophobicContact CG-CG2 4.38Å; R252-V256 WeakPolarHBondContact O-CG2 3.48Å; R252-V256 PolarHBondContact O-N 3.28Å; V256-E259 PolarHBondContact O-N 3.16Å; V256-Y260 HydrophobicContact CG1-CD2 4.2Å; V256-Y260 HydrophobicContact CG1-CE2 4.08Å; V256-Y260 VanDerWaalsContact O-CD2 3.26Å; V256-Y260 WeakPolarHBondContact O-CD2 3.4Å; V256-Y260 PolarHBondContact O-N 2.79Å
257	N	96	Very high	93.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-38.9	175	-85.4	-83.9	0	0	0	112.9	L172 L174 A225 Y231 I241 I253 V254 G255 Y260 Y261	L172-N257 HydrophobicContact CD2-CB 4.37Å; L174-N257 HydrophobicContact CD1-CB 3.94Å; A225-N257 PolarHBondContact O-ND2 3.48Å; Y231-N257 PolarHBondContact OH-OD1 2.87Å; I241-N257 HydrophobicContact CD1-CB 4.36Å; I253-N257 WeakPolarHBondContact O-CB 3.3Å; I253-N257 PolarHBondContact O-N 3.32Å; I253-N257 VanDerWaalsContact O-N 3.1Å; I253-N257 PolarHBondContact O-ND2 2.95Å; V254-N257 PolarHBondContact O-N 3.35Å; G255-N257 VanDerWaalsContact C-N 3.35Å; G255-N257 PolarHBondContact O-N 3.09Å; N257-Y260 PolarHBondContact O-N 3.18Å; N257-Y261 WeakPolarHBondContact O-CD2 3.37Å; N257-Y261 PolarHBondContact O-N 3.12Å
258	A	94.7	Very high	93.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.9	-37.7	178	0	0	0	0	0	112.6	I241 V254 G255 Y260 L262 F299 Y321	I241-A258 HydrophobicContact CD1-CB 3.89Å; V254-A258 VanDerWaalsContact O-CB 3.3Å; V254-A258 WeakPolarHBondContact O-CB 3.45Å; V254-A258 PolarHBondContact O-N 2.89Å; G255-A258 PolarHBondContact O-N 2.83Å; A258-Y260 VanDerWaalsContact C-N 3.28Å; A258-Y260 PolarHBondContact O-N 3.22Å; A258-L262 HydrophobicContact CB-CB 3.88Å; A258-L262 HydrophobicContact CB-CD2 3.9Å; A258-L262 VanDerWaalsContact O-CB 3.3Å; A258-L262 WeakPolarHBondContact O-CB 3.47Å; A258-L262 PolarHBondContact O-N 3.41Å; A258-F299 HydrophobicContact CB-CE1 4.24Å; A258-F299 HydrophobicContact CB-CE2 4.11Å; A258-F299 HydrophobicContact CB-CZ 3.39Å; A258-Y321 HydrophobicContact CB-CD2 4.06Å; A258-Y321 HydrophobicContact CB-CE2 4.05Å; A258-Y321 HydrophobicContact CB-CG 4.41Å
259	E	93.6	Very high	93.7	Very high	126 Å²	126	33.7 Å²	33.7	59%	0.589	17%	0.165	S	C	*	.	H	α-helix	trans	-60.8	-37.2	175.2	-174	175.6	-169.8	0	0	112.7	G255 V256	G255-E259 PolarHBondContact O-N 2.85Å; V256-E259 PolarHBondContact O-N 3.16Å
260	Y	93.8	Very high	93.9	Very high	106 Å²	106	31.8 Å²	31.8	42%	0.416	16%	0.155	S	C	.	.	H	α-helix	trans	-81.6	-39.5	-179.6	-84.3	-106.3	0	0	0	113.6	P228 H229 V256 N257 A258	P228-Y260 HydrophobicContact CB-CD2 4.39Å; P228-Y260 HydrophobicContact CB-CG 4.17Å; P228-Y260 HydrophobicContact CG-CD2 3.94Å; P228-Y260 HydrophobicContact CG-CE2 4.24Å; P228-Y260 HydrophobicContact CG-CG 4.23Å; H229-Y260 HydrophobicContact CB-CE1 4.33Å; V256-Y260 HydrophobicContact CG1-CD2 4.2Å; V256-Y260 HydrophobicContact CG1-CE2 4.08Å; V256-Y260 VanDerWaalsContact O-CD2 3.26Å; V256-Y260 WeakPolarHBondContact O-CD2 3.4Å; V256-Y260 PolarHBondContact O-N 2.79Å; N257-Y260 PolarHBondContact O-N 3.18Å; A258-Y260 VanDerWaalsContact C-N 3.28Å; A258-Y260 PolarHBondContact O-N 3.22Å
261	Y	95.1	Very high	94	Very high	7 Å²	7	31.8 Å²	31.8	3%	0.027	16%	0.155	C	C	.	.	H	α-helix	trans	-124	-22.5	-165.1	-55.5	-61.7	0	0	0	115.3	L172 P228 Y231 R232 V235 M237 V238 N257	L172-Y261 HydrophobicContact CD2-CD2 3.91Å; L172-Y261 HydrophobicContact CD2-CG 4.42Å; P228-Y261 HydrophobicContact CB-CD2 4.48Å; P228-Y261 HydrophobicContact CB-CE2 3.58Å; P228-Y261 PolarHBondContact O-OH 2.9Å; Y231-Y261 VanDerWaalsContact C-OH 3.3Å; Y231-Y261 AromaticContact CD2-CE2 3.88Å; Y231-Y261 HydrophobicContact CD2-CE2 3.88Å; Y231-Y261 AromaticContact CD2-CZ 3.82Å; Y231-Y261 VanDerWaalsContact CD2-OH 3.29Å; Y231-Y261 WeakPolarHBondContact CD2-OH 3.14Å; Y231-Y261 HydrophobicContact CE2-CD2 4.33Å; Y231-Y261 AromaticContact CE2-CE2 3.38Å; Y231-Y261 HydrophobicContact CE2-CE2 3.38Å; Y231-Y261 AromaticContact CE2-CZ 3.84Å; Y231-Y261 PolarHBondContact O-OH 2.82Å; R232-Y261 WeakPolarHBondContact CA-OH 3.22Å; R232-Y261 PolarHBondContact N-OH 3.11Å; R232-Y261 VanDerWaalsContact N-OH 3.08Å; V235-Y261 HydrophobicContact CB-CD1 3.75Å; V235-Y261 HydrophobicContact CB-CE1 3.59Å; V235-Y261 HydrophobicContact CB-CE2 4.47Å; V235-Y261 HydrophobicContact CB-CG 4.25Å; V235-Y261 HydrophobicContact CG1-CD1 3.53Å; V235-Y261 HydrophobicContact CG1-CD2 4.18Å; V235-Y261 HydrophobicContact CG1-CE1 3.93Å; V235-Y261 HydrophobicContact CG1-CG 3.67Å; V235-Y261 WeakPolarHBondContact O-CD1 3.3Å; V235-Y261 WeakPolarHBondContact O-CE1 3.47Å; M237-Y261 CarbonylContact C-O 3.52Å; M237-Y261 VanDerWaalsContact CA-O 3.3Å; M237-Y261 WeakPolarHBondContact CA-O 3.36Å; V238-Y261 WeakPolarHBondContact CG2-O 3.16Å; V238-Y261 PolarHBondContact N-O 3.3Å; N257-Y261 WeakPolarHBondContact O-CD2 3.37Å; N257-Y261 PolarHBondContact O-N 3.12Å
262	L	94.7	Very high	94	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	129.7	-173.7	-170.5	56.7	0	0	0	110.3	M237 V238 D239 I241 A258 F299 Y321	M237-L262 WeakPolarHBondContact CE-O 3.44Å; V238-L262 HydrophobicContact CG2-CD1 4.19Å; D239-L262 WeakPolarHBondContact O-CD1 3.22Å; I241-L262 HydrophobicContact CD1-CB 3.95Å; I241-L262 HydrophobicContact CD1-CD2 4.1Å; I241-L262 HydrophobicContact CD1-CG 4.43Å; I241-L262 HydrophobicContact CG1-CD1 4.23Å; I241-L262 HydrophobicContact CG1-CD2 4.43Å; A258-L262 HydrophobicContact CB-CB 3.88Å; A258-L262 HydrophobicContact CB-CD2 3.9Å; A258-L262 VanDerWaalsContact O-CB 3.3Å; A258-L262 WeakPolarHBondContact O-CB 3.47Å; A258-L262 PolarHBondContact O-N 3.41Å; L262-F299 HydrophobicContact CD2-CE1 4.05Å; L262-Y321 HydrophobicContact CB-CD1 4.24Å; L262-Y321 HydrophobicContact CD2-CD1 4.19Å; L262-Y321 HydrophobicContact CD2-CG 3.85Å; L262-Y321 HydrophobicContact CG-CD1 4.19Å; L262-Y321 HydrophobicContact CG-CG 4.35Å
263	K	94.4	Very high	93.9	Very high	76 Å²	76	29.8 Å²	29.8	33%	0.33	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	149.2	173.8	-67.4	173.3	-171	172.8	0	110.6	M237 V238 D239 G265 G266	M237-K263 HydrophobicContact CB-CG 3.92Å; M237-K263 HydrophobicContact CE-CB 4.35Å; M237-K263 HydrophobicContact CE-CG 3.93Å; V238-K263 WeakPolarHBondContact O-CG 3.46Å; V238-K263 PolarHBondContact O-N 3.34Å; D239-K263 WeakPolarHBondContact OD1-CD 3.39Å; D239-K263 WeakPolarHBondContact OD1-CE 3.36Å; D239-K263 IonicContact OD1-NZ 2.71Å; D239-K263 PolarHBondContact OD1-NZ 3.09Å; D239-K263 IonicContact OD2-NZ 3.21Å; K263-G265 PolarHBondContact O-N 3.26Å; K263-G266 WeakPolarHBondContact O-CA 3.31Å; K263-G266 PolarHBondContact O-N 3.29Å
264	N	92	Very high	93.7	Very high	118 Å²	118	29.8 Å²	29.8	63%	0.631	15%	0.15	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	129.2	170.1	-69.4	-22.4	0	0	0	109.3	G266 R322	N264-G266 PolarHBondContact O-N 3.33Å; N264-R322 VanDerWaalsContact OD1-CD 3.3Å; N264-R322 WeakPolarHBondContact OD1-CD 3.45Å; N264-R322 PolarHBondContact OD1-NH1 2.8Å
265	G	91.2	Very high	93.5	Very high	20 Å²	20	33 Å²	33	21%	0.206	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.8	-2.5	-173.5	0	0	0	0	0	114.9	K263 Q320 Y321	K263-G265 PolarHBondContact O-N 3.26Å; G265-Q320 PolarHBondContact O-NE2 2.86Å; G265-Q320 VanDerWaalsContact O-NE2 3.1Å; G265-Y321 VanDerWaalsContact CA-O 3.24Å; G265-Y321 WeakPolarHBondContact CA-O 3.48Å; G265-Y321 PolarHBondContact N-O 3.2Å
266	G	92.8	Very high	93.3	Very high	7 Å²	7	34.7 Å²	34.7	7%	0.072	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	171.2	173.7	0	0	0	0	0	112.6	D239 K263 N264 Y321	D239-G266 WeakPolarHBondContact O-CA 3.39Å; K263-G266 WeakPolarHBondContact O-CA 3.31Å; K263-G266 PolarHBondContact O-N 3.29Å; N264-G266 PolarHBondContact O-N 3.33Å; G266-Y321 PolarHBondContact O-N 2.93Å
267	H	94.2	Very high	93	Very high	36 Å²	36	34.5 Å²	34.5	17%	0.167	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.2	-170.9	-63.2	-88.6	0	0	0	112	H164 D239 C240 I241 A319	H164-H267 HydrophobicContact CB-CB 3.63Å; H164-H267 AromaticContact CD2-CG 3.44Å; H164-H267 VanDerWaalsContact CD2-CG 3.44Å; H164-H267 AromaticContact CD2-ND1 3.44Å; H164-H267 PolarHBondContact CD2-ND1 2.87Å; H164-H267 AromaticContact CE1-CD2 3.75Å; H164-H267 AromaticContact CE1-CE1 3.08Å; H164-H267 PolarHBondContact CE1-CE1 2.92Å; H164-H267 AromaticContact CE1-CG 3.63Å; H164-H267 AromaticContact CE1-ND1 3.22Å; H164-H267 PolarHBondContact CE1-ND1 3.04Å; H164-H267 AromaticContact CE1-NE2 3.42Å; H164-H267 PolarHBondContact CE1-NE2 3.12Å; H164-H267 AromaticContact CG-CD2 3.55Å; H164-H267 AromaticContact CG-CG 3.28Å; H164-H267 AromaticContact CG-ND1 3.65Å; H164-H267 AromaticContact ND1-CD2 3.29Å; H164-H267 PolarHBondContact ND1-CD2 2.99Å; H164-H267 VanDerWaalsContact ND1-CD2 3.29Å; H164-H267 AromaticContact ND1-CE1 3.47Å; H164-H267 PolarHBondContact ND1-CE1 3.2Å; H164-H267 AromaticContact ND1-CG 3.41Å; H164-H267 AromaticContact ND1-ND1 3.53Å; H164-H267 AromaticContact ND1-NE2 3.33Å; H164-H267 PolarHBondContact ND1-NE2 3.1Å; H164-H267 AromaticContact NE2-CE1 3.48Å; H164-H267 PolarHBondContact NE2-CE1 3.03Å; H164-H267 AromaticContact NE2-CG 3.64Å; H164-H267 AromaticContact NE2-ND1 3.13Å; H164-H267 PolarHBondContact NE2-ND1 2.97Å; H164-H267 VanDerWaalsContact NE2-ND1 3.13Å; D239-H267 PolarHBondContact O-N 3.03Å; C240-H267 CarbonylContact C-O 3.59Å; C240-H267 VanDerWaalsContact CA-O 3.22Å; C240-H267 WeakPolarHBondContact CA-O 3.44Å; I241-H267 PolarHBondContact N-O 3.2Å; H267-A319 CarbonylContact C-O 3.46Å; H267-A319 WeakPolarHBondContact CA-O 3.38Å
268	A	94.6	Very high	92.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.7	170.8	0	0	0	0	0	109.1	I241 V254 I270 F299 T318 A319	I241-A268 HydrophobicContact CB-CB 4.4Å; I241-A268 CarbonylContact O-C 3.51Å; I241-A268 WeakPolarHBondContact O-CA 3.38Å; V254-A268 HydrophobicContact CG1-CB 4.32Å; A268-I270 HydrophobicContact CB-CD1 4.49Å; A268-I270 HydrophobicContact CB-CG1 4.38Å; A268-F299 HydrophobicContact CB-CD1 4.17Å; A268-F299 HydrophobicContact CB-CE1 3.51Å; A268-F299 HydrophobicContact CB-CZ 4.17Å; A268-T318 CarbonylContact O-C 3.56Å; A268-T318 WeakPolarHBondContact O-CA 3.13Å; A268-A319 PolarHBondContact N-O 3.07Å; A268-A319 PolarHBondContact O-N 2.83Å
269	V	94.6	Very high	92.4	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.7	173.5	-179.2	0	0	0	0	107.2	I163 I241 F242 A243 M316 T318	I163-V269 WeakPolarHBondContact O-CG2 3.46Å; I241-V269 PolarHBondContact O-N 3.45Å; F242-V269 CarbonylContact C-O 3.6Å; F242-V269 WeakPolarHBondContact CA-O 3.42Å; F242-V269 HydrophobicContact CD2-CB 3.87Å; F242-V269 HydrophobicContact CD2-CG1 3.75Å; F242-V269 HydrophobicContact CE2-CB 4.43Å; F242-V269 HydrophobicContact CE2-CG1 3.81Å; A243-V269 PolarHBondContact N-O 2.9Å; V269-M316 HydrophobicContact CG1-CG 3.68Å; V269-M316 HydrophobicContact CG1-SD 3.44Å; V269-M316 WeakPolarHBondContact CG1-SD 3.41Å; V269-T318 HydrophobicContact CG1-CG2 4.43Å; V269-T318 HydrophobicContact CG2-CG2 4.16Å
270	I	94.2	Very high	92.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.5	-169.7	-55.1	169.7	0	0	0	108.3	A243 Q250 V254 A268 I272 L294 M316 V317	A243-I270 HydrophobicContact CB-CG1 4.35Å; A243-I270 HydrophobicContact CB-CG2 4.41Å; Q250-I270 HydrophobicContact CG-CG2 4.36Å; V254-I270 HydrophobicContact CB-CD1 4.42Å; V254-I270 HydrophobicContact CG1-CD1 3.89Å; V254-I270 HydrophobicContact CG1-CG1 4.25Å; V254-I270 HydrophobicContact CG2-CD1 4.35Å; V254-I270 HydrophobicContact CG2-CG1 4.34Å; A268-I270 HydrophobicContact CB-CD1 4.49Å; A268-I270 HydrophobicContact CB-CG1 4.38Å; I270-I272 HydrophobicContact CG2-CG1 4.02Å; I270-L294 HydrophobicContact CD1-CD1 3.52Å; I270-L294 HydrophobicContact CD1-CD2 3.44Å; I270-L294 VanDerWaalsContact CD1-CD2 3.44Å; I270-L294 HydrophobicContact CD1-CG 4.13Å; I270-M316 WeakPolarHBondContact O-CA 3.49Å; I270-V317 PolarHBondContact N-O 3.26Å; I270-V317 PolarHBondContact O-N 3.37Å
271	S	93.6	Very high	92.2	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.021	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	110.3	171.1	-169.8	0	0	0	0	109.9	K151 A243 Q250 A315	K151-S271 WeakPolarHBondContact CD-OG 3.43Å; A243-S271 PolarHBondContact O-N 3.08Å; Q250-S271 PolarHBondContact NE2-O 3.16Å; S271-A315 CarbonylContact C-O 3.6Å
272	I	92.8	Very high	92	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.1	-178.4	-54.9	175.9	0	0	0	108.6	I270 I277 F287 E290 H314 A315 V317	I270-I272 HydrophobicContact CG2-CG1 4.02Å; I272-I277 HydrophobicContact CG2-CD1 3.51Å; I272-F287 HydrophobicContact CB-CD1 4.15Å; I272-F287 HydrophobicContact CB-CE1 4.22Å; I272-F287 HydrophobicContact CG2-CD1 3.69Å; I272-F287 HydrophobicContact CG2-CE1 3.88Å; I272-E290 HydrophobicContact CD1-CB 3.79Å; I272-E290 HydrophobicContact CD1-CG 4.33Å; I272-E290 HydrophobicContact CG2-CG 4.12Å; I272-H314 VanDerWaalsContact O-CA 3.31Å; I272-H314 WeakPolarHBondContact O-CA 3.39Å; I272-A315 PolarHBondContact N-O 3.14Å; I272-A315 PolarHBondContact O-N 3.32Å; I272-V317 HydrophobicContact CD1-CB 4.31Å; I272-V317 HydrophobicContact CD1-CG2 3.58Å; I272-V317 HydrophobicContact CG1-CG2 4.48Å
273	K	91.1	Very high	91.8	Very high	69 Å²	69	42.4 Å²	42.4	30%	0.3	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	105.3	172.3	178.6	174.9	177	-172.1	0	109.2	S275 C276 I277 H314	K273-S275 VanDerWaalsContact C-N 3.29Å; K273-S275 WeakPolarHBondContact CE-OG 3.09Å; K273-S275 PolarHBondContact O-N 3.42Å; K273-C276 HydrophobicContact CB-CB 4.31Å; K273-C276 HydrophobicContact CD-CB 4.06Å; K273-C276 WeakPolarHBondContact CD-SG 3.27Å; K273-C276 WeakPolarHBondContact CE-SG 3.18Å; K273-C276 HydrophobicContact CG-CB 4.1Å; K273-C276 PolarHBondContact NZ-SG 3.46Å; K273-C276 PolarHBondContact O-N 3.19Å; K273-C276 VanDerWaalsContact O-N 3.08Å; K273-I277 PolarHBondContact O-N 3.33Å; K273-H314 VanDerWaalsContact CD-NE2 3.27Å; K273-H314 WeakPolarHBondContact CD-NE2 3.31Å; K273-H314 VanDerWaalsContact CG-NE2 3.31Å; K273-H314 WeakPolarHBondContact CG-NE2 3.49Å
274	A	91.3	Very high	91.7	Very high	4 Å²	4	45.1 Å²	45.1	3%	0.033	27%	0.273	C	S	.	.	H	α-helix	trans	-54.7	-45.9	-174	0	0	0	0	0	112.3	C276 I277 D278 P283 V286 F287 G313	A274-C276 VanDerWaalsContact C-N 3.25Å; A274-C276 PolarHBondContact O-N 3.28Å; A274-I277 PolarHBondContact O-N 2.78Å; A274-I277 VanDerWaalsContact O-N 3.11Å; A274-D278 CarbonylContact O-C 3.52Å; A274-D278 PolarHBondContact O-N 3.02Å; A274-D278 VanDerWaalsContact O-O 3.06Å; A274-P283 HydrophobicContact CB-CB 3.74Å; A274-P283 HydrophobicContact CB-CG 4.19Å; A274-V286 HydrophobicContact CB-CB 4.26Å; A274-V286 HydrophobicContact CB-CG1 4.42Å; A274-V286 HydrophobicContact CB-CG2 4.48Å; A274-F287 HydrophobicContact CB-CE1 4Å; A274-F287 HydrophobicContact CB-CZ 4.2Å; A274-G313 WeakPolarHBondContact CB-O 3.07Å; A274-G313 PolarHBondContact N-O 3.32Å; A274-G313 VanDerWaalsContact N-O 3.08Å
275	S	90.7	Very high	91.7	Very high	69 Å²	69	42.9 Å²	42.9	48%	0.483	26%	0.264	S	S	.	.	H	α-helix	trans	-64.3	-21.1	-178.2	52	0	0	0	0	115.5	K273	K273-S275 VanDerWaalsContact C-N 3.29Å; K273-S275 WeakPolarHBondContact CE-OG 3.09Å; K273-S275 PolarHBondContact O-N 3.42Å
276	C	89.5	Confident	91.8	Very high	42 Å²	42	42 Å²	42	28%	0.284	25%	0.254	S	S	.	.	H	α-helix	trans	-90.4	-17.6	176.8	-80.1	0	0	0	0	113.2	A246 K273 A274	A246-C276 HydrophobicContact CB-CB 4.33Å; K273-C276 HydrophobicContact CB-CB 4.31Å; K273-C276 HydrophobicContact CD-CB 4.06Å; K273-C276 WeakPolarHBondContact CD-SG 3.27Å; K273-C276 WeakPolarHBondContact CE-SG 3.18Å; K273-C276 HydrophobicContact CG-CB 4.1Å; K273-C276 PolarHBondContact NZ-SG 3.46Å; K273-C276 PolarHBondContact O-N 3.19Å; K273-C276 VanDerWaalsContact O-N 3.08Å; A274-C276 VanDerWaalsContact C-N 3.25Å; A274-C276 PolarHBondContact O-N 3.28Å
277	I	88.1	Confident	91.7	Very high	37 Å²	37	42.2 Å²	42.2	19%	0.19	25%	0.253	C	S	.	.	H	α-helix	trans	-91.9	-53.4	178.1	-62.6	170.6	0	0	0	109.2	I272 K273 A274 V286 E290	I272-I277 HydrophobicContact CG2-CD1 3.51Å; K273-I277 PolarHBondContact O-N 3.33Å; A274-I277 PolarHBondContact O-N 2.78Å; A274-I277 VanDerWaalsContact O-N 3.11Å; I277-V286 HydrophobicContact CB-CG1 3.78Å; I277-V286 HydrophobicContact CD1-CG1 4Å; I277-V286 HydrophobicContact CG1-CG1 4.49Å; I277-V286 HydrophobicContact CG2-CG1 3.76Å; I277-E290 HydrophobicContact CD1-CG 3.66Å
278	D	89.1	Confident	91.6	Very high	52 Å²	52	43 Å²	43	28%	0.278	27%	0.265	S	S	.	.			trans	-146.5	109	178	-173.6	-18.2	0	0	0	108.6	A274 V280 A281 V286	A274-D278 CarbonylContact O-C 3.52Å; A274-D278 PolarHBondContact O-N 3.02Å; A274-D278 VanDerWaalsContact O-O 3.06Å; D278-V280 VanDerWaalsContact C-N 3.25Å; D278-V280 PolarHBondContact O-N 3.39Å; D278-V280 PolarHBondContact OD1-N 3.14Å; D278-A281 HydrophobicContact CB-CB 4.2Å; D278-A281 PolarHBondContact OD1-N 2.92Å; D278-A281 VanDerWaalsContact OD1-N 3.1Å; D278-A281 WeakPolarHBondContact OD2-CB 3.38Å; D278-V286 HydrophobicContact CB-CG2 3.91Å
279	S	89.5	Confident	91.5	Very high	102 Å²	102	48.2 Å²	48.2	71%	0.713	29%	0.288	S	S	*	.	S	Bend	trans	-77.3	-10.1	-179.2	59.5	0	0	0	0	113.7
280	V	91.5	Very high	91.4	Very high	133 Å²	133	48.9 Å²	48.9	81%	0.806	29%	0.291	S	S	*	.	S	Bend	trans	-98.7	-39.1	-175.9	-176.6	0	0	0	0	110.8	D278	D278-V280 VanDerWaalsContact C-N 3.25Å; D278-V280 PolarHBondContact O-N 3.39Å; D278-V280 PolarHBondContact OD1-N 3.14Å
281	A	90.6	Very high	91.3	Very high	27 Å²	27	49.6 Å²	49.6	22%	0.223	30%	0.295	C	S	.	.	S	Bend	trans	-73.3	152.2	-179.8	0	0	0	0	0	113.1	D278 V286	D278-A281 HydrophobicContact CB-CB 4.2Å; D278-A281 PolarHBondContact OD1-N 2.92Å; D278-A281 VanDerWaalsContact OD1-N 3.1Å; D278-A281 WeakPolarHBondContact OD2-CB 3.38Å; A281-V286 HydrophobicContact CB-CG2 3.83Å
282	A	91.9	Very high	91.3	Very high	49 Å²	49	52.9 Å²	52.9	41%	0.405	31%	0.313	S	S	.	.			trans	-63.5	143.2	171.3	0	0	0	0	0	110.9	E284 V285 V286	A282-E284 PolarHBondContact O-N 3.41Å; A282-E284 VanDerWaalsContact O-N 3.16Å; A282-V285 HydrophobicContact CB-CG2 4.34Å; A282-V285 WeakPolarHBondContact O-CB 3.47Å; A282-V285 PolarHBondContact O-N 2.77Å; A282-V286 PolarHBondContact O-N 3.33Å
283	P	90.7	Very high	91.3	Very high	45 Å²	45	55.3 Å²	55.3	29%	0.292	33%	0.328	S	S	.	.	H	α-helix	trans	-53.6	-38.6	-176.3	-27.4	35.2	0	0	0	114.3	A274 V285 V286 F287	A274-P283 HydrophobicContact CB-CB 3.74Å; A274-P283 HydrophobicContact CB-CG 4.19Å; P283-V285 VanDerWaalsContact C-N 3.31Å; P283-V285 PolarHBondContact O-N 2.9Å; P283-V286 PolarHBondContact O-N 3.36Å; P283-F287 HydrophobicContact CB-CD2 4.47Å; P283-F287 HydrophobicContact CB-CE2 3.73Å; P283-F287 HydrophobicContact CB-CZ 3.85Å; P283-F287 WeakPolarHBondContact O-CD1 3.1Å; P283-F287 WeakPolarHBondContact O-CD2 3.43Å; P283-F287 WeakPolarHBondContact O-CG 3.3Å; P283-F287 PolarHBondContact O-N 3.44Å
284	E	91.5	Very high	91.3	Very high	133 Å²	133	52 Å²	52	62%	0.621	31%	0.314	S	S	*	.	H	α-helix	trans	-62.9	-38.8	-179.2	-58.6	74.7	-161.8	0	0	111.8	A282 F287 A288	A282-E284 PolarHBondContact O-N 3.41Å; A282-E284 VanDerWaalsContact O-N 3.16Å; E284-F287 PolarHBondContact O-N 2.87Å; E284-A288 PolarHBondContact O-N 2.53Å
285	V	92.6	Very high	91.4	Very high	72 Å²	72	58 Å²	58	44%	0.436	34%	0.335	S	S	.	.	H	α-helix	trans	-68.5	-40.1	177.4	179	0	0	0	0	110.4	A282 P283 A288 K289	A282-V285 HydrophobicContact CB-CG2 4.34Å; A282-V285 WeakPolarHBondContact O-CB 3.47Å; A282-V285 PolarHBondContact O-N 2.77Å; P283-V285 VanDerWaalsContact C-N 3.31Å; P283-V285 PolarHBondContact O-N 2.9Å; V285-A288 PolarHBondContact O-N 2.77Å; V285-K289 HydrophobicContact CG1-CD 4.36Å; V285-K289 WeakPolarHBondContact O-CG 3.42Å; V285-K289 PolarHBondContact O-N 3.28Å; V285-K289 VanDerWaalsContact O-N 3.08Å
286	V	91.9	Very high	91.5	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.012	35%	0.348	C	S	.	.	H	α-helix	trans	-64.9	-44.7	176.6	-178.9	0	0	0	0	110.6	A274 I277 D278 A281 A282 P283 A288 K289 E290	A274-V286 HydrophobicContact CB-CB 4.26Å; A274-V286 HydrophobicContact CB-CG1 4.42Å; A274-V286 HydrophobicContact CB-CG2 4.48Å; I277-V286 HydrophobicContact CB-CG1 3.78Å; I277-V286 HydrophobicContact CD1-CG1 4Å; I277-V286 HydrophobicContact CG1-CG1 4.49Å; I277-V286 HydrophobicContact CG2-CG1 3.76Å; D278-V286 HydrophobicContact CB-CG2 3.91Å; A281-V286 HydrophobicContact CB-CG2 3.83Å; A282-V286 PolarHBondContact O-N 3.33Å; P283-V286 PolarHBondContact O-N 3.36Å; V286-A288 PolarHBondContact O-N 3.06Å; V286-K289 PolarHBondContact O-N 3.22Å; V286-E290 PolarHBondContact O-N 3.2Å
287	F	91.9	Very high	91.6	Very high	11 Å²	11	63.5 Å²	63.5	5%	0.048	35%	0.348	C	S	.	.	H	α-helix	trans	-61.1	-43.5	177.8	-57.3	-32.5	0	0	0	112.1	I272 A274 P283 E284 E290 V291 A315	I272-F287 HydrophobicContact CB-CD1 4.15Å; I272-F287 HydrophobicContact CB-CE1 4.22Å; I272-F287 HydrophobicContact CG2-CD1 3.69Å; I272-F287 HydrophobicContact CG2-CE1 3.88Å; A274-F287 HydrophobicContact CB-CE1 4Å; A274-F287 HydrophobicContact CB-CZ 4.2Å; P283-F287 HydrophobicContact CB-CD2 4.47Å; P283-F287 HydrophobicContact CB-CE2 3.73Å; P283-F287 HydrophobicContact CB-CZ 3.85Å; P283-F287 WeakPolarHBondContact O-CD1 3.1Å; P283-F287 WeakPolarHBondContact O-CD2 3.43Å; P283-F287 WeakPolarHBondContact O-CG 3.3Å; P283-F287 PolarHBondContact O-N 3.44Å; E284-F287 PolarHBondContact O-N 2.87Å; F287-E290 PolarHBondContact O-N 3.4Å; F287-V291 WeakPolarHBondContact O-CB 3.44Å; F287-V291 VanDerWaalsContact O-CG2 3.25Å; F287-V291 WeakPolarHBondContact O-CG2 3.36Å; F287-V291 PolarHBondContact O-N 3.36Å; F287-A315 HydrophobicContact CD1-CB 3.9Å; F287-A315 HydrophobicContact CD2-CB 4.11Å; F287-A315 HydrophobicContact CE1-CB 3.64Å; F287-A315 HydrophobicContact CE2-CB 3.88Å; F287-A315 HydrophobicContact CG-CB 4.14Å; F287-A315 HydrophobicContact CZ-CB 3.64Å
288	A	92.2	Very high	91.7	Very high	51 Å²	51	66.7 Å²	66.7	42%	0.421	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-45.1	176.8	0	0	0	0	0	112.1	E284 V285 V286 E290 V291 D292	E284-A288 PolarHBondContact O-N 2.53Å; V285-A288 PolarHBondContact O-N 2.77Å; V286-A288 PolarHBondContact O-N 3.06Å; A288-E290 PolarHBondContact O-N 2.9Å; A288-V291 PolarHBondContact O-N 3.02Å; A288-D292 PolarHBondContact O-N 3.27Å
289	K	92.7	Very high	91.9	Very high	111 Å²	111	64.4 Å²	64.4	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-42.2	176.9	-74.5	175.4	179.8	178.1	0	112.6	V285 V286 D292 T293	V285-K289 HydrophobicContact CG1-CD 4.36Å; V285-K289 WeakPolarHBondContact O-CG 3.42Å; V285-K289 PolarHBondContact O-N 3.28Å; V285-K289 VanDerWaalsContact O-N 3.08Å; V286-K289 PolarHBondContact O-N 3.22Å; K289-D292 PolarHBondContact O-N 3.38Å; K289-T293 WeakPolarHBondContact O-CB 3.39Å; K289-T293 PolarHBondContact O-N 3.47Å; K289-T293 PolarHBondContact O-OG1 3.08Å
290	E	92.1	Very high	92.1	Very high	15 Å²	15	62.1 Å²	62.1	7%	0.07	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-45.5	176.8	-75.7	-59.7	122.1	0	0	111.4	S251 I272 I277 V286 F287 A288 D292 T293 L294	S251-E290 WeakPolarHBondContact CB-OE2 3.29Å; S251-E290 PolarHBondContact OG-OE2 2.9Å; I272-E290 HydrophobicContact CD1-CB 3.79Å; I272-E290 HydrophobicContact CD1-CG 4.33Å; I272-E290 HydrophobicContact CG2-CG 4.12Å; I277-E290 HydrophobicContact CD1-CG 3.66Å; V286-E290 PolarHBondContact O-N 3.2Å; F287-E290 PolarHBondContact O-N 3.4Å; A288-E290 PolarHBondContact O-N 2.9Å; E290-D292 VanDerWaalsContact C-N 3.29Å; E290-D292 PolarHBondContact O-N 3.43Å; E290-T293 PolarHBondContact O-N 3.35Å; E290-T293 VanDerWaalsContact O-N 3.09Å; E290-L294 WeakPolarHBondContact O-CG 3.37Å; E290-L294 PolarHBondContact O-N 3.23Å
291	V	92.1	Very high	92.1	Very high	14 Å²	14	57.4 Å²	57.4	9%	0.085	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-40.9	176.9	172	0	0	0	0	111.5	F287 A288 L294 R295 P301 V317	F287-V291 WeakPolarHBondContact O-CB 3.44Å; F287-V291 VanDerWaalsContact O-CG2 3.25Å; F287-V291 WeakPolarHBondContact O-CG2 3.36Å; F287-V291 PolarHBondContact O-N 3.36Å; A288-V291 PolarHBondContact O-N 3.02Å; V291-L294 PolarHBondContact O-N 2.84Å; V291-R295 WeakPolarHBondContact O-CG 3.46Å; V291-R295 PolarHBondContact O-N 3.29Å; V291-P301 HydrophobicContact CG1-CB 4.06Å; V291-P301 HydrophobicContact CG1-CG 3.79Å; V291-V317 HydrophobicContact CG2-CG1 4.4Å; V291-V317 HydrophobicContact CG2-CG2 4.22Å
292	D	93.2	Very high	92.1	Very high	72 Å²	72	62.6 Å²	62.6	39%	0.385	32%	0.318	S	S	.	.	H	α-helix	trans	-69	-33.7	176	-74.8	-23.6	0	0	0	113	A288 K289 E290 R295 K296	A288-D292 PolarHBondContact O-N 3.27Å; K289-D292 PolarHBondContact O-N 3.38Å; E290-D292 VanDerWaalsContact C-N 3.29Å; E290-D292 PolarHBondContact O-N 3.43Å; D292-R295 PolarHBondContact O-N 3.09Å; D292-R295 IonicContact OD1-CZ 3.84Å; D292-R295 IonicContact OD1-NH1 2.91Å; D292-R295 PolarHBondContact OD1-NH1 3.06Å; D292-K296 WeakPolarHBondContact O-CG 3.45Å; D292-K296 PolarHBondContact O-N 2.96Å
293	T	92.5	Very high	92.1	Very high	52 Å²	52	62 Å²	62	32%	0.319	31%	0.306	S	S	.	.	H	α-helix	trans	-68.1	-40.7	174.2	-56.4	0	0	0	0	111.1	K289 E290 R295 K296 L297	K289-T293 WeakPolarHBondContact O-CB 3.39Å; K289-T293 PolarHBondContact O-N 3.47Å; K289-T293 PolarHBondContact O-OG1 3.08Å; E290-T293 PolarHBondContact O-N 3.35Å; E290-T293 VanDerWaalsContact O-N 3.09Å; T293-R295 VanDerWaalsContact C-N 3.33Å; T293-R295 PolarHBondContact O-N 2.81Å; T293-K296 WeakPolarHBondContact O-CB 3.28Å; T293-K296 PolarHBondContact O-N 3.46Å; T293-L297 HydrophobicContact CG2-CD1 4.39Å; T293-L297 WeakPolarHBondContact O-CG 3.39Å; T293-L297 PolarHBondContact O-N 3.19Å
294	L	92.2	Very high	92.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-40.1	174.1	-69.4	171	0	0	0	112.1	I270 E290 V291 K296 L297 F299 V317	I270-L294 HydrophobicContact CD1-CD1 3.52Å; I270-L294 HydrophobicContact CD1-CD2 3.44Å; I270-L294 VanDerWaalsContact CD1-CD2 3.44Å; I270-L294 HydrophobicContact CD1-CG 4.13Å; E290-L294 WeakPolarHBondContact O-CG 3.37Å; E290-L294 PolarHBondContact O-N 3.23Å; V291-L294 PolarHBondContact O-N 2.84Å; L294-K296 VanDerWaalsContact C-N 3.3Å; L294-K296 PolarHBondContact O-N 3.11Å; L294-L297 CarbonylContact O-C 3.59Å; L294-L297 WeakPolarHBondContact O-CA 3.34Å; L294-L297 PolarHBondContact O-N 3.45Å; L294-F299 HydrophobicContact CB-CB 4.17Å; L294-F299 HydrophobicContact CD2-CD2 4.22Å; L294-F299 WeakPolarHBondContact O-CB 3.32Å; L294-F299 PolarHBondContact O-N 3.48Å; L294-F299 VanDerWaalsContact O-N 3.09Å; L294-V317 HydrophobicContact CD1-CG1 4.43Å
295	R	92.5	Very high	92.2	Very high	128 Å²	128	58.9 Å²	58.9	48%	0.483	29%	0.29	S	S	.	.	H	α-helix	trans	-57.8	-41.6	174.3	-73.5	171.5	178.5	168.7	-6.5	112.5	V291 D292 T293 L297 Q298 F299 P301	V291-R295 WeakPolarHBondContact O-CG 3.46Å; V291-R295 PolarHBondContact O-N 3.29Å; D292-R295 PolarHBondContact O-N 3.09Å; D292-R295 IonicContact OD1-CZ 3.84Å; D292-R295 IonicContact OD1-NH1 2.91Å; D292-R295 PolarHBondContact OD1-NH1 3.06Å; T293-R295 VanDerWaalsContact C-N 3.33Å; T293-R295 PolarHBondContact O-N 2.81Å; R295-L297 PolarHBondContact O-N 2.98Å; R295-Q298 PolarHBondContact O-N 2.95Å; R295-F299 WeakPolarHBondContact CA-O 3.45Å; R295-P301 HydrophobicContact CG-CG 4.16Å
296	K	93	Very high	92.2	Very high	171 Å²	171	59.1 Å²	59.1	74%	0.743	29%	0.291	S	S	*	.	H	α-helix	trans	-64.4	-28.9	175.7	-65.8	171	-174.1	174.1	0	112.4	D292 T293 L294 Q298	D292-K296 WeakPolarHBondContact O-CG 3.45Å; D292-K296 PolarHBondContact O-N 2.96Å; T293-K296 WeakPolarHBondContact O-CB 3.28Å; T293-K296 PolarHBondContact O-N 3.46Å; L294-K296 VanDerWaalsContact C-N 3.3Å; L294-K296 PolarHBondContact O-N 3.11Å; K296-Q298 PolarHBondContact O-N 2.93Å
297	L	92	Very high	92	Very high	57 Å²	57	59 Å²	59	30%	0.298	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	23.6	177.8	-63.4	169.6	0	0	0	113.4	S251 T293 L294 R295 F299	S251-L297 WeakPolarHBondContact O-CD1 3.3Å; T293-L297 HydrophobicContact CG2-CD1 4.39Å; T293-L297 WeakPolarHBondContact O-CG 3.39Å; T293-L297 PolarHBondContact O-N 3.19Å; L294-L297 CarbonylContact O-C 3.59Å; L294-L297 WeakPolarHBondContact O-CA 3.34Å; L294-L297 PolarHBondContact O-N 3.45Å; R295-L297 PolarHBondContact O-N 2.98Å; L297-F299 HydrophobicContact CB-CD2 4.01Å; L297-F299 HydrophobicContact CB-CE2 4.35Å; L297-F299 WeakPolarHBondContact O-CD2 3.4Å; L297-F299 PolarHBondContact O-N 3.08Å
298	Q	90.8	Very high	91.8	Very high	103 Å²	103	63.8 Å²	63.8	48%	0.481	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	19.6	178.6	-50.1	-177.7	-40.2	0	0	115	R295 K296 Y321 R322	R295-Q298 PolarHBondContact O-N 2.95Å; K296-Q298 PolarHBondContact O-N 2.93Å; Q298-Y321 HydrophobicContact CB-CE2 4.35Å; Q298-R322 HydrophobicContact CB-CG 4.13Å; Q298-R322 PolarHBondContact O-N 3.4Å
299	F	92.9	Very high	91.6	Very high	4 Å²	4	66.3 Å²	66.3	2%	0.018	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.5	170.2	-70.9	-85.7	0	0	0	111.6	V254 A258 L262 A268 L294 R295 L297 P301 A319 Q320 Y321	V254-F299 HydrophobicContact CG1-CE2 4.32Å; V254-F299 HydrophobicContact CG1-CZ 3.96Å; A258-F299 HydrophobicContact CB-CE1 4.24Å; A258-F299 HydrophobicContact CB-CE2 4.11Å; A258-F299 HydrophobicContact CB-CZ 3.39Å; L262-F299 HydrophobicContact CD2-CE1 4.05Å; A268-F299 HydrophobicContact CB-CD1 4.17Å; A268-F299 HydrophobicContact CB-CE1 3.51Å; A268-F299 HydrophobicContact CB-CZ 4.17Å; L294-F299 HydrophobicContact CB-CB 4.17Å; L294-F299 HydrophobicContact CD2-CD2 4.22Å; L294-F299 WeakPolarHBondContact O-CB 3.32Å; L294-F299 PolarHBondContact O-N 3.48Å; L294-F299 VanDerWaalsContact O-N 3.09Å; R295-F299 WeakPolarHBondContact CA-O 3.45Å; L297-F299 HydrophobicContact CB-CD2 4.01Å; L297-F299 HydrophobicContact CB-CE2 4.35Å; L297-F299 WeakPolarHBondContact O-CD2 3.4Å; L297-F299 PolarHBondContact O-N 3.08Å; F299-P301 WeakPolarHBondContact O-CD 3.36Å; F299-A319 HydrophobicContact CB-CB 3.99Å; F299-A319 HydrophobicContact CD1-CB 4.06Å; F299-A319 HydrophobicContact CG-CB 4.39Å; F299-Q320 CarbonylContact C-O 3.43Å; F299-Q320 WeakPolarHBondContact CA-O 3.5Å; F299-Y321 HydrophobicContact CD1-CD2 4.02Å; F299-Y321 HydrophobicContact CD2-CD2 4.27Å; F299-Y321 AromaticContact CE1-CD2 3.7Å; F299-Y321 HydrophobicContact CE1-CD2 3.7Å; F299-Y321 HydrophobicContact CE1-CG 4.1Å; F299-Y321 AromaticContact CE2-CD2 3.97Å; F299-Y321 HydrophobicContact CE2-CD2 3.97Å; F299-Y321 HydrophobicContact CE2-CE2 4.38Å; F299-Y321 HydrophobicContact CG-CD2 4.31Å; F299-Y321 AromaticContact CZ-CD2 3.7Å; F299-Y321 HydrophobicContact CZ-CD2 3.7Å; F299-Y321 HydrophobicContact CZ-CE2 4.39Å; F299-Y321 HydrophobicContact CZ-CG 4.42Å
300	T	93.1	Very high	91.4	Very high	55 Å²	55	63 Å²	63	34%	0.337	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	104.2	169.3	-55.9	0	0	0	0	108.6	R302 A319 Q320	T300-R302 PolarHBondContact O-N 2.84Å; T300-A319 CarbonylContact O-C 3.59Å; T300-A319 WeakPolarHBondContact O-CA 3.1Å; T300-Q320 PolarHBondContact N-O 2.9Å; T300-Q320 PolarHBondContact O-N 3.47Å
301	P	91.8	Very high	91.1	Very high	34 Å²	34	64.1 Å²	64.1	22%	0.221	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	135.2	176.1	27.6	-35.2	0	0	0	110	V291 R295 F299 V317	V291-P301 HydrophobicContact CG1-CB 4.06Å; V291-P301 HydrophobicContact CG1-CG 3.79Å; R295-P301 HydrophobicContact CG-CG 4.16Å; F299-P301 WeakPolarHBondContact O-CD 3.36Å; P301-V317 HydrophobicContact CB-CG1 4.46Å
302	R	91.1	Very high	90.9	Very high	136 Å²	136	73.8 Å²	73.8	51%	0.513	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-44.2	-178	-67	-61.8	-170.6	-175.5	-1.7	111.7	T300 T318 Q320	T300-R302 PolarHBondContact O-N 2.84Å; R302-T318 PolarHBondContact N-O 3.1Å; R302-Q320 HydrophobicContact CG-CB 4.43Å
303	E	91.4	Very high	90.6	Very high	35 Å²	35	71.2 Å²	71.2	16%	0.164	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	148	-174.7	-158.8	-173.1	173.4	0	0	110.2	L160 D161 V305 V317 T318	L160-E303 VanDerWaalsContact CA-OE1 3.32Å; L160-E303 WeakPolarHBondContact CA-OE1 3.42Å; D161-E303 VanDerWaalsContact N-CD 3.29Å; D161-E303 PolarHBondContact N-OE1 3.41Å; D161-E303 PolarHBondContact N-OE2 3.27Å; E303-V305 HydrophobicContact CG-CG2 4.18Å; E303-V305 WeakPolarHBondContact OE1-CG2 3.46Å; E303-V317 WeakPolarHBondContact O-CA 3.32Å; E303-T318 WeakPolarHBondContact CB-OG1 3.33Å; E303-T318 PolarHBondContact N-O 3.08Å; E303-T318 PolarHBondContact N-OG1 3.48Å; E303-T318 PolarHBondContact O-N 2.91Å
304	Q	91.5	Very high	90.6	Very high	93 Å²	93	69.6 Å²	69.6	44%	0.435	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	127.7	170.6	176.3	179.6	-9.3	0	0	108.4	M316 V317	Q304-M316 WeakPolarHBondContact CA-O 3.47Å; Q304-V317 HydrophobicContact CB-CG2 4.26Å; Q304-V317 HydrophobicContact CG-CG2 3.99Å
305	V	92.4	Very high	90.6	Very high	21 Å²	21	69.6 Å²	69.6	13%	0.127	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.2	179.5	176.7	0	0	0	0	109	N158 L160 E303 A315 M316	N158-V305 HydrophobicContact CB-CG1 3.73Å; L160-V305 HydrophobicContact CD2-CB 3.88Å; L160-V305 HydrophobicContact CD2-CG2 3.62Å; L160-V305 HydrophobicContact CG-CB 4.25Å; L160-V305 HydrophobicContact CG-CG2 4.15Å; E303-V305 HydrophobicContact CG-CG2 4.18Å; E303-V305 WeakPolarHBondContact OE1-CG2 3.46Å; V305-A315 CarbonylContact O-C 3.54Å; V305-A315 WeakPolarHBondContact O-CA 3.25Å; V305-M316 PolarHBondContact N-O 3.45Å; V305-M316 PolarHBondContact O-N 2.96Å
306	T	92.2	Very high	90.7	Very high	77 Å²	77	63.5 Å²	63.5	47%	0.472	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	144.5	172.1	52.4	0	0	0	0	109.9	N158 E308	N158-T306 PolarHBondContact ND2-O 3.29Å; T306-E308 VanDerWaalsContact C-N 3.31Å; T306-E308 PolarHBondContact O-N 2.98Å
307	L	89.4	Confident	90.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.272	C	S	.	.			trans	-91.4	12.6	-176.2	-60.9	-173.4	0	0	0	113.7	K151 A154 G155 N158 F310 E311 H314 M316	K151-L307 HydrophobicContact CB-CD1 3.95Å; A154-L307 HydrophobicContact CB-CB 4.44Å; A154-L307 HydrophobicContact CB-CD2 4.18Å; G155-L307 VanDerWaalsContact CA-CD2 3.48Å; N158-L307 VanDerWaalsContact ND2-CA 3.31Å; N158-L307 WeakPolarHBondContact ND2-CA 3.15Å; L307-F310 PolarHBondContact O-N 2.8Å; L307-E311 HydrophobicContact CB-CB 4.42Å; L307-E311 PolarHBondContact O-N 2.82Å; L307-E311 VanDerWaalsContact O-N 3.09Å; L307-H314 HydrophobicContact CB-CB 4.07Å; L307-H314 HydrophobicContact CD1-CB 4.01Å; L307-H314 HydrophobicContact CG-CB 4.29Å; L307-H314 PolarHBondContact N-O 3.34Å; L307-M316 HydrophobicContact CD1-CE 4.21Å; L307-M316 HydrophobicContact CD2-CB 4.08Å; L307-M316 HydrophobicContact CD2-CE 4.43Å
308	E	87.1	Confident	90.8	Very high	110 Å²	110	52.8 Å²	52.8	51%	0.514	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	134.9	174.1	-59.4	-164.9	159.9	0	0	109.7	N158 T306	N158-E308 PolarHBondContact ND2-O 3.44Å; T306-E308 VanDerWaalsContact C-N 3.31Å; T306-E308 PolarHBondContact O-N 2.98Å
309	P	87.3	Confident	90.9	Very high	104 Å²	104	48 Å²	48	68%	0.675	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	cis	-94.2	1.7	18.1	36.7	-37.2	0	0	0	116.2
310	F	88.2	Confident	91	Very high	41 Å²	41	49.1 Å²	49.1	18%	0.18	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-47.5	-172.7	-57.6	-72.4	0	0	0	112.8	P147 F148 A154 V157 N158 L307	P147-F310 HydrophobicContact CB-CD1 3.69Å; P147-F310 HydrophobicContact CB-CD2 4.29Å; P147-F310 HydrophobicContact CB-CE1 3.59Å; P147-F310 HydrophobicContact CB-CE2 4.18Å; P147-F310 HydrophobicContact CB-CG 4.05Å; P147-F310 HydrophobicContact CB-CZ 3.84Å; P147-F310 HydrophobicContact CG-CD1 3.83Å; P147-F310 HydrophobicContact CG-CE1 3.37Å; P147-F310 HydrophobicContact CG-CZ 3.86Å; F148-F310 HydrophobicContact CD1-CB 4.49Å; F148-F310 AromaticContact CD1-CD1 3.88Å; F148-F310 HydrophobicContact CD1-CD1 3.88Å; F148-F310 HydrophobicContact CD2-CD1 4.13Å; F148-F310 HydrophobicContact CD2-CE1 4.41Å; F148-F310 AromaticContact CE1-CD1 3.68Å; F148-F310 HydrophobicContact CE1-CD1 3.68Å; F148-F310 HydrophobicContact CE1-CE1 4.34Å; F148-F310 AromaticContact CE2-CD1 3.94Å; F148-F310 HydrophobicContact CE2-CD1 3.94Å; F148-F310 AromaticContact CE2-CE1 3.94Å; F148-F310 HydrophobicContact CE2-CE1 3.94Å; F148-F310 HydrophobicContact CG-CD1 4.1Å; F148-F310 AromaticContact CZ-CD1 3.71Å; F148-F310 HydrophobicContact CZ-CD1 3.71Å; F148-F310 AromaticContact CZ-CE1 3.91Å; F148-F310 HydrophobicContact CZ-CE1 3.91Å; A154-F310 HydrophobicContact CB-CB 3.83Å; A154-F310 HydrophobicContact CB-CD2 3.67Å; A154-F310 HydrophobicContact CB-CG 3.94Å; V157-F310 HydrophobicContact CB-CE2 4.03Å; V157-F310 HydrophobicContact CB-CZ 4.26Å; V157-F310 HydrophobicContact CG1-CE2 3.77Å; V157-F310 HydrophobicContact CG1-CZ 3.72Å; N158-F310 WeakPolarHBondContact OD1-CE2 3.31Å; L307-F310 PolarHBondContact O-N 2.8Å
311	E	86	Confident	91	Very high	39 Å²	39	46.8 Å²	46.8	18%	0.182	23%	0.227	C	C	.	.	S	Bend	trans	-131.6	119.2	178.7	-66.9	-166.9	166.7	0	0	110.8	K151 L307 H314	K151-E311 WeakPolarHBondContact CD-OE2 3.31Å; K151-E311 WeakPolarHBondContact CE-OE2 3.5Å; K151-E311 WeakPolarHBondContact CG-OE2 3.5Å; L307-E311 HydrophobicContact CB-CB 4.42Å; L307-E311 PolarHBondContact O-N 2.82Å; L307-E311 VanDerWaalsContact O-N 3.09Å; E311-H314 HydrophobicContact CB-CB 3.98Å; E311-H314 IonicContact OE2-CD2 3.02Å; E311-H314 PolarHBondContact OE2-CD2 3.09Å; E311-H314 IonicContact OE2-CE1 3.73Å; E311-H314 IonicContact OE2-CG 3.36Å; E311-H314 IonicContact OE2-ND1 3.8Å; E311-H314 IonicContact OE2-NE2 3.14Å; E311-H314 PolarHBondContact OE2-NE2 2.96Å
312	R	88.3	Confident	90.9	Very high	217 Å²	217	50 Å²	50	82%	0.819	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	139.8	178.6	-66.1	-176.7	-178.5	179.4	-0.8	111.2	H314	R312-H314 PolarHBondContact O-N 2.98Å; R312-H314 PolarHBondContact O-ND1 3.47Å
313	G	87.8	Confident	90.3	Very high	18 Å²	18	44.7 Å²	44.7	19%	0.186	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	22.3	177.6	0	0	0	0	0	114.6	A274	A274-G313 WeakPolarHBondContact CB-O 3.07Å; A274-G313 PolarHBondContact N-O 3.32Å; A274-G313 VanDerWaalsContact N-O 3.08Å
314	H	92.1	Very high	89.5	Confident	19 Å²	19	47.5 Å²	47.5	9%	0.088	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	141.3	174.3	-68	69.2	0	0	0	110.5	I272 K273 L307 E311 R312	I272-H314 VanDerWaalsContact O-CA 3.31Å; I272-H314 WeakPolarHBondContact O-CA 3.39Å; K273-H314 VanDerWaalsContact CD-NE2 3.27Å; K273-H314 WeakPolarHBondContact CD-NE2 3.31Å; K273-H314 VanDerWaalsContact CG-NE2 3.31Å; K273-H314 WeakPolarHBondContact CG-NE2 3.49Å; L307-H314 HydrophobicContact CB-CB 4.07Å; L307-H314 HydrophobicContact CD1-CB 4.01Å; L307-H314 HydrophobicContact CG-CB 4.29Å; L307-H314 PolarHBondContact N-O 3.34Å; E311-H314 HydrophobicContact CB-CB 3.98Å; E311-H314 IonicContact OE2-CD2 3.02Å; E311-H314 PolarHBondContact OE2-CD2 3.09Å; E311-H314 IonicContact OE2-CE1 3.73Å; E311-H314 IonicContact OE2-CG 3.36Å; E311-H314 IonicContact OE2-ND1 3.8Å; E311-H314 IonicContact OE2-NE2 3.14Å; E311-H314 PolarHBondContact OE2-NE2 2.96Å; R312-H314 PolarHBondContact O-N 2.98Å; R312-H314 PolarHBondContact O-ND1 3.47Å
315	A	92.3	Very high	88.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	150.9	171.6	0	0	0	0	0	109.8	S271 I272 F287 V305	S271-A315 CarbonylContact C-O 3.6Å; I272-A315 PolarHBondContact N-O 3.14Å; I272-A315 PolarHBondContact O-N 3.32Å; F287-A315 HydrophobicContact CD1-CB 3.9Å; F287-A315 HydrophobicContact CD2-CB 4.11Å; F287-A315 HydrophobicContact CE1-CB 3.64Å; F287-A315 HydrophobicContact CE2-CB 3.88Å; F287-A315 HydrophobicContact CG-CB 4.14Å; F287-A315 HydrophobicContact CZ-CB 3.64Å; V305-A315 CarbonylContact O-C 3.54Å; V305-A315 WeakPolarHBondContact O-CA 3.25Å
316	M	93.7	Very high	86.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.7	169	-167.9	158.8	-59	0	0	108.8	K151 L160 F242 V269 I270 Q304 V305 L307	K151-M316 HydrophobicContact CB-CE 4.15Å; K151-M316 WeakPolarHBondContact O-CE 3.36Å; L160-M316 HydrophobicContact CD1-CB 4.16Å; L160-M316 HydrophobicContact CD1-CG 3.81Å; L160-M316 HydrophobicContact CD1-SD 3.22Å; L160-M316 WeakPolarHBondContact CD1-SD 3.39Å; L160-M316 HydrophobicContact CD2-CB 4.48Å; L160-M316 HydrophobicContact CD2-CG 4.43Å; F242-M316 HydrophobicContact CE2-CE 4.02Å; F242-M316 HydrophobicContact CE2-SD 4.21Å; F242-M316 HydrophobicContact CZ-CE 4.23Å; V269-M316 HydrophobicContact CG1-CG 3.68Å; V269-M316 HydrophobicContact CG1-SD 3.44Å; V269-M316 WeakPolarHBondContact CG1-SD 3.41Å; I270-M316 WeakPolarHBondContact O-CA 3.49Å; Q304-M316 WeakPolarHBondContact CA-O 3.47Å; V305-M316 PolarHBondContact N-O 3.45Å; V305-M316 PolarHBondContact O-N 2.96Å; L307-M316 HydrophobicContact CD1-CE 4.21Å; L307-M316 HydrophobicContact CD2-CB 4.08Å; L307-M316 HydrophobicContact CD2-CE 4.43Å
317	V	93.2	Very high	84.7	Confident	1 Å²	1	63 Å²	63	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.7	177.8	177.2	0	0	0	0	108.3	I270 I272 V291 L294 P301 E303 Q304	I270-V317 PolarHBondContact N-O 3.26Å; I270-V317 PolarHBondContact O-N 3.37Å; I272-V317 HydrophobicContact CD1-CB 4.31Å; I272-V317 HydrophobicContact CD1-CG2 3.58Å; I272-V317 HydrophobicContact CG1-CG2 4.48Å; V291-V317 HydrophobicContact CG2-CG1 4.4Å; V291-V317 HydrophobicContact CG2-CG2 4.22Å; L294-V317 HydrophobicContact CD1-CG1 4.43Å; P301-V317 HydrophobicContact CB-CG1 4.46Å; E303-V317 WeakPolarHBondContact O-CA 3.32Å; Q304-V317 HydrophobicContact CB-CG2 4.26Å; Q304-V317 HydrophobicContact CG-CG2 3.99Å
318	T	93.8	Very high	82.5	Confident	2 Å²	2	71.8 Å²	71.8	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.6	169.8	70.6	0	0	0	0	108.7	L160 A268 V269 R302 E303	L160-T318 HydrophobicContact CD2-CG2 3.97Å; A268-T318 CarbonylContact O-C 3.56Å; A268-T318 WeakPolarHBondContact O-CA 3.13Å; V269-T318 HydrophobicContact CG1-CG2 4.43Å; V269-T318 HydrophobicContact CG2-CG2 4.16Å; R302-T318 PolarHBondContact N-O 3.1Å; E303-T318 WeakPolarHBondContact CB-OG1 3.33Å; E303-T318 PolarHBondContact N-O 3.08Å; E303-T318 PolarHBondContact N-OG1 3.48Å; E303-T318 PolarHBondContact O-N 2.91Å
319	A	93.6	Very high	80.4	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.008	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	148.1	-178.3	0	0	0	0	0	111.1	H267 A268 F299 T300	H267-A319 CarbonylContact C-O 3.46Å; H267-A319 WeakPolarHBondContact CA-O 3.38Å; A268-A319 PolarHBondContact N-O 3.07Å; A268-A319 PolarHBondContact O-N 2.83Å; F299-A319 HydrophobicContact CB-CB 3.99Å; F299-A319 HydrophobicContact CD1-CB 4.06Å; F299-A319 HydrophobicContact CG-CB 4.39Å; T300-A319 CarbonylContact O-C 3.59Å; T300-A319 WeakPolarHBondContact O-CA 3.1Å
320	Q	94.1	Very high	78	Confident	29 Å²	29	76.4 Å²	76.4	14%	0.136	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.5	177.3	-170.9	174.5	21.5	0	0	110.1	G265 F299 T300 R302 A323	G265-Q320 PolarHBondContact O-NE2 2.86Å; G265-Q320 VanDerWaalsContact O-NE2 3.1Å; F299-Q320 CarbonylContact C-O 3.43Å; F299-Q320 WeakPolarHBondContact CA-O 3.5Å; T300-Q320 PolarHBondContact N-O 2.9Å; T300-Q320 PolarHBondContact O-N 3.47Å; R302-Q320 HydrophobicContact CG-CB 4.43Å; Q320-A323 HydrophobicContact CB-CB 4.43Å; Q320-A323 HydrophobicContact CG-CB 4.19Å
321	Y	93.9	Very high	75.5	Confident	5 Å²	5	86.6 Å²	86.6	2%	0.02	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.2	180	-174.5	-117	0	0	0	111.2	A258 L262 G265 G266 Q298 F299 A323	A258-Y321 HydrophobicContact CB-CD2 4.06Å; A258-Y321 HydrophobicContact CB-CE2 4.05Å; A258-Y321 HydrophobicContact CB-CG 4.41Å; L262-Y321 HydrophobicContact CB-CD1 4.24Å; L262-Y321 HydrophobicContact CD2-CD1 4.19Å; L262-Y321 HydrophobicContact CD2-CG 3.85Å; L262-Y321 HydrophobicContact CG-CD1 4.19Å; L262-Y321 HydrophobicContact CG-CG 4.35Å; G265-Y321 VanDerWaalsContact CA-O 3.24Å; G265-Y321 WeakPolarHBondContact CA-O 3.48Å; G265-Y321 PolarHBondContact N-O 3.2Å; G266-Y321 PolarHBondContact O-N 2.93Å; Q298-Y321 HydrophobicContact CB-CE2 4.35Å; F299-Y321 HydrophobicContact CD1-CD2 4.02Å; F299-Y321 HydrophobicContact CD2-CD2 4.27Å; F299-Y321 AromaticContact CE1-CD2 3.7Å; F299-Y321 HydrophobicContact CE1-CD2 3.7Å; F299-Y321 HydrophobicContact CE1-CG 4.1Å; F299-Y321 AromaticContact CE2-CD2 3.97Å; F299-Y321 HydrophobicContact CE2-CD2 3.97Å; F299-Y321 HydrophobicContact CE2-CE2 4.38Å; F299-Y321 HydrophobicContact CG-CD2 4.31Å; F299-Y321 AromaticContact CZ-CD2 3.7Å; F299-Y321 HydrophobicContact CZ-CD2 3.7Å; F299-Y321 HydrophobicContact CZ-CE2 4.39Å; F299-Y321 HydrophobicContact CZ-CG 4.42Å; Y321-A323 VanDerWaalsContact C-N 3.27Å; Y321-A323 PolarHBondContact O-N 3.24Å
322	R	89	Confident	74.9	Confident	102 Å²	102	89 Å²	89	39%	0.385	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	45	52.9	-179.9	-66.1	178.7	174.5	172.3	2.9	112	N264 Q298	N264-R322 VanDerWaalsContact OD1-CD 3.3Å; N264-R322 WeakPolarHBondContact OD1-CD 3.45Å; N264-R322 PolarHBondContact OD1-NH1 2.8Å; Q298-R322 HydrophobicContact CB-CG 4.13Å; Q298-R322 PolarHBondContact O-N 3.4Å
323	A	79.3	Confident	74.2	Confident	24 Å²	24	82.3 Å²	82.3	20%	0.198	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-51.7	130	-178.8	0	0	0	0	0	109.6	Q320 Y321 K325	Q320-A323 HydrophobicContact CB-CB 4.43Å; Q320-A323 HydrophobicContact CG-CB 4.19Å; Y321-A323 VanDerWaalsContact C-N 3.27Å; Y321-A323 PolarHBondContact O-N 3.24Å; A323-K325 PolarHBondContact O-N 3.05Å
324	P	74.2	Confident	73.5	Confident	95 Å²	95	85.8 Å²	85.8	62%	0.617	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-56.8	130.1	177.4	22.8	-31.6	0	0	0	108	K326	P324-K326 PolarHBondContact O-N 3.04Å
325	K	66.7	Low	72.4	Confident	200 Å²	200	89.8 Å²	89.8	87%	0.87	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-54.2	117.5	172.5	-69.3	-177.6	179.9	179.2	0	105.9	A323 V327	A323-K325 PolarHBondContact O-N 3.05Å; K325-V327 PolarHBondContact O-N 3.36Å
326	K	59.4	Low	71.1	Confident	186 Å²	186	95.4 Å²	95.4	81%	0.809	47%	0.467	S	S	*	.			trans	-52.7	110.4	175	-77.5	-173.9	176	-175.5	0	106.6	P324 K328	P324-K326 PolarHBondContact O-N 3.04Å; K326-K328 PolarHBondContact O-N 3.16Å
327	V	49.2	Very low	69.6	Low	130 Å²	130	101.7 Å²	101.7	79%	0.788	50%	0.498	S	S	*	.			trans	-60.8	112.4	163.7	-176.9	0	0	0	0	103.5	K325 T329	K325-V327 PolarHBondContact O-N 3.36Å; V327-T329 VanDerWaalsContact C-N 3.3Å; V327-T329 PolarHBondContact O-N 3.44Å
328	K	43	Very low	68	Low	185 Å²	185	108.9 Å²	108.9	80%	0.804	53%	0.534	S	S	*	.			trans	-62.6	103.5	169.4	-74.9	-177	177	-177.2	0	104.9	K326 E330	K326-K328 PolarHBondContact O-N 3.16Å; K328-E330 VanDerWaalsContact C-N 3.27Å; K328-E330 PolarHBondContact O-N 2.93Å
329	T	42.8	Very low	66	Low	123 Å²	123	117.2 Å²	117.2	76%	0.755	57%	0.574	S	S	*	*			trans	-65	99.5	163.2	-46.4	0	0	0	0	105.2	V327 Q331	V327-T329 VanDerWaalsContact C-N 3.3Å; V327-T329 PolarHBondContact O-N 3.44Å; T329-Q331 PolarHBondContact O-N 3.46Å
330	E	37.1	Very low	63.7	Low	187 Å²	187	126.8 Å²	126.8	87%	0.874	62%	0.621	S	S	*	*			trans	-59.1	114.5	163.7	-71.6	177.3	162.8	0	0	106.5	K328	K328-E330 VanDerWaalsContact C-N 3.27Å; K328-E330 PolarHBondContact O-N 2.93Å
331	Q	35.2	Very low	60.9	Low	256 Å²	256	135.7 Å²	135.7	100%	1.196	67%	0.665	S	S	*	*			trans	-94.8	0	154.4	-74.9	-174.8	-8.9	0	0	107.3	T329	T329-Q331 PolarHBondContact O-N 3.46Å

Retrieved 331 of 331 residues in 150.2 ms (Link to these results)

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