A0A077Z7A0_TRITR Loading...

S4 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7A0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 199 aa.

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(Predicted Aligned Error values between residue pairs)

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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	46.2	Very low	50	Low	246 Å²	246	174.7 Å²	174.7	100%	1.212	90%	0.901	S	S	*	*				0	141.7	0	-66	-154.8	-159.8	0	0	107.8
2	A	45.2	Very low	50.2	Low	109 Å²	109	180.1 Å²	180.1	90%	0.901	90%	0.901	S	S	*	*			trans	73.1	112	-162.6	0	0	0	0	0	115
3	T	55.3	Low	50.5	Low	134 Å²	134	179.5 Å²	179.5	82%	0.822	90%	0.901	S	S	*	*			trans	-101.9	139.4	-167.7	40.4	0	0	0	0	112.3	R5	T3-R5 PolarHBondContact O-N 3.13Å
4	A	48.1	Very low	50.4	Low	104 Å²	104	172.3 Å²	172.3	86%	0.86	88%	0.883	S	S	*	*			trans	-67.8	118.7	169	0	0	0	0	0	112.1
5	R	55.4	Low	50.7	Low	239 Å²	239	177.3 Å²	177.3	90%	0.902	89%	0.887	S	S	*	*			trans	-158.4	118.6	163.9	-80.6	-170.2	154.2	164.3	-8.1	109.6	T3	T3-R5 PolarHBondContact O-N 3.13Å
6	S	51.7	Low	51.2	Low	119 Å²	119	173.8 Å²	173.8	83%	0.832	88%	0.877	S	S	*	*			trans	162.2	74.2	132	-175.9	0	0	0	0	110.6
7	L	48	Very low	51.5	Low	157 Å²	157	173.9 Å²	173.9	82%	0.822	88%	0.88	S	S	*	*			trans	-69.2	147.1	154.4	-94.3	166	0	0	0	109.7
8	L	50.5	Low	51.6	Low	156 Å²	156	168.1 Å²	168.1	82%	0.817	87%	0.871	S	S	*	*			trans	66.2	97.3	162.1	-74.7	85.8	0	0	0	118.8
9	R	52.9	Low	51.7	Low	232 Å²	232	165.8 Å²	165.8	88%	0.875	87%	0.868	S	S	*	*			trans	-146.5	151.5	145.5	-111.9	178.5	-175	-148.7	0	106.7
10	W	47.1	Very low	52.1	Low	253 Å²	253	164.2 Å²	164.2	96%	0.958	87%	0.865	S	S	*	*			trans	106.6	13.9	-179.9	-60.3	90.4	0	0	0	118.9
11	L	50.1	Low	52.3	Low	173 Å²	173	164 Å²	164	91%	0.906	86%	0.863	S	S	*	*			trans	-114.8	95.2	156.6	-99.6	144.3	0	0	0	109.4
12	R	51.8	Low	52.7	Low	239 Å²	239	156.4 Å²	156.4	90%	0.902	84%	0.839	S	S	*	*			trans	153.2	99.9	154.4	-90.1	174.6	-158.7	-167.7	5.6	110.9
13	L	53.7	Low	53.4	Low	172 Å²	172	158.7 Å²	158.7	90%	0.901	84%	0.836	S	S	*	*			trans	-153.1	102	143	-101.7	126	0	0	0	106.5
14	A	49.1	Very low	53.4	Low	79 Å²	79	161.2 Å²	161.2	65%	0.653	84%	0.839	S	S	*	*				72.9	96.9	120.6	0	0	0	0	0	111.9
15	R	54.8	Low	53.8	Low	248 Å²	248	162.4 Å²	162.4	94%	0.936	84%	0.835	S	S	*	*				35.2	90.5	57.6	-92.1	-167.2	-176.8	-164.7	1.5	112.3
16	T	59.2	Low	53.8	Low	120 Å²	120	155 Å²	155	74%	0.736	83%	0.825	S	S	*	*			trans	-177.1	127.5	141.3	37.5	0	0	0	0	111.2
17	L	56	Low	54.2	Low	177 Å²	177	158 Å²	158	93%	0.927	83%	0.826	S	S	*	*			trans	76	122.6	156	-50.8	152.6	0	0	0	114.7
18	G	54.3	Low	54.9	Low	69 Å²	69	158.5 Å²	158.5	71%	0.711	83%	0.827	S	S	*	*			cis	143.9	131.5	18.8	0	0	0	0	0	105.8
19	P	53.1	Low	55.4	Low	125 Å²	125	159 Å²	159	81%	0.812	83%	0.826	S	S	*	*			trans	-92.3	164.1	-172.2	36.7	-32.4	0	0	0	112.1
20	T	58.8	Low	56	Low	132 Å²	132	153.7 Å²	153.7	81%	0.81	82%	0.821	S	S	*	*			trans	156	157.4	147.9	-65.2	0	0	0	0	109.6
21	I	56.4	Low	56.9	Low	160 Å²	160	149.5 Å²	149.5	82%	0.821	82%	0.816	S	S	*	*			trans	103	86.2	174.9	-50.1	162.5	0	0	0	110.7
22	A	55.1	Low	57	Low	88 Å²	88	148.3 Å²	148.3	73%	0.727	81%	0.808	S	S	*	*				100.6	123.7	66.4	0	0	0	0	0	110.7
23	N	59.9	Low	57.1	Low	156 Å²	156	147.3 Å²	147.3	83%	0.834	80%	0.804	S	S	*	*			trans	-58	127.2	178.5	-64.3	-45.1	0	0	0	111.6
24	H	54.8	Low	57.4	Low	188 Å²	188	143.2 Å²	143.2	87%	0.87	80%	0.795	S	S	*	*			trans	-113.2	95.3	151.9	-100.7	-76.1	0	0	0	108.2	A26	H24-A26 PolarHBondContact O-N 2.96Å; H24-A26 VanDerWaalsContact O-N 3.14Å
25	V	56.8	Low	58.1	Low	128 Å²	128	146 Å²	146	78%	0.776	80%	0.798	S	S	*	*			trans	-68.8	99.7	160.5	171.7	0	0	0	0	105.9	Q27	V25-Q27 PolarHBondContact O-N 3.27Å
26	A	55.7	Low	58.1	Low	85 Å²	85	140.4 Å²	140.4	70%	0.702	79%	0.787	S	S	*	*			trans	-67.7	123.1	166.5	0	0	0	0	0	107.9	H24 I28	H24-A26 PolarHBondContact O-N 2.96Å; H24-A26 VanDerWaalsContact O-N 3.14Å; A26-I28 PolarHBondContact O-N 3.26Å
27	Q	60.8	Low	57.9	Low	182 Å²	182	140.2 Å²	140.2	85%	0.85	79%	0.786	S	S	*	*			trans	-57.7	117.3	176.7	-70.4	171.6	-37.4	0	0	109.5	V25 Q29	V25-Q27 PolarHBondContact O-N 3.27Å; Q27-Q29 PolarHBondContact O-N 3.19Å; Q27-Q29 VanDerWaalsContact O-N 3.13Å
28	I	61.2	Low	57.9	Low	166 Å²	166	137.6 Å²	137.6	85%	0.851	78%	0.777	S	S	*	*			trans	-61.7	112.6	164.4	-63.6	170.1	0	0	0	106.3	A26	A26-I28 PolarHBondContact O-N 3.26Å
29	Q	61.6	Low	57.8	Low	167 Å²	167	143.3 Å²	143.3	78%	0.78	78%	0.782	S	S	*	*			trans	-67.4	138.2	169.3	-64.1	-156.1	2.3	0	0	109.1	Q27 I31	Q27-Q29 PolarHBondContact O-N 3.19Å; Q27-Q29 VanDerWaalsContact O-N 3.13Å; Q29-I31 PolarHBondContact O-N 3.11Å
30	P	66.7	Low	57.6	Low	120 Å²	120	147.8 Å²	147.8	78%	0.779	78%	0.783	S	S	*	*			trans	-65	124.5	174.1	26.6	-31.2	0	0	0	109.1	M32	P30-M32 PolarHBondContact O-N 3.18Å; P30-M32 VanDerWaalsContact O-N 3.13Å
31	I	65.7	Low	56.8	Low	165 Å²	165	153 Å²	153	85%	0.846	79%	0.788	S	S	*	*			trans	-58.8	115.6	170	-61.8	167	0	0	0	107.2	Q29 R33	Q29-I31 PolarHBondContact O-N 3.11Å; I31-R33 PolarHBondContact O-N 3.08Å
32	M	51.1	Low	56.4	Low	149 Å²	149	153.1 Å²	153.1	73%	0.734	79%	0.789	S	S	*	*			trans	-54.1	126.4	170.3	-91.5	-178	85.8	0	0	108.8	P30 D36	P30-M32 PolarHBondContact O-N 3.18Å; P30-M32 VanDerWaalsContact O-N 3.13Å; M32-D36 HydrophobicContact CE-CB 4.4Å
33	R	55.1	Low	56.1	Low	218 Å²	218	157.9 Å²	157.9	82%	0.823	80%	0.796	S	S	*	*			trans	-66.2	142.8	168.1	-77.2	-170.7	165.9	145.6	-2.1	109.5	I31 D35	I31-R33 PolarHBondContact O-N 3.08Å; R33-D35 PolarHBondContact O-N 3.39Å
34	A	60.1	Low	55.9	Low	86 Å²	86	155.4 Å²	155.4	71%	0.711	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	0.5	-169.7	0	0	0	0	0	115.8
35	D	61.9	Low	55.9	Low	136 Å²	136	151.8 Å²	151.8	73%	0.727	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-1.5	-168.3	-56.6	-44	0	0	0	115	R33	R33-D35 PolarHBondContact O-N 3.39Å
36	D	55	Low	55.6	Low	131 Å²	131	152 Å²	152	70%	0.701	79%	0.794	S	S	*	*	S	Bend	trans	-104.4	3.1	-175	-119.1	-42.6	0	0	0	115.6	M32	M32-D36 HydrophobicContact CE-CB 4.4Å
37	V	56.3	Low	55.5	Low	116 Å²	116	152.5 Å²	152.5	70%	0.703	80%	0.799	S	S	*	*	S	Bend	trans	-87.2	-4.9	-176.3	-172.3	0	0	0	0	112.9
38	T	55.6	Low	55	Low	122 Å²	122	151 Å²	151	75%	0.748	80%	0.796	S	S	*	*	S	Bend	trans	-94.6	7.9	-167.4	55.6	0	0	0	0	116.6
39	K	51.9	Low	54.7	Low	189 Å²	189	153.2 Å²	153.2	82%	0.822	79%	0.794	S	S	*	*	S	Bend	trans	-123	7.8	-169.8	-77.4	-172.7	179.5	177.8	0	119.1
40	R	48	Very low	54.1	Low	219 Å²	219	155.5 Å²	155.5	83%	0.826	80%	0.795	S	S	*	*	S	Bend	trans	-144.9	111.1	171.1	-73	172.5	154.9	-177	-8.3	104.1
41	W	44	Very low	53	Low	242 Å²	242	160 Å²	160	92%	0.917	80%	0.802	S	S	*	*				-159	109.4	56.2	-79	65.8	0	0	0	107.4
42	L	47.7	Very low	52.4	Low	162 Å²	162	161 Å²	161	85%	0.848	80%	0.804	S	S	*	*			trans	-96.8	154.6	153.7	-72.1	166.2	0	0	0	106.3
43	H	48.8	Very low	52	Low	189 Å²	189	164.1 Å²	164.1	88%	0.875	81%	0.813	S	S	*	*			trans	92.1	81.8	-175.3	-58.3	-98.5	0	0	0	115.6
44	A	54.6	Low	52.2	Low	104 Å²	104	160 Å²	160	86%	0.86	81%	0.812	S	S	*	*				-164	122.8	121.5	0	0	0	0	0	110.3
45	S	55.6	Low	51.4	Low	112 Å²	112	161.5 Å²	161.5	78%	0.783	81%	0.814	S	S	*	*			trans	-62.4	140.5	-176.4	39.4	0	0	0	0	115.4
46	V	49.6	Very low	50.3	Low	131 Å²	131	165.1 Å²	165.1	79%	0.794	82%	0.823	S	S	*	*			trans	0.4	113.1	139.8	-177.8	0	0	0	0	115.4	L48	V46-L48 HydrophobicContact CG1-CD1 4.26Å
47	A	53.9	Low	50.2	Low	96 Å²	96	168.6 Å²	168.6	79%	0.793	83%	0.832	S	S	*	*			trans	-146.8	105	151	0	0	0	0	0	109.2
48	L	51.2	Low	49.5	Very low	151 Å²	151	168 Å²	168	79%	0.791	83%	0.831	S	S	*	*			trans	-60.4	130.8	161.8	-77	83.5	0	0	0	108.8	V46	V46-L48 HydrophobicContact CG1-CD1 4.26Å
49	R	53.6	Low	48.5	Very low	213 Å²	213	168.1 Å²	168.1	80%	0.804	83%	0.831	S	S	*	*			trans	174.9	128.4	131	-100.5	163.1	170.1	-118.3	-0.5	114.1
50	R	50.6	Low	48.3	Very low	215 Å²	215	169.2 Å²	169.2	81%	0.811	83%	0.832	S	S	*	*			trans	57.3	119	139.5	-76.9	-179.2	164.1	175.1	-5	120.2	Q52	R50-Q52 PolarHBondContact O-N 3.14Å
51	K	43.6	Very low	47.8	Very low	215 Å²	215	167.8 Å²	167.8	94%	0.935	83%	0.834	S	S	*	*			trans	-38.4	117.2	164.1	-65.4	175.9	172.2	-175.7	0	113.8
52	Q	51.7	Low	47.7	Very low	186 Å²	186	163.2 Å²	163.2	87%	0.869	83%	0.828	S	S	*	*			trans	-141.9	131.9	153.5	-79.1	-170.8	-52.4	0	0	110	R50	R50-Q52 PolarHBondContact O-N 3.14Å
53	K	42.9	Very low	47.3	Very low	213 Å²	213	162.7 Å²	162.7	93%	0.926	83%	0.826	S	S	*	*			trans	-68.2	121.1	171.6	-89.3	178.5	165.3	-175.5	0	110.5
54	V	60.5	Low	46.6	Very low	132 Å²	132	160.3 Å²	160.3	80%	0.8	82%	0.82	S	S	*	*			trans	-159.8	164.8	156.9	-131.5	0	0	0	0	109.4
55	P	42.6	Very low	45.9	Very low	117 Å²	117	162.7 Å²	162.7	76%	0.76	82%	0.818	S	S	*	*				-116.2	176.5	-114.1	34.8	-13.8	0	0	0	115.2
56	K	39.3	Very low	44.9	Very low	213 Å²	213	165.7 Å²	165.7	93%	0.926	82%	0.82	S	S	*	*			trans	-47.9	138.4	178.2	-78.2	178.5	171.6	-179.6	0	114.6
57	K	52.1	Low	44.7	Very low	204 Å²	204	164.3 Å²	164.3	89%	0.887	81%	0.808	S	S	*	*			trans	-144.6	157.3	158.8	-113.6	-173.4	176.4	178.2	0	108.8
58	P	42.8	Very low	44	Very low	104 Å²	104	163.6 Å²	163.6	68%	0.675	81%	0.81	S	S	*	*				-107.1	153.6	-118.1	24.4	-6.4	0	0	0	114.6
59	T	33.9	Very low	43.9	Very low	123 Å²	123	159.5 Å²	159.5	76%	0.755	79%	0.789	S	S	*	*			trans	32.1	102.8	139.7	-38.2	0	0	0	0	117.9	E61	T59-E61 HydrophobicContact CG2-CG 4.16Å
60	Y	48.4	Very low	43.9	Very low	212 Å²	212	155.4 Å²	155.4	83%	0.831	78%	0.783	S	S	*	*			trans	-98.1	123.6	139.2	44.4	-86.6	0	0	0	106.3	D62	Y60-D62 PolarHBondContact O-N 3.13Å
61	E	37.6	Very low	44.3	Very low	189 Å²	189	146.4 Å²	146.4	88%	0.883	75%	0.751	S	S	*	*			trans	-67.1	112.4	169.2	-63.8	169.3	164.6	0	0	107.1	T59	T59-E61 HydrophobicContact CG2-CG 4.16Å
62	D	41.3	Very low	45.1	Very low	146 Å²	146	137 Å²	137	78%	0.781	71%	0.713	S	S	*	*			trans	-140	127.5	159.2	-165	24.5	0	0	0	105.9	Y60	Y60-D62 PolarHBondContact O-N 3.13Å
63	D	39.1	Very low	45.6	Very low	151 Å²	151	132.3 Å²	132.3	81%	0.807	69%	0.691	S	S	*	*			trans	-45.1	135.3	-150.2	-86.1	-53	0	0	0	116.7	D65	D63-D65 PolarHBondContact O-N 3.43Å
64	D	33.3	Very low	46.6	Very low	140 Å²	140	126.3 Å²	126.3	75%	0.749	67%	0.667	S	S	*	*			trans	-50.1	98.7	160.4	-85.1	-45.4	0	0	0	111.3
65	D	39.7	Very low	46.5	Very low	153 Å²	153	124.6 Å²	124.6	82%	0.818	65%	0.651	S	S	*	*			trans	-103.4	64.7	146.3	-86.1	-37	0	0	0	107.9	D63 D67	D63-D65 PolarHBondContact O-N 3.43Å; D65-D67 PolarHBondContact O-N 3.21Å
66	E	35.7	Very low	47.3	Very low	175 Å²	175	125.9 Å²	125.9	82%	0.818	65%	0.647	S	S	*	*			trans	-72.2	51.2	166.9	-152.7	179.3	-140	0	0	110.2	G68	E66-G68 VanDerWaalsContact C-N 3.28Å; E66-G68 PolarHBondContact O-N 3.12Å
67	D	45.4	Very low	48	Very low	103 Å²	103	120 Å²	120	55%	0.551	62%	0.623	S	S	*	*			trans	-96.9	60.8	174	-121.4	8.7	0	0	0	108.7	D65 D69 R98	D65-D67 PolarHBondContact O-N 3.21Å; D67-D69 PolarHBondContact O-N 2.89Å; D67-R98 IonicContact OD2-NH1 3.11Å
68	G	38.4	Very low	48.1	Very low	81 Å²	81	113.8 Å²	113.8	84%	0.835	60%	0.601	S	S	*	*			trans	-71.3	43.6	170.7	0	0	0	0	0	113	E66 D70	E66-G68 VanDerWaalsContact C-N 3.28Å; E66-G68 PolarHBondContact O-N 3.12Å; G68-D70 PolarHBondContact O-N 3.31Å
69	D	49.1	Very low	48.5	Very low	64 Å²	64	110.8 Å²	110.8	34%	0.342	59%	0.59	S	S	.	*			trans	-91.1	95.7	176.6	-139	-0.4	0	0	0	108.3	D67 D71 K95	D67-D69 PolarHBondContact O-N 2.89Å; D69-D71 HydrophobicContact CB-CB 4.23Å; D69-D71 PolarHBondContact O-N 2.82Å; D69-K95 WeakPolarHBondContact OD2-CD 3.22Å; D69-K95 IonicContact OD2-NZ 3.77Å; D69-K95 PolarHBondContact OD2-NZ 3.29Å
70	D	53	Low	49.2	Very low	127 Å²	127	110.8 Å²	110.8	68%	0.679	59%	0.585	S	S	*	*			trans	-71.4	41	169.6	-158.8	19.6	0	0	0	110.9	G68 A72	G68-D70 PolarHBondContact O-N 3.31Å; D70-A72 VanDerWaalsContact C-N 3.3Å; D70-A72 PolarHBondContact O-N 3.09Å
71	D	59.5	Low	49.3	Very low	26 Å²	26	104.4 Å²	104.4	14%	0.139	58%	0.576	C	S	.	*			trans	-93.9	18	-163.2	-159	46.4	0	0	0	113.6	D69 E73 N93 K95 R180	D69-D71 HydrophobicContact CB-CB 4.23Å; D69-D71 PolarHBondContact O-N 2.82Å; D71-E73 PolarHBondContact O-N 3.48Å; D71-N93 VanDerWaalsContact O-O 3.1Å; D71-K95 WeakPolarHBondContact OD2-CB 3.2Å; D71-K95 PolarHBondContact OD2-N 2.97Å; D71-R180 IonicContact OD1-CZ 2.78Å; D71-R180 IonicContact OD1-NE 3.14Å; D71-R180 PolarHBondContact OD1-NE 3.3Å; D71-R180 IonicContact OD1-NH2 2.77Å; D71-R180 PolarHBondContact OD1-NH2 3.26Å; D71-R180 IonicContact OD2-NE 3.89Å; D71-R180 PolarHBondContact OD2-NE 3.44Å
72	A	61.7	Low	50.2	Low	17 Å²	17	100.8 Å²	100.8	14%	0.14	56%	0.563	C	S	.	*			trans	-96	82.8	174.7	0	0	0	0	0	108.4	D70 V94 A101 I105	D70-A72 VanDerWaalsContact C-N 3.3Å; D70-A72 PolarHBondContact O-N 3.09Å; A72-V94 HydrophobicContact CB-CG1 3.96Å; A72-A101 HydrophobicContact CB-CB 4.27Å; A72-I105 HydrophobicContact CB-CD1 3.73Å
73	E	62.2	Low	51.3	Low	89 Å²	89	97.2 Å²	97.2	42%	0.416	54%	0.541	S	S	.	.	B	Isolated β-bridge	trans	-82.6	118.5	171.1	-75	172.5	-150.4	0	0	108.3	D71 E75 N93 R180	D71-E73 PolarHBondContact O-N 3.48Å; E73-E75 PolarHBondContact O-N 2.79Å; E73-N93 PolarHBondContact N-O 2.8Å; E73-N93 PolarHBondContact O-N 2.87Å; E73-N93 VanDerWaalsContact O-N 3.14Å; E73-R180 IonicContact OE1-CZ 3.81Å; E73-R180 IonicContact OE1-NH1 2.7Å; E73-R180 PolarHBondContact OE1-NH1 2.95Å; E73-R180 VanDerWaalsContact OE1-NH1 3.14Å; E73-R180 IonicContact OE1-NH2 3.2Å; E73-R180 PolarHBondContact OE1-NH2 3.23Å; E73-R180 IonicContact OE2-CZ 3.95Å; E73-R180 IonicContact OE2-NH1 3.88Å; E73-R180 PolarHBondContact OE2-NH1 3.22Å; E73-R180 IonicContact OE2-NH2 3.65Å
74	M	63.7	Low	52.9	Low	86 Å²	86	95.7 Å²	95.7	42%	0.424	55%	0.55	S	S	.	*			trans	-78.3	100.9	170.6	-177.9	-177.9	173.4	0	0	107.7	E77 I105	M74-E77 HydrophobicContact CE-CB 3.76Å; M74-I105 HydrophobicContact CB-CD1 4.21Å; M74-I105 HydrophobicContact CB-CG1 4.43Å; M74-I105 HydrophobicContact CB-CG2 4.27Å; M74-I105 HydrophobicContact CG-CG2 3.95Å; M74-I105 HydrophobicContact SD-CG2 4.31Å
75	E	57.6	Low	55.3	Low	97 Å²	97	92.5 Å²	92.5	45%	0.453	53%	0.533	S	S	.	.			trans	-91.8	117.1	166.8	-76.1	178.3	-149.6	0	0	108.5	E73 C91 N93	E73-E75 PolarHBondContact O-N 2.79Å; E75-C91 WeakPolarHBondContact O-CB 3.25Å; E75-N93 PolarHBondContact OE1-ND2 2.83Å; E75-N93 PolarHBondContact OE2-ND2 2.66Å
76	E	59.2	Low	57.5	Low	144 Å²	144	87.3 Å²	87.3	67%	0.673	52%	0.515	S	S	*	.			trans	65.7	98.1	164.8	-140	172.9	-167.9	0	0	115.7	V78	E76-V78 HydrophobicContact CB-CG2 4.15Å; E76-V78 HydrophobicContact CG-CG2 3.88Å; E76-V78 PolarHBondContact O-N 3.38Å
77	E	55.2	Low	60.1	Low	89 Å²	89	79 Å²	79	42%	0.416	48%	0.476	S	S	.	.			trans	-66.3	91.9	146.3	-179	163.4	-170.8	0	0	106.5	M74 G79 R90	M74-E77 HydrophobicContact CE-CB 3.76Å; E77-G79 PolarHBondContact O-N 2.88Å; E77-R90 IonicContact OE1-CZ 3.14Å; E77-R90 VanDerWaalsContact OE1-CZ 3.22Å; E77-R90 IonicContact OE1-NH1 3.63Å; E77-R90 PolarHBondContact OE1-NH1 2.85Å; E77-R90 IonicContact OE1-NH2 3.57Å; E77-R90 PolarHBondContact OE1-NH2 3.33Å; E77-R90 IonicContact OE2-CZ 2.69Å; E77-R90 IonicContact OE2-NH1 2.72Å; E77-R90 PolarHBondContact OE2-NH1 2.84Å; E77-R90 IonicContact OE2-NH2 2.67Å
78	V	54.4	Low	62.3	Low	73 Å²	73	75.3 Å²	75.3	44%	0.442	46%	0.458	S	S	.	.			trans	-66.4	92.1	169.2	-174.7	0	0	0	0	105.2	E76	E76-V78 HydrophobicContact CB-CG2 4.15Å; E76-V78 HydrophobicContact CG-CG2 3.88Å; E76-V78 PolarHBondContact O-N 3.38Å
79	G	49.2	Very low	64.8	Low	42 Å²	42	72.6 Å²	72.6	43%	0.433	43%	0.425	S	S	.	.			trans	-57.7	146.3	-155.3	0	0	0	0	0	114.2	E77 A81	E77-G79 PolarHBondContact O-N 2.88Å; G79-A81 PolarHBondContact O-N 2.84Å
80	D	49.4	Very low	66.7	Low	123 Å²	123	71.4 Å²	71.4	66%	0.658	42%	0.416	S	S	*	.			trans	29.1	21.2	145	-62.6	-30.4	0	0	0	119.7	D82	D80-D82 PolarHBondContact O-N 2.92Å
81	A	51.2	Low	68.5	Low	78 Å²	78	65.9 Å²	65.9	65%	0.645	39%	0.387	S	S	*	.			trans	-78.7	79.3	156.9	0	0	0	0	0	103.8	G79 E83	G79-A81 PolarHBondContact O-N 2.84Å; A81-E83 VanDerWaalsContact C-N 3.28Å; A81-E83 PolarHBondContact O-N 3.28Å
82	D	55.6	Low	69.9	Low	112 Å²	112	64.6 Å²	64.6	60%	0.599	38%	0.38	S	S	*	.			trans	-43.6	106.7	160.3	-78.3	-40.5	0	0	0	105.4	D80	D80-D82 PolarHBondContact O-N 2.92Å
83	E	65.7	Low	71.2	Confident	71 Å²	71	64 Å²	64	33%	0.332	37%	0.374	S	S	.	.			trans	-58.6	154.1	168.2	-64.2	-177.1	-157.9	0	0	106	A81 D85 G86 S87 T89 R186	A81-E83 VanDerWaalsContact C-N 3.28Å; A81-E83 PolarHBondContact O-N 3.28Å; E83-D85 WeakPolarHBondContact CB-OD1 3.47Å; E83-D85 PolarHBondContact O-N 2.9Å; E83-G86 PolarHBondContact O-N 2.91Å; E83-S87 PolarHBondContact N-O 3.3Å; E83-T89 PolarHBondContact OE1-OG1 3.41Å; E83-R186 IonicContact OE1-NE 3.29Å; E83-R186 IonicContact OE2-CZ 3.16Å; E83-R186 IonicContact OE2-NE 3.78Å; E83-R186 PolarHBondContact OE2-NE 2.65Å; E83-R186 IonicContact OE2-NH2 2.72Å; E83-R186 PolarHBondContact OE2-NH2 3.32Å
84	A	72.1	Confident	72.3	Confident	120 Å²	120	59.9 Å²	59.9	99%	0.992	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-11.2	-168.9	0	0	0	0	0	115
85	D	83.2	Confident	73.3	Confident	73 Å²	73	61.1 Å²	61.1	39%	0.39	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	5.9	175.8	69.9	-13.2	0	0	0	115.6	E83 S87 R186 W188	E83-D85 WeakPolarHBondContact CB-OD1 3.47Å; E83-D85 PolarHBondContact O-N 2.9Å; D85-S87 WeakPolarHBondContact OD1-CB 3.22Å; D85-S87 PolarHBondContact OD1-N 3.2Å; D85-S87 VanDerWaalsContact OD1-N 3.16Å; D85-S87 PolarHBondContact OD1-OG 2.71Å; D85-R186 IonicContact OD1-NH2 2.66Å; D85-R186 PolarHBondContact OD1-NH2 3.35Å; D85-R186 VanDerWaalsContact OD1-NH2 3.14Å; D85-R186 IonicContact OD2-CZ 3.6Å; D85-R186 IonicContact OD2-NH1 3.13Å; D85-R186 IonicContact OD2-NH2 2.83Å; D85-R186 PolarHBondContact OD2-NH2 3.26Å; D85-W188 WeakPolarHBondContact OD2-CZ2 3.27Å; D85-W188 PolarHBondContact OD2-NE1 3.41Å
86	G	86.2	Confident	74.4	Confident	43 Å²	43	64.2 Å²	64.2	44%	0.443	37%	0.366	S	S	.	.	S	Bend	trans	75.3	21.2	-179.4	0	0	0	0	0	114.4	E83	E83-G86 PolarHBondContact O-N 2.91Å
87	S	90.7	Very high	75.5	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.338	C	S	.	.			trans	-89.7	147.4	172.6	65.3	0	0	0	0	112.5	E83 D85 R186 R187	E83-S87 PolarHBondContact N-O 3.3Å; D85-S87 WeakPolarHBondContact OD1-CB 3.22Å; D85-S87 PolarHBondContact OD1-N 3.2Å; D85-S87 VanDerWaalsContact OD1-N 3.16Å; D85-S87 PolarHBondContact OD1-OG 2.71Å; S87-R186 PolarHBondContact OG-NE 2.89Å; S87-R186 PolarHBondContact OG-NH2 2.77Å; S87-R186 VanDerWaalsContact OG-NH2 3.08Å; S87-R187 CarbonylContact C-O 3.52Å; S87-R187 VanDerWaalsContact CA-O 3.25Å; S87-R187 WeakPolarHBondContact CA-O 3.49Å
88	V	91	Very high	76.9	Confident	26 Å²	26	57.1 Å²	57.1	16%	0.158	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129	175.1	179	0	0	0	0	109.1	R187	V88-R187 PolarHBondContact N-O 3.14Å; V88-R187 WeakPolarHBondContact O-CB 2.99Å; V88-R187 PolarHBondContact O-N 2.78Å
89	T	90.8	Very high	78.5	Confident	24 Å²	24	53.7 Å²	53.7	15%	0.147	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	134.4	175.4	-75.2	0	0	0	0	111.1	E83 R184 F185	E83-T89 PolarHBondContact OE1-OG1 3.41Å; T89-R184 HydrophobicContact CG2-CG 3.81Å; T89-F185 CarbonylContact C-O 3.49Å; T89-F185 VanDerWaalsContact CA-O 3.31Å; T89-F185 WeakPolarHBondContact CA-O 3.42Å
90	R	90.2	Very high	80.3	Confident	39 Å²	39	51.9 Å²	51.9	15%	0.147	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	146.6	177.8	-65.1	-69.1	179.6	162.6	-9.2	110.1	E77 R184 F185	E77-R90 IonicContact OE1-CZ 3.14Å; E77-R90 VanDerWaalsContact OE1-CZ 3.22Å; E77-R90 IonicContact OE1-NH1 3.63Å; E77-R90 PolarHBondContact OE1-NH1 2.85Å; E77-R90 IonicContact OE1-NH2 3.57Å; E77-R90 PolarHBondContact OE1-NH2 3.33Å; E77-R90 IonicContact OE2-CZ 2.69Å; E77-R90 IonicContact OE2-NH1 2.72Å; E77-R90 PolarHBondContact OE2-NH1 2.84Å; E77-R90 IonicContact OE2-NH2 2.67Å; R90-R184 CarbonylContact O-C 3.55Å; R90-R184 WeakPolarHBondContact O-CA 3.2Å; R90-F185 PolarHBondContact N-O 3.37Å; R90-F185 PolarHBondContact O-N 3.4Å
91	C	89.5	Confident	82.2	Confident	11 Å²	11	46.2 Å²	46.2	7%	0.074	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.7	175.4	-159.4	0	0	0	0	110.2	E75 S182 V183	E75-C91 WeakPolarHBondContact O-CB 3.25Å; C91-S182 PolarHBondContact SG-OG 3.3Å; C91-V183 WeakPolarHBondContact CA-O 3.31Å
92	V	88.4	Confident	84	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	137.7	174.3	67.1	0	0	0	0	110.1	V94 I102 I105 S182 V183 F185	V92-V94 HydrophobicContact CG1-CG2 4.45Å; V92-V94 HydrophobicContact CG2-CG1 3.76Å; V92-I102 HydrophobicContact CG1-CD1 3.87Å; V92-I105 HydrophobicContact CB-CB 4.43Å; V92-I105 HydrophobicContact CB-CD1 4.14Å; V92-I105 HydrophobicContact CB-CG2 4.06Å; V92-I105 HydrophobicContact CG2-CB 4.34Å; V92-I105 HydrophobicContact CG2-CD1 3.28Å; V92-I105 HydrophobicContact CG2-CG1 4.36Å; V92-I105 HydrophobicContact CG2-CG2 4.37Å; V92-S182 CarbonylContact O-C 3.54Å; V92-S182 VanDerWaalsContact O-CA 3.3Å; V92-S182 WeakPolarHBondContact O-CA 3.21Å; V92-V183 HydrophobicContact CG1-CB 3.87Å; V92-V183 HydrophobicContact CG1-CG2 4.45Å; V92-V183 PolarHBondContact N-O 2.87Å; V92-V183 PolarHBondContact O-N 3.39Å; V92-F185 HydrophobicContact CB-CE2 4.46Å; V92-F185 HydrophobicContact CG1-CE2 3.51Å; V92-F185 HydrophobicContact CG1-CZ 4.13Å
93	N	89.1	Confident	85.7	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.6	169	-66.6	-2.6	0	0	0	108.6	D71 E73 E75 S182	D71-N93 VanDerWaalsContact O-O 3.1Å; E73-N93 PolarHBondContact N-O 2.8Å; E73-N93 PolarHBondContact O-N 2.87Å; E73-N93 VanDerWaalsContact O-N 3.14Å; E75-N93 PolarHBondContact OE1-ND2 2.83Å; E75-N93 PolarHBondContact OE2-ND2 2.66Å; N93-S182 VanDerWaalsContact OD1-CB 3.27Å; N93-S182 WeakPolarHBondContact OD1-CB 3.36Å; N93-S182 PolarHBondContact OD1-OG 2.7Å
94	V	86.7	Confident	86.9	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.024	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	140.1	-178.5	-82.6	0	0	0	0	109.9	A72 V92 R96 P97 A101 V181	A72-V94 HydrophobicContact CB-CG1 3.96Å; V92-V94 HydrophobicContact CG1-CG2 4.45Å; V92-V94 HydrophobicContact CG2-CG1 3.76Å; V94-R96 VanDerWaalsContact C-N 3.31Å; V94-P97 HydrophobicContact CG2-CB 4.1Å; V94-P97 HydrophobicContact CG2-CG 4.25Å; V94-A101 HydrophobicContact CG1-CB 4.12Å; V94-V181 PolarHBondContact N-O 2.93Å; V94-V181 PolarHBondContact O-N 2.64Å; V94-V181 VanDerWaalsContact O-O 3.12Å
95	K	84.3	Confident	87.7	Confident	112 Å²	112	32.2 Å²	32.2	49%	0.487	16%	0.157	S	C	.	.	S	Bend	trans	-63.5	-36.3	169	174.2	-176.9	178.7	-171.8	0	113.3	D69 D71 R180	D69-K95 WeakPolarHBondContact OD2-CD 3.22Å; D69-K95 IonicContact OD2-NZ 3.77Å; D69-K95 PolarHBondContact OD2-NZ 3.29Å; D71-K95 WeakPolarHBondContact OD2-CB 3.2Å; D71-K95 PolarHBondContact OD2-N 2.97Å; K95-R180 HydrophobicContact CB-CG 4.47Å
96	R	81.3	Confident	87.9	Confident	162 Å²	162	28.8 Å²	28.8	61%	0.611	14%	0.139	S	C	*	.	S	Bend	trans	-138	128.1	170.2	-69.1	-172.7	179.5	-111.9	-0.4	110.1	V94 R98 E136	V94-R96 VanDerWaalsContact C-N 3.31Å; R96-R98 VanDerWaalsContact C-N 3.33Å; R96-R98 PolarHBondContact O-N 2.59Å; R96-E136 IonicContact NH1-OE1 2.65Å; R96-E136 PolarHBondContact NH1-OE1 2.9Å
97	P	81.5	Confident	88.1	Confident	12 Å²	12	27.1 Å²	27.1	8%	0.078	12%	0.12	C	C	.	.			trans	-72.8	86.6	177	-2.9	15.2	0	0	0	111.4	V94 I102 F137 I138 V142 V183	V94-P97 HydrophobicContact CG2-CB 4.1Å; V94-P97 HydrophobicContact CG2-CG 4.25Å; P97-I102 HydrophobicContact CB-CD1 4.21Å; P97-F137 WeakPolarHBondContact O-CB 3.4Å; P97-I138 HydrophobicContact CB-CD1 3.8Å; P97-I138 VanDerWaalsContact CD-CD1 3.49Å; P97-I138 HydrophobicContact CG-CD1 3.61Å; P97-I138 WeakPolarHBondContact O-CD1 3.42Å; P97-V142 HydrophobicContact CB-CG2 3.55Å; P97-V142 HydrophobicContact CG-CB 4.47Å; P97-V142 HydrophobicContact CG-CG2 3.63Å; P97-V183 HydrophobicContact CB-CG2 4.47Å; P97-V183 HydrophobicContact CG-CG2 4.37Å
98	R	85	Confident	88.1	Confident	71 Å²	71	33.6 Å²	33.6	27%	0.268	16%	0.155	S	C	.	.	B	Isolated β-bridge	trans	-83.2	145.1	171.3	-60.8	169.1	50.5	153	-0.3	110.2	D67 R96 D100 A101 I102	D67-R98 IonicContact OD2-NH1 3.11Å; R96-R98 VanDerWaalsContact C-N 3.33Å; R96-R98 PolarHBondContact O-N 2.59Å; R98-D100 VanDerWaalsContact C-N 3.29Å; R98-D100 WeakPolarHBondContact CB-OD1 3.43Å; R98-D100 IonicContact CZ-OD1 3.18Å; R98-D100 IonicContact NE-OD1 2.89Å; R98-D100 PolarHBondContact NE-OD1 2.95Å; R98-D100 IonicContact NE-OD2 3.46Å; R98-D100 IonicContact NH2-OD1 3.85Å; R98-D100 IonicContact NH2-OD2 2.98Å; R98-D100 PolarHBondContact O-N 3.45Å; R98-A101 HydrophobicContact CB-CB 4.48Å; R98-A101 PolarHBondContact O-N 3.11Å; R98-A101 VanDerWaalsContact O-N 3.12Å; R98-I102 WeakPolarHBondContact O-CG1 3.44Å; R98-I102 PolarHBondContact O-N 3.42Å
99	L	87.8	Confident	88.1	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-41.9	-177.2	174.1	61.7	0	0	0	112.2	A101 I102 L103 V118 V123 V125 A130 F137 V148	L99-A101 VanDerWaalsContact C-N 3.35Å; L99-A101 PolarHBondContact O-N 3.28Å; L99-I102 PolarHBondContact O-N 3.27Å; L99-L103 HydrophobicContact CD1-CD1 3.93Å; L99-L103 HydrophobicContact CD1-CD2 4.38Å; L99-L103 HydrophobicContact CD1-CG 3.92Å; L99-L103 HydrophobicContact CG-CD1 3.88Å; L99-L103 HydrophobicContact CG-CG 4.3Å; L99-L103 WeakPolarHBondContact O-CB 3.27Å; L99-L103 VanDerWaalsContact O-CG 3.24Å; L99-L103 WeakPolarHBondContact O-CG 3.26Å; L99-L103 PolarHBondContact O-N 2.87Å; L99-V118 HydrophobicContact CD2-CG1 4.32Å; L99-V118 HydrophobicContact CD2-CG2 3.72Å; L99-V118 HydrophobicContact CG-CG2 4.3Å; L99-V123 HydrophobicContact CD1-CG1 4.12Å; L99-V123 HydrophobicContact CD2-CG1 4.25Å; L99-V125 HydrophobicContact CD1-CG2 4.31Å; L99-A130 HydrophobicContact CD2-CB 3.77Å; L99-F137 HydrophobicContact CB-CB 4.19Å; L99-F137 HydrophobicContact CB-CD2 4.14Å; L99-F137 HydrophobicContact CD1-CD2 3.46Å; L99-F137 VanDerWaalsContact CD1-CD2 3.46Å; L99-F137 HydrophobicContact CD1-CE2 3.89Å; L99-F137 HydrophobicContact CG-CD2 4.31Å; L99-V148 HydrophobicContact CD1-CG1 4.02Å
100	D	87.5	Confident	88.1	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-38.9	178.6	61	-53	0	0	0	112.8	R98 L103 K104 R111	R98-D100 VanDerWaalsContact C-N 3.29Å; R98-D100 WeakPolarHBondContact CB-OD1 3.43Å; R98-D100 IonicContact CZ-OD1 3.18Å; R98-D100 IonicContact NE-OD1 2.89Å; R98-D100 PolarHBondContact NE-OD1 2.95Å; R98-D100 IonicContact NE-OD2 3.46Å; R98-D100 IonicContact NH2-OD1 3.85Å; R98-D100 IonicContact NH2-OD2 2.98Å; R98-D100 PolarHBondContact O-N 3.45Å; D100-L103 PolarHBondContact O-N 2.67Å; D100-K104 WeakPolarHBondContact O-CB 3.47Å; D100-K104 PolarHBondContact O-N 3.43Å; D100-R111 HydrophobicContact CB-CG 4.45Å; D100-R111 IonicContact OD2-CZ 3.77Å; D100-R111 IonicContact OD2-NE 3.04Å; D100-R111 PolarHBondContact OD2-NE 3.2Å; D100-R111 IonicContact OD2-NH2 3.39Å; D100-R111 PolarHBondContact OD2-NH2 3.33Å
101	A	87.5	Confident	88	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.033	18%	0.179	C	C	.	.	H	α-helix	trans	-67.4	-41.8	175.4	0	0	0	0	0	111.6	A72 V94 R98 L99 K104 I105	A72-A101 HydrophobicContact CB-CB 4.27Å; V94-A101 HydrophobicContact CG1-CB 4.12Å; R98-A101 HydrophobicContact CB-CB 4.48Å; R98-A101 PolarHBondContact O-N 3.11Å; R98-A101 VanDerWaalsContact O-N 3.12Å; L99-A101 VanDerWaalsContact C-N 3.35Å; L99-A101 PolarHBondContact O-N 3.28Å; A101-K104 PolarHBondContact O-N 2.98Å; A101-I105 PolarHBondContact O-N 2.81Å
102	I	89.7	Confident	88.1	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-44.3	175.7	-60	-38.6	0	0	0	110.9	V92 P97 R98 L99 K104 G106 V148 L167 F185	V92-I102 HydrophobicContact CG1-CD1 3.87Å; P97-I102 HydrophobicContact CB-CD1 4.21Å; R98-I102 WeakPolarHBondContact O-CG1 3.44Å; R98-I102 PolarHBondContact O-N 3.42Å; L99-I102 PolarHBondContact O-N 3.27Å; I102-K104 PolarHBondContact O-N 2.87Å; I102-G106 VanDerWaalsContact O-CA 3.31Å; I102-G106 WeakPolarHBondContact O-CA 3.42Å; I102-G106 PolarHBondContact O-N 2.77Å; I102-V148 HydrophobicContact CG2-CG2 4.5Å; I102-L167 HydrophobicContact CG2-CD1 3.94Å; I102-F185 HydrophobicContact CB-CZ 4.43Å; I102-F185 HydrophobicContact CD1-CE2 4.23Å; I102-F185 HydrophobicContact CD1-CZ 3.6Å; I102-F185 HydrophobicContact CG1-CZ 4.11Å; I102-F185 HydrophobicContact CG2-CE1 3.7Å; I102-F185 HydrophobicContact CG2-CE2 4.36Å; I102-F185 HydrophobicContact CG2-CZ 3.62Å
103	L	91.4	Very high	88.3	Confident	1 Å²	1	44 Å²	44	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-41.1	177.5	-68.8	172	0	0	0	111.5	L99 D100 I105 C107 N108 V109 A114 V118 V123 V148 I150	L99-L103 HydrophobicContact CD1-CD1 3.93Å; L99-L103 HydrophobicContact CD1-CD2 4.38Å; L99-L103 HydrophobicContact CD1-CG 3.92Å; L99-L103 HydrophobicContact CG-CD1 3.88Å; L99-L103 HydrophobicContact CG-CG 4.3Å; L99-L103 WeakPolarHBondContact O-CB 3.27Å; L99-L103 VanDerWaalsContact O-CG 3.24Å; L99-L103 WeakPolarHBondContact O-CG 3.26Å; L99-L103 PolarHBondContact O-N 2.87Å; D100-L103 PolarHBondContact O-N 2.67Å; L103-I105 PolarHBondContact O-N 2.81Å; L103-C107 WeakPolarHBondContact O-CA 3.48Å; L103-C107 VanDerWaalsContact O-CB 3.27Å; L103-C107 WeakPolarHBondContact O-CB 3.28Å; L103-C107 PolarHBondContact O-N 3.31Å; L103-N108 PolarHBondContact O-N 2.93Å; L103-V109 HydrophobicContact CB-CG2 3.92Å; L103-V109 VanDerWaalsContact O-CG2 3.31Å; L103-V109 WeakPolarHBondContact O-CG2 3.4Å; L103-A114 HydrophobicContact CB-CB 3.84Å; L103-A114 HydrophobicContact CD1-CB 3.94Å; L103-V118 HydrophobicContact CD1-CG2 3.74Å; L103-V123 HydrophobicContact CD1-CG2 4.28Å; L103-V148 HydrophobicContact CD2-CG1 4.05Å; L103-I150 HydrophobicContact CD2-CD1 3.82Å; L103-I150 HydrophobicContact CD2-CG1 3.97Å
104	K	90.3	Very high	88.4	Confident	70 Å²	70	43.8 Å²	43.8	30%	0.304	22%	0.215	S	C	.	.	H	α-helix	trans	-55	-53.9	178.5	180	-172.9	175.3	-169.7	0	111.5	D100 A101 I102 N108 V109	D100-K104 WeakPolarHBondContact O-CB 3.47Å; D100-K104 PolarHBondContact O-N 3.43Å; A101-K104 PolarHBondContact O-N 2.98Å; I102-K104 PolarHBondContact O-N 2.87Å; K104-N108 WeakPolarHBondContact O-CA 3.45Å; K104-N108 PolarHBondContact O-N 2.81Å; K104-N108 VanDerWaalsContact O-N 3.15Å; K104-V109 VanDerWaalsContact CA-O 3.27Å; K104-V109 WeakPolarHBondContact CA-O 3.36Å; K104-V109 PolarHBondContact O-N 2.86Å
105	I	88.6	Confident	88.6	Confident	14 Å²	14	44.6 Å²	44.6	7%	0.072	22%	0.219	C	C	.	.	H	α-helix	trans	-85.7	-43.1	-172.7	-67.1	170.4	0	0	0	111.3	A72 M74 V92 A101 L103	A72-I105 HydrophobicContact CB-CD1 3.73Å; M74-I105 HydrophobicContact CB-CD1 4.21Å; M74-I105 HydrophobicContact CB-CG1 4.43Å; M74-I105 HydrophobicContact CB-CG2 4.27Å; M74-I105 HydrophobicContact CG-CG2 3.95Å; M74-I105 HydrophobicContact SD-CG2 4.31Å; V92-I105 HydrophobicContact CB-CB 4.43Å; V92-I105 HydrophobicContact CB-CD1 4.14Å; V92-I105 HydrophobicContact CB-CG2 4.06Å; V92-I105 HydrophobicContact CG2-CB 4.34Å; V92-I105 HydrophobicContact CG2-CD1 3.28Å; V92-I105 HydrophobicContact CG2-CG1 4.36Å; V92-I105 HydrophobicContact CG2-CG2 4.37Å; A101-I105 PolarHBondContact O-N 2.81Å; L103-I105 PolarHBondContact O-N 2.81Å
106	G	89	Confident	89	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-70.3	-43.8	-179.1	0	0	0	0	0	113	I102 R187	I102-G106 VanDerWaalsContact O-CA 3.31Å; I102-G106 WeakPolarHBondContact O-CA 3.42Å; I102-G106 PolarHBondContact O-N 2.77Å; G106-R187 WeakPolarHBondContact O-CD 3.21Å; G106-R187 PolarHBondContact O-NE 2.84Å; G106-R187 PolarHBondContact O-NH1 2.95Å
107	C	90	Very high	89.5	Confident	8 Å²	8	39.2 Å²	39.2	5%	0.054	20%	0.203	C	C	.	.	H	α-helix	trans	-100.5	-5.3	-176.7	-61.8	0	0	0	0	114.1	L103 V109 I150 L167 R187	L103-C107 WeakPolarHBondContact O-CA 3.48Å; L103-C107 VanDerWaalsContact O-CB 3.27Å; L103-C107 WeakPolarHBondContact O-CB 3.28Å; L103-C107 PolarHBondContact O-N 3.31Å; C107-V109 VanDerWaalsContact C-N 3.33Å; C107-V109 HydrophobicContact CB-CG1 4.41Å; C107-V109 HydrophobicContact CB-CG2 4.36Å; C107-I150 HydrophobicContact CB-CD1 3.74Å; C107-I150 VanDerWaalsContact SG-CD1 3.51Å; C107-L167 VanDerWaalsContact SG-CD1 3.59Å; C107-R187 PolarHBondContact O-NH1 2.91Å; C107-R187 PolarHBondContact O-NH2 3.19Å
108	N	89.6	Confident	90	Very high	137 Å²	137	38.8 Å²	38.8	73%	0.733	20%	0.201	S	C	*	.			trans	56.7	44.4	-175.8	-164.4	30.7	0	0	0	112.5	L103 K104	L103-N108 PolarHBondContact O-N 2.93Å; K104-N108 WeakPolarHBondContact O-CA 3.45Å; K104-N108 PolarHBondContact O-N 2.81Å; K104-N108 VanDerWaalsContact O-N 3.15Å
109	V	90.9	Very high	90.2	Very high	31 Å²	31	39.3 Å²	39.3	19%	0.188	21%	0.214	C	C	.	.			trans	-105.8	151.5	172.7	-67.1	0	0	0	0	109.9	L103 K104 C107 A113 A114 I117	L103-V109 HydrophobicContact CB-CG2 3.92Å; L103-V109 VanDerWaalsContact O-CG2 3.31Å; L103-V109 WeakPolarHBondContact O-CG2 3.4Å; K104-V109 VanDerWaalsContact CA-O 3.27Å; K104-V109 WeakPolarHBondContact CA-O 3.36Å; K104-V109 PolarHBondContact O-N 2.86Å; C107-V109 VanDerWaalsContact C-N 3.33Å; C107-V109 HydrophobicContact CB-CG1 4.41Å; C107-V109 HydrophobicContact CB-CG2 4.36Å; V109-A113 HydrophobicContact CB-CB 4.35Å; V109-A114 HydrophobicContact CG2-CB 3.92Å; V109-I117 HydrophobicContact CG1-CD1 4.26Å
110	S	91.8	Very high	90.4	Very high	71 Å²	71	42.2 Å²	42.2	50%	0.497	23%	0.234	S	C	.	.			trans	-67.2	156.7	171.4	71.5	0	0	0	0	110.1	N112 A113 A114	S110-N112 VanDerWaalsContact C-N 3.25Å; S110-N112 PolarHBondContact O-N 2.8Å; S110-A113 PolarHBondContact O-N 2.72Å; S110-A113 VanDerWaalsContact O-N 3.09Å; S110-A113 VanDerWaalsContact OG-CB 3.29Å; S110-A113 WeakPolarHBondContact OG-CB 3.44Å; S110-A113 PolarHBondContact OG-N 3.49Å; S110-A113 VanDerWaalsContact OG-N 3.14Å; S110-A114 PolarHBondContact O-N 3.35Å
111	R	87.7	Confident	90.5	Very high	69 Å²	69	42.7 Å²	42.7	26%	0.26	24%	0.24	S	C	.	.	H	α-helix	trans	-57.4	-40.9	178.1	-158.1	169.6	-160.6	161.4	5.1	111.7	D100 A114 D115	D100-R111 HydrophobicContact CB-CG 4.45Å; D100-R111 IonicContact OD2-CZ 3.77Å; D100-R111 IonicContact OD2-NE 3.04Å; D100-R111 PolarHBondContact OD2-NE 3.2Å; D100-R111 IonicContact OD2-NH2 3.39Å; D100-R111 PolarHBondContact OD2-NH2 3.33Å; R111-A114 WeakPolarHBondContact O-CB 3.34Å; R111-A114 PolarHBondContact O-N 2.72Å; R111-D115 PolarHBondContact O-N 3.47Å; R111-D115 VanDerWaalsContact O-N 3.09Å
112	N	91.7	Very high	90.7	Very high	120 Å²	120	48.1 Å²	48.1	64%	0.642	26%	0.26	S	S	*	.	H	α-helix	trans	-63.7	-43.2	175.3	-64.7	8.8	0	0	0	112.1	S110 A114 D115 E116	S110-N112 VanDerWaalsContact C-N 3.25Å; S110-N112 PolarHBondContact O-N 2.8Å; N112-A114 VanDerWaalsContact C-N 3.35Å; N112-D115 WeakPolarHBondContact O-CB 3.46Å; N112-D115 PolarHBondContact O-N 3.13Å; N112-E116 WeakPolarHBondContact O-CG 3.33Å; N112-E116 PolarHBondContact O-N 2.98Å
113	A	92.9	Very high	90.9	Very high	26 Å²	26	48.1 Å²	48.1	22%	0.215	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-37.6	177.1	0	0	0	0	0	111.6	V109 S110 D115 E116 I117	V109-A113 HydrophobicContact CB-CB 4.35Å; S110-A113 PolarHBondContact O-N 2.72Å; S110-A113 VanDerWaalsContact O-N 3.09Å; S110-A113 VanDerWaalsContact OG-CB 3.29Å; S110-A113 WeakPolarHBondContact OG-CB 3.44Å; S110-A113 PolarHBondContact OG-N 3.49Å; S110-A113 VanDerWaalsContact OG-N 3.14Å; A113-D115 VanDerWaalsContact C-N 3.32Å; A113-D115 PolarHBondContact O-N 3.29Å; A113-E116 PolarHBondContact O-N 3.49Å; A113-I117 WeakPolarHBondContact O-CD1 3.4Å; A113-I117 WeakPolarHBondContact O-CG1 3.27Å; A113-I117 PolarHBondContact O-N 3.47Å
114	A	91.8	Very high	90.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.3	-47.9	174.1	0	0	0	0	0	110.8	L103 V109 S110 R111 N112 E116 I117 V118	L103-A114 HydrophobicContact CB-CB 3.84Å; L103-A114 HydrophobicContact CD1-CB 3.94Å; V109-A114 HydrophobicContact CG2-CB 3.92Å; S110-A114 PolarHBondContact O-N 3.35Å; R111-A114 WeakPolarHBondContact O-CB 3.34Å; R111-A114 PolarHBondContact O-N 2.72Å; N112-A114 VanDerWaalsContact C-N 3.35Å; A114-E116 PolarHBondContact O-N 2.97Å; A114-I117 PolarHBondContact O-N 3.3Å; A114-V118 VanDerWaalsContact O-CG2 3.27Å; A114-V118 WeakPolarHBondContact O-CG2 3.43Å; A114-V118 PolarHBondContact O-N 3.35Å
115	D	89.6	Confident	91	Very high	20 Å²	20	46.4 Å²	46.4	11%	0.107	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-45.6	176.3	-79.8	-11.6	0	0	0	112.7	R111 N112 A113 I117 V118 C119 R133	R111-D115 PolarHBondContact O-N 3.47Å; R111-D115 VanDerWaalsContact O-N 3.09Å; N112-D115 WeakPolarHBondContact O-CB 3.46Å; N112-D115 PolarHBondContact O-N 3.13Å; A113-D115 VanDerWaalsContact C-N 3.32Å; A113-D115 PolarHBondContact O-N 3.29Å; D115-I117 PolarHBondContact O-N 2.9Å; D115-V118 PolarHBondContact O-N 3.44Å; D115-C119 WeakPolarHBondContact O-CB 3.36Å; D115-C119 PolarHBondContact O-N 3.49Å; D115-C119 PolarHBondContact O-SG 2.84Å; D115-R133 HydrophobicContact CB-CG 4.39Å; D115-R133 VanDerWaalsContact CG-CD 3.41Å; D115-R133 VanDerWaalsContact CG-NE 3.34Å; D115-R133 WeakPolarHBondContact OD1-CD 3.17Å; D115-R133 WeakPolarHBondContact OD1-CG 3.15Å; D115-R133 IonicContact OD1-NE 3.83Å; D115-R133 WeakPolarHBondContact OD2-CD 3.38Å; D115-R133 IonicContact OD2-CZ 3.94Å; D115-R133 IonicContact OD2-NE 2.87Å; D115-R133 PolarHBondContact OD2-NE 2.67Å; D115-R133 IonicContact OD2-NH1 2.71Å; D115-R133 PolarHBondContact OD2-NH1 3.41Å; D115-R133 VanDerWaalsContact OD2-NH1 3.13Å; D115-R133 IonicContact OD2-NH2 3.58Å
116	E	92.6	Very high	91	Very high	138 Å²	138	49.5 Å²	49.5	65%	0.645	27%	0.271	S	S	*	.	H	α-helix	trans	-61.6	-42.7	177.5	-73.2	174.3	-167.2	0	0	112.2	N112 A113 A114 C119 S120	N112-E116 WeakPolarHBondContact O-CG 3.33Å; N112-E116 PolarHBondContact O-N 2.98Å; A113-E116 PolarHBondContact O-N 3.49Å; A114-E116 PolarHBondContact O-N 2.97Å; E116-C119 PolarHBondContact O-N 3.09Å; E116-S120 WeakPolarHBondContact O-CB 3.33Å; E116-S120 PolarHBondContact O-N 2.87Å; E116-S120 PolarHBondContact O-OG 3.29Å
117	I	92.7	Very high	91	Very high	24 Å²	24	50.8 Å²	50.8	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-67.9	-42.1	-179.8	-62	162.1	0	0	0	110.4	V109 A113 A114 D115 S120 G121 R122 V123 I150	V109-I117 HydrophobicContact CG1-CD1 4.26Å; A113-I117 WeakPolarHBondContact O-CD1 3.4Å; A113-I117 WeakPolarHBondContact O-CG1 3.27Å; A113-I117 PolarHBondContact O-N 3.47Å; A114-I117 PolarHBondContact O-N 3.3Å; D115-I117 PolarHBondContact O-N 2.9Å; I117-S120 WeakPolarHBondContact CA-OG 3.28Å; I117-S120 PolarHBondContact O-N 3.27Å; I117-S120 PolarHBondContact O-OG 3.04Å; I117-G121 PolarHBondContact O-N 2.83Å; I117-R122 HydrophobicContact CG2-CB 3.92Å; I117-R122 PolarHBondContact O-N 3.46Å; I117-V123 HydrophobicContact CB-CG2 4.36Å; I117-V123 HydrophobicContact CG2-CG2 3.62Å; I117-I150 HydrophobicContact CG2-CG2 3.83Å
118	V	90.9	Very high	90.9	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-49.5	174.5	173.4	0	0	0	0	110.4	L99 L103 A114 D115 S120 G121 V123 A130	L99-V118 HydrophobicContact CD2-CG1 4.32Å; L99-V118 HydrophobicContact CD2-CG2 3.72Å; L99-V118 HydrophobicContact CG-CG2 4.3Å; L103-V118 HydrophobicContact CD1-CG2 3.74Å; A114-V118 VanDerWaalsContact O-CG2 3.27Å; A114-V118 WeakPolarHBondContact O-CG2 3.43Å; A114-V118 PolarHBondContact O-N 3.35Å; D115-V118 PolarHBondContact O-N 3.44Å; V118-S120 PolarHBondContact O-N 3.44Å; V118-G121 PolarHBondContact O-N 3.27Å; V118-V123 HydrophobicContact CB-CG2 4.43Å; V118-V123 HydrophobicContact CG2-CB 4.13Å; V118-V123 HydrophobicContact CG2-CG2 3.68Å; V118-A130 HydrophobicContact CG1-CB 4.35Å
119	C	90.5	Very high	90.9	Very high	82 Å²	82	58.7 Å²	58.7	55%	0.554	30%	0.303	S	S	*	.	H	α-helix	trans	-62.8	-30.3	177.7	-71.6	0	0	0	0	112.8	D115 E116 G121	D115-C119 WeakPolarHBondContact O-CB 3.36Å; D115-C119 PolarHBondContact O-N 3.49Å; D115-C119 PolarHBondContact O-SG 2.84Å; E116-C119 PolarHBondContact O-N 3.09Å; C119-G121 PolarHBondContact O-N 3.32Å
120	S	91.2	Very high	90.8	Very high	62 Å²	62	57.6 Å²	57.6	43%	0.434	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-5.8	174.4	74.2	0	0	0	0	113.8	E116 I117 V118 R122	E116-S120 WeakPolarHBondContact O-CB 3.33Å; E116-S120 PolarHBondContact O-N 2.87Å; E116-S120 PolarHBondContact O-OG 3.29Å; I117-S120 WeakPolarHBondContact CA-OG 3.28Å; I117-S120 PolarHBondContact O-N 3.27Å; I117-S120 PolarHBondContact O-OG 3.04Å; V118-S120 PolarHBondContact O-N 3.44Å; S120-R122 VanDerWaalsContact C-N 3.31Å; S120-R122 PolarHBondContact O-N 3.1Å; S120-R122 WeakPolarHBondContact OG-CG 3.43Å; S120-R122 PolarHBondContact OG-NE 2.91Å
121	G	90.4	Very high	90.4	Very high	14 Å²	14	60.6 Å²	60.6	14%	0.144	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	18.6	179.8	0	0	0	0	0	114.3	I117 V118 C119 R129	I117-G121 PolarHBondContact O-N 2.83Å; V118-G121 PolarHBondContact O-N 3.27Å; C119-G121 PolarHBondContact O-N 3.32Å; G121-R129 PolarHBondContact O-NE 2.69Å
122	R	92.2	Very high	90	Very high	119 Å²	119	63.7 Å²	63.7	45%	0.449	32%	0.322	S	S	.	.			trans	-92.3	-3.4	-178.3	-71.1	-170.3	-68.7	170.7	-1.4	114.5	I117 S120 V151	I117-R122 HydrophobicContact CG2-CB 3.92Å; I117-R122 PolarHBondContact O-N 3.46Å; S120-R122 VanDerWaalsContact C-N 3.31Å; S120-R122 PolarHBondContact O-N 3.1Å; S120-R122 WeakPolarHBondContact OG-CG 3.43Å; S120-R122 PolarHBondContact OG-NE 2.91Å; R122-V151 PolarHBondContact O-N 3.27Å
123	V	93	Very high	88.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.7	178.1	-175.1	0	0	0	0	110	L99 L103 I117 V118 A130 V148 D149	L99-V123 HydrophobicContact CD1-CG1 4.12Å; L99-V123 HydrophobicContact CD2-CG1 4.25Å; L103-V123 HydrophobicContact CD1-CG2 4.28Å; I117-V123 HydrophobicContact CB-CG2 4.36Å; I117-V123 HydrophobicContact CG2-CG2 3.62Å; V118-V123 HydrophobicContact CB-CG2 4.43Å; V118-V123 HydrophobicContact CG2-CB 4.13Å; V118-V123 HydrophobicContact CG2-CG2 3.68Å; V123-A130 HydrophobicContact CB-CB 4.29Å; V123-A130 HydrophobicContact CG1-CB 4.31Å; V123-A130 PolarHBondContact O-N 3.14Å; V123-V148 HydrophobicContact CG1-CG1 4.06Å; V123-D149 CarbonylContact C-O 3.55Å; V123-D149 WeakPolarHBondContact CA-O 3.2Å
124	F	92.3	Very high	87.3	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.035	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.6	174.7	-68.5	-106.1	0	0	0	109.6	R128 R129 V148 D149 V151 I196 P197	F124-R128 CarbonylContact C-O 3.51Å; F124-R128 VanDerWaalsContact CA-O 3.28Å; F124-R128 WeakPolarHBondContact CA-O 3.32Å; F124-R129 HydrophobicContact CD1-CB 4.24Å; F124-R129 HydrophobicContact CE1-CB 3.96Å; F124-R129 HydrophobicContact CZ-CB 4.35Å; F124-V148 CarbonylContact O-C 3.58Å; F124-V148 WeakPolarHBondContact O-CA 3.44Å; F124-D149 HydrophobicContact CB-CB 4.31Å; F124-D149 PolarHBondContact N-O 2.89Å; F124-D149 PolarHBondContact O-N 3.24Å; F124-V151 HydrophobicContact CD2-CG2 3.75Å; F124-V151 HydrophobicContact CE2-CG2 3.62Å; F124-I196 HydrophobicContact CD1-CG2 4.31Å; F124-I196 HydrophobicContact CD2-CG2 4Å; F124-I196 HydrophobicContact CE1-CG2 4.02Å; F124-I196 HydrophobicContact CE2-CG2 3.7Å; F124-I196 HydrophobicContact CG-CG1 4.46Å; F124-I196 HydrophobicContact CG-CG2 4.31Å; F124-I196 HydrophobicContact CZ-CG2 3.7Å; F124-P197 HydrophobicContact CE1-CG 4.22Å
125	V	90.9	Very high	85.5	Confident	28 Å²	28	70.3 Å²	70.3	17%	0.17	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.9	176.7	-177	0	0	0	0	107.4	L99 G127 R128 A130 F137 T147	L99-V125 HydrophobicContact CD1-CG2 4.31Å; V125-G127 PolarHBondContact O-N 2.86Å; V125-R128 PolarHBondContact N-O 2.89Å; V125-R128 PolarHBondContact O-N 2.8Å; V125-A130 HydrophobicContact CG2-CB 4.29Å; V125-F137 HydrophobicContact CB-CE2 4.01Å; V125-F137 HydrophobicContact CG1-CD2 3.94Å; V125-F137 HydrophobicContact CG1-CE2 3.32Å; V125-F137 HydrophobicContact CG1-CZ 3.62Å; V125-F137 HydrophobicContact CG2-CD2 3.87Å; V125-F137 HydrophobicContact CG2-CE2 3.51Å; V125-T147 CarbonylContact C-O 3.59Å; V125-T147 WeakPolarHBondContact CA-O 3.48Å
126	N	89.2	Confident	83.8	Confident	78 Å²	78	72.9 Å²	72.9	42%	0.417	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	41.6	-175.4	-63.4	-30.4	0	0	0	112.4	R128 D146 T147	N126-R128 VanDerWaalsContact C-N 3.25Å; N126-R128 PolarHBondContact O-N 3.39Å; N126-D146 PolarHBondContact ND2-OD1 3.14Å; N126-D146 VanDerWaalsContact OD1-CA 3.28Å; N126-D146 WeakPolarHBondContact OD1-CA 3.4Å; N126-T147 PolarHBondContact N-O 2.85Å; N126-T147 PolarHBondContact OD1-N 2.85Å
127	G	88.5	Confident	81.8	Confident	29 Å²	29	66.8 Å²	66.8	30%	0.299	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	0.7	-177.5	0	0	0	0	0	115.7	V125	V125-G127 PolarHBondContact O-N 2.86Å
128	R	88.9	Confident	79.8	Confident	204 Å²	204	67 Å²	67	77%	0.77	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	135	178.5	-61.9	-176.2	178.7	-170.5	0.1	111.4	F124 V125 N126 A130	F124-R128 CarbonylContact C-O 3.51Å; F124-R128 VanDerWaalsContact CA-O 3.28Å; F124-R128 WeakPolarHBondContact CA-O 3.32Å; V125-R128 PolarHBondContact N-O 2.89Å; V125-R128 PolarHBondContact O-N 2.8Å; N126-R128 VanDerWaalsContact C-N 3.25Å; N126-R128 PolarHBondContact O-N 3.39Å; R128-A130 PolarHBondContact O-N 3.08Å
129	R	89.6	Confident	77.7	Confident	107 Å²	107	74.7 Å²	74.7	40%	0.404	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	126.8	179.2	-171.7	177.1	-68.9	177.9	-3.1	111.4	G121 F124 L131 S199	G121-R129 PolarHBondContact O-NE 2.69Å; F124-R129 HydrophobicContact CD1-CB 4.24Å; F124-R129 HydrophobicContact CE1-CB 3.96Å; F124-R129 HydrophobicContact CZ-CB 4.35Å; R129-L131 HydrophobicContact CG-CD2 4.1Å; R129-S199 PolarHBondContact NH2-OG 3.31Å
130	A	88.8	Confident	75.7	Confident	7 Å²	7	80.5 Å²	80.5	6%	0.058	38%	0.38	C	S	.	.			trans	-79.7	126.9	172.1	0	0	0	0	0	110.2	L99 V118 V123 V125 R128	L99-A130 HydrophobicContact CD2-CB 3.77Å; V118-A130 HydrophobicContact CG1-CB 4.35Å; V123-A130 HydrophobicContact CB-CB 4.29Å; V123-A130 HydrophobicContact CG1-CB 4.31Å; V123-A130 PolarHBondContact O-N 3.14Å; V125-A130 HydrophobicContact CG2-CB 4.29Å; R128-A130 PolarHBondContact O-N 3.08Å
131	L	83.2	Confident	74.2	Confident	135 Å²	135	81.3 Å²	81.3	71%	0.707	39%	0.385	S	S	*	.			trans	-112.3	-19.2	-175.6	-64.4	179.3	0	0	0	114.5	R129	R129-L131 HydrophobicContact CG-CD2 4.1Å
132	K	79.6	Confident	73.1	Confident	133 Å²	133	81 Å²	81	58%	0.578	38%	0.381	S	S	*	.			trans	-125.6	142.9	-176.2	-165.1	178.2	-178.5	-173.6	0	110.1	S134 F135	K132-S134 VanDerWaalsContact C-N 3.33Å; K132-S134 WeakPolarHBondContact CE-OG 3.49Å; K132-S134 PolarHBondContact O-N 2.72Å; K132-F135 HydrophobicContact CB-CD2 4.29Å; K132-F135 WeakPolarHBondContact O-CB 3.41Å; K132-F135 PolarHBondContact O-N 3.16Å; K132-F135 VanDerWaalsContact O-N 3.11Å
133	R	68.7	Low	72.5	Confident	130 Å²	130	77.6 Å²	77.6	49%	0.491	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-46.8	174.9	-64.2	-178.2	178.9	-173.6	-1.7	112.3	D115 F135	D115-R133 HydrophobicContact CB-CG 4.39Å; D115-R133 VanDerWaalsContact CG-CD 3.41Å; D115-R133 VanDerWaalsContact CG-NE 3.34Å; D115-R133 WeakPolarHBondContact OD1-CD 3.17Å; D115-R133 WeakPolarHBondContact OD1-CG 3.15Å; D115-R133 IonicContact OD1-NE 3.83Å; D115-R133 WeakPolarHBondContact OD2-CD 3.38Å; D115-R133 IonicContact OD2-CZ 3.94Å; D115-R133 IonicContact OD2-NE 2.87Å; D115-R133 PolarHBondContact OD2-NE 2.67Å; D115-R133 IonicContact OD2-NH1 2.71Å; D115-R133 PolarHBondContact OD2-NH1 3.41Å; D115-R133 VanDerWaalsContact OD2-NH1 3.13Å; D115-R133 IonicContact OD2-NH2 3.58Å; R133-F135 VanDerWaalsContact C-N 3.26Å; R133-F135 PolarHBondContact O-N 2.79Å
134	S	59.5	Low	72.2	Confident	56 Å²	56	80.8 Å²	80.8	39%	0.392	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	26	178	78.2	0	0	0	0	112	K132 E136	K132-S134 VanDerWaalsContact C-N 3.33Å; K132-S134 WeakPolarHBondContact CE-OG 3.49Å; K132-S134 PolarHBondContact O-N 2.72Å; S134-E136 PolarHBondContact O-N 2.67Å
135	F	54.2	Low	72.1	Confident	100 Å²	100	82.6 Å²	82.6	44%	0.439	43%	0.425	S	S	.	.			trans	-62.6	89.2	150	-127.3	-93.1	0	0	0	102.9	K132 R133 F137	K132-F135 HydrophobicContact CB-CD2 4.29Å; K132-F135 WeakPolarHBondContact O-CB 3.41Å; K132-F135 PolarHBondContact O-N 3.16Å; K132-F135 VanDerWaalsContact O-N 3.11Å; R133-F135 VanDerWaalsContact C-N 3.26Å; R133-F135 PolarHBondContact O-N 2.79Å; F135-F137 PolarHBondContact O-N 2.7Å
136	E	53.8	Low	72.1	Confident	73 Å²	73	82.4 Å²	82.4	34%	0.341	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-36.1	119.3	151.2	-141.6	-176.6	-169	0	0	101.8	R96 S134 I138	R96-E136 IonicContact NH1-OE1 2.65Å; R96-E136 PolarHBondContact NH1-OE1 2.9Å; S134-E136 PolarHBondContact O-N 2.67Å; E136-I138 HydrophobicContact CB-CB 3.95Å; E136-I138 WeakPolarHBondContact CB-O 3.41Å; E136-I138 HydrophobicContact CG-CB 3.88Å; E136-I138 HydrophobicContact CG-CD1 4.13Å; E136-I138 HydrophobicContact CG-CG1 4.4Å; E136-I138 HydrophobicContact CG-CG2 4.31Å; E136-I138 CarbonylContact O-C 3.56Å; E136-I138 VanDerWaalsContact O-C 3.25Å; E136-I138 WeakPolarHBondContact O-CA 3.36Å; E136-I138 PolarHBondContact O-N 3.03Å
137	F	50.3	Low	72.2	Confident	11 Å²	11	79.9 Å²	79.9	5%	0.048	41%	0.41	C	S	.	.	S	Bend	trans	-64.9	34.8	-169.7	-180	-99	0	0	0	110.8	P97 L99 V125 F135 V142 D146 V148	P97-F137 WeakPolarHBondContact O-CB 3.4Å; L99-F137 HydrophobicContact CB-CB 4.19Å; L99-F137 HydrophobicContact CB-CD2 4.14Å; L99-F137 HydrophobicContact CD1-CD2 3.46Å; L99-F137 VanDerWaalsContact CD1-CD2 3.46Å; L99-F137 HydrophobicContact CD1-CE2 3.89Å; L99-F137 HydrophobicContact CG-CD2 4.31Å; V125-F137 HydrophobicContact CB-CE2 4.01Å; V125-F137 HydrophobicContact CG1-CD2 3.94Å; V125-F137 HydrophobicContact CG1-CE2 3.32Å; V125-F137 HydrophobicContact CG1-CZ 3.62Å; V125-F137 HydrophobicContact CG2-CD2 3.87Å; V125-F137 HydrophobicContact CG2-CE2 3.51Å; F135-F137 PolarHBondContact O-N 2.7Å; F137-V142 HydrophobicContact CD1-CG2 3.87Å; F137-V142 HydrophobicContact CE1-CG2 4.47Å; F137-D146 HydrophobicContact CE1-CB 4.35Å; F137-V148 HydrophobicContact CD2-CG2 4.37Å; F137-V148 HydrophobicContact CE1-CG2 4.09Å; F137-V148 HydrophobicContact CE2-CB 4.18Å; F137-V148 HydrophobicContact CE2-CG1 4.09Å; F137-V148 HydrophobicContact CE2-CG2 3.17Å; F137-V148 HydrophobicContact CZ-CB 4.36Å; F137-V148 HydrophobicContact CZ-CG2 3.06Å
138	I	50.1	Low	72.4	Confident	27 Å²	27	78.5 Å²	78.5	14%	0.138	40%	0.396	C	S	.	.				177.6	72.1	-124.2	-56.1	-176.9	0	0	0	104.2	P97 E136 F140 V142	P97-I138 HydrophobicContact CB-CD1 3.8Å; P97-I138 VanDerWaalsContact CD-CD1 3.49Å; P97-I138 HydrophobicContact CG-CD1 3.61Å; P97-I138 WeakPolarHBondContact O-CD1 3.42Å; E136-I138 HydrophobicContact CB-CB 3.95Å; E136-I138 WeakPolarHBondContact CB-O 3.41Å; E136-I138 HydrophobicContact CG-CB 3.88Å; E136-I138 HydrophobicContact CG-CD1 4.13Å; E136-I138 HydrophobicContact CG-CG1 4.4Å; E136-I138 HydrophobicContact CG-CG2 4.31Å; E136-I138 CarbonylContact O-C 3.56Å; E136-I138 VanDerWaalsContact O-C 3.25Å; E136-I138 WeakPolarHBondContact O-CA 3.36Å; E136-I138 PolarHBondContact O-N 3.03Å; I138-F140 PolarHBondContact O-N 3.2Å; I138-V142 HydrophobicContact CD1-CG2 3.69Å; I138-V142 HydrophobicContact CG1-CG2 3.56Å
139	H	45.8	Very low	72.7	Confident	166 Å²	166	68.8 Å²	68.8	77%	0.769	36%	0.36	S	S	*	.	S	Bend	trans	-80.1	8.5	151	-139.7	-69.8	0	0	0	110.4
140	F	48.9	Very low	72.9	Confident	204 Å²	204	64.3 Å²	64.3	90%	0.895	34%	0.344	S	S	*	.	S	Bend	trans	-157.1	-45.2	-179.7	-152.5	-117.9	0	0	0	117.9	I138	I138-F140 PolarHBondContact O-N 3.2Å
141	S	59.4	Low	73.2	Confident	78 Å²	78	64.9 Å²	64.9	55%	0.545	35%	0.347	S	S	.	.			trans	171	138.3	174.9	-178.6	0	0	0	0	104.7	A143	S141-A143 PolarHBondContact O-N 2.7Å; S141-A143 VanDerWaalsContact O-N 3.1Å
142	V	67.5	Low	73.7	Confident	8 Å²	8	62.9 Å²	62.9	5%	0.048	34%	0.336	C	S	.	.			trans	-61.2	120.8	165.2	-177.3	0	0	0	0	106.6	P97 F137 I138 V169 V172 V183	P97-V142 HydrophobicContact CB-CG2 3.55Å; P97-V142 HydrophobicContact CG-CB 4.47Å; P97-V142 HydrophobicContact CG-CG2 3.63Å; F137-V142 HydrophobicContact CD1-CG2 3.87Å; F137-V142 HydrophobicContact CE1-CG2 4.47Å; I138-V142 HydrophobicContact CD1-CG2 3.69Å; I138-V142 HydrophobicContact CG1-CG2 3.56Å; V142-V169 HydrophobicContact CG1-CB 4.46Å; V142-V169 HydrophobicContact CG1-CG1 3.91Å; V142-V169 HydrophobicContact CG1-CG2 3.85Å; V142-V172 HydrophobicContact CB-CG2 4.25Å; V142-V172 HydrophobicContact CG1-CG2 3.73Å; V142-V183 HydrophobicContact CG1-CG1 4.21Å
143	A	80.8	Confident	74.3	Confident	47 Å²	47	57.5 Å²	57.5	39%	0.388	32%	0.318	S	S	.	.			trans	-109	149	176.5	0	0	0	0	0	109.1	S141 G145 D146 V169	S141-A143 PolarHBondContact O-N 2.7Å; S141-A143 VanDerWaalsContact O-N 3.1Å; A143-G145 PolarHBondContact O-N 2.76Å; A143-D146 PolarHBondContact N-OD2 2.86Å; A143-D146 PolarHBondContact O-N 3.31Å; A143-V169 WeakPolarHBondContact O-CG1 3.42Å
144	A	86.1	Confident	75.4	Confident	67 Å²	67	55.5 Å²	55.5	55%	0.554	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	129.6	165.3	0	0	0	0	0	108.9	T170	A144-T170 WeakPolarHBondContact CB-O 3.49Å
145	G	90.5	Very high	76.9	Confident	46 Å²	46	53.3 Å²	53.3	47%	0.474	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.5	-10.2	-175.5	0	0	0	0	0	115.1	A143 V169	A143-G145 PolarHBondContact O-N 2.76Å; G145-V169 PolarHBondContact N-O 2.99Å
146	D	90	Very high	78.5	Confident	24 Å²	24	53.7 Å²	53.7	13%	0.128	32%	0.322	C	S	.	.			trans	-64.9	140.5	175.1	-73.3	-29.5	0	0	0	111.6	N126 F137 A143 V169	N126-D146 PolarHBondContact ND2-OD1 3.14Å; N126-D146 VanDerWaalsContact OD1-CA 3.28Å; N126-D146 WeakPolarHBondContact OD1-CA 3.4Å; F137-D146 HydrophobicContact CE1-CB 4.35Å; A143-D146 PolarHBondContact N-OD2 2.86Å; A143-D146 PolarHBondContact O-N 3.31Å; D146-V169 HydrophobicContact CB-CB 4.31Å; D146-V169 HydrophobicContact CB-CG2 3.91Å; D146-V169 PolarHBondContact O-N 3.09Å
147	T	92.5	Very high	80.2	Confident	25 Å²	25	55.5 Å²	55.5	15%	0.153	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.4	178.7	61.3	0	0	0	0	112.4	V125 N126 L167 L168	V125-T147 CarbonylContact C-O 3.59Å; V125-T147 WeakPolarHBondContact CA-O 3.48Å; N126-T147 PolarHBondContact N-O 2.85Å; N126-T147 PolarHBondContact OD1-N 2.85Å; T147-L167 CarbonylContact C-O 3.56Å; T147-L167 VanDerWaalsContact CA-O 3.32Å; T147-L167 WeakPolarHBondContact CA-O 3.43Å; T147-L168 HydrophobicContact CG2-CD1 3.76Å
148	V	92.8	Very high	82	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.3	170.8	-160.4	0	0	0	0	109.1	L99 I102 L103 V123 F124 F137 R166 L167	L99-V148 HydrophobicContact CD1-CG1 4.02Å; I102-V148 HydrophobicContact CG2-CG2 4.5Å; L103-V148 HydrophobicContact CD2-CG1 4.05Å; V123-V148 HydrophobicContact CG1-CG1 4.06Å; F124-V148 CarbonylContact O-C 3.58Å; F124-V148 WeakPolarHBondContact O-CA 3.44Å; F137-V148 HydrophobicContact CD2-CG2 4.37Å; F137-V148 HydrophobicContact CE1-CG2 4.09Å; F137-V148 HydrophobicContact CE2-CB 4.18Å; F137-V148 HydrophobicContact CE2-CG1 4.09Å; F137-V148 HydrophobicContact CE2-CG2 3.17Å; F137-V148 HydrophobicContact CZ-CB 4.36Å; F137-V148 HydrophobicContact CZ-CG2 3.06Å; V148-R166 CarbonylContact O-C 3.58Å; V148-R166 WeakPolarHBondContact O-CA 3.36Å; V148-L167 HydrophobicContact CB-CB 4.03Å; V148-L167 HydrophobicContact CB-CD1 4.38Å; V148-L167 HydrophobicContact CB-CG 4.49Å; V148-L167 HydrophobicContact CG2-CB 4.18Å; V148-L167 PolarHBondContact N-O 3.05Å; V148-L167 PolarHBondContact O-N 3.12Å
149	D	94.3	Very high	83.6	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.1	179.4	-63.6	-42.8	0	0	0	110.7	V123 F124 V164 T165 R166 I196	V123-D149 CarbonylContact C-O 3.55Å; V123-D149 WeakPolarHBondContact CA-O 3.2Å; F124-D149 HydrophobicContact CB-CB 4.31Å; F124-D149 PolarHBondContact N-O 2.89Å; F124-D149 PolarHBondContact O-N 3.24Å; D149-V164 HydrophobicContact CB-CB 4.23Å; D149-V164 HydrophobicContact CB-CG1 4.39Å; D149-V164 HydrophobicContact CB-CG2 4.32Å; D149-T165 WeakPolarHBondContact CA-O 3.13Å; D149-R166 WeakPolarHBondContact OD1-CA 3.37Å; D149-R166 WeakPolarHBondContact OD1-CB 3.34Å; D149-R166 WeakPolarHBondContact OD1-CD 3.47Å; D149-R166 WeakPolarHBondContact OD1-CG 3.25Å; D149-R166 IonicContact OD1-CZ 3.31Å; D149-R166 IonicContact OD1-NE 3.41Å; D149-R166 PolarHBondContact OD1-NE 3.19Å; D149-R166 IonicContact OD1-NH2 3.3Å; D149-R166 IonicContact OD2-CZ 3.53Å; D149-R166 IonicContact OD2-NE 2.76Å; D149-R166 PolarHBondContact OD2-NE 3.44Å; D149-R166 IonicContact OD2-NH2 3.22Å; D149-R166 PolarHBondContact OD2-NH2 3.37Å; D149-I196 HydrophobicContact CB-CD1 3.68Å
150	I	94.8	Very high	85.7	Confident	13 Å²	13	62.7 Å²	62.7	7%	0.067	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.3	164.3	-54.7	177.4	0	0	0	107.8	L103 C107 I117 L152 V164 T165	L103-I150 HydrophobicContact CD2-CD1 3.82Å; L103-I150 HydrophobicContact CD2-CG1 3.97Å; C107-I150 HydrophobicContact CB-CD1 3.74Å; C107-I150 VanDerWaalsContact SG-CD1 3.51Å; I117-I150 HydrophobicContact CG2-CG2 3.83Å; I150-L152 PolarHBondContact O-N 3.49Å; I150-V164 CarbonylContact O-C 3.25Å; I150-V164 WeakPolarHBondContact O-CA 3.29Å; I150-V164 WeakPolarHBondContact O-CB 3.19Å; I150-T165 PolarHBondContact N-O 3.17Å; I150-T165 PolarHBondContact O-N 2.94Å
151	V	94.7	Very high	87.7	Confident	19 Å²	19	56.4 Å²	56.4	12%	0.115	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	119.2	176.4	-177.9	0	0	0	0	110.3	R122 F124 V164 I196	R122-V151 PolarHBondContact O-N 3.27Å; F124-V151 HydrophobicContact CD2-CG2 3.75Å; F124-V151 HydrophobicContact CE2-CG2 3.62Å; V151-V164 HydrophobicContact CG2-CG1 4.23Å; V151-I196 HydrophobicContact CG2-CD1 4.32Å; V151-I196 HydrophobicContact CG2-CG2 3.83Å
152	L	93.5	Very high	89.3	Confident	93 Å²	93	52.7 Å²	52.7	49%	0.487	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-36.5	174.6	-56.4	175	0	0	0	111	I150 D163 R190	I150-L152 PolarHBondContact O-N 3.49Å; L152-D163 WeakPolarHBondContact CA-O 3.19Å; L152-D163 VanDerWaalsContact CB-O 3.26Å; L152-D163 WeakPolarHBondContact CB-O 3.39Å; L152-D163 PolarHBondContact N-O 3.22Å; L152-R190 HydrophobicContact CD1-CB 4.45Å; L152-R190 HydrophobicContact CD1-CG 4.15Å
153	G	92.1	Very high	90.6	Very high	19 Å²	19	52.5 Å²	52.5	20%	0.196	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.1	-176.1	178.6	0	0	0	0	0	112.4	D163	G153-D163 PolarHBondContact N-O 2.82Å; G153-D163 PolarHBondContact O-N 3.49Å
154	P	91.5	Very high	91.3	Very high	89 Å²	89	50.3 Å²	50.3	58%	0.578	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	145.8	170.8	29.1	-34.3	0	0	0	110.5	L198	P154-L198 HydrophobicContact CB-CD1 4.18Å
155	S	91	Very high	91.7	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.063	29%	0.286	C	S	.	.			trans	-70.8	143.3	178.1	-166.8	0	0	0	0	111.2	S157 F161 D163 T192	S155-S157 PolarHBondContact O-N 3.5Å; S155-F161 WeakPolarHBondContact CB-O 3.47Å; S155-F161 PolarHBondContact N-O 2.77Å; S155-D163 VanDerWaalsContact CB-OD1 3.27Å; S155-D163 WeakPolarHBondContact CB-OD1 3.48Å; S155-D163 PolarHBondContact OG-OD1 2.83Å; S155-T192 WeakPolarHBondContact OG-CG2 3.5Å
156	S	88.7	Confident	91.9	Very high	109 Å²	109	47.3 Å²	47.3	76%	0.762	27%	0.27	S	S	*	.	S	Bend	trans	-67.9	-20.6	175.7	52.9	0	0	0	0	113.4
157	S	88.9	Confident	92.2	Very high	110 Å²	110	46.2 Å²	46.2	77%	0.769	26%	0.264	S	S	*	.	S	Bend	trans	-88.7	-30.1	-176.7	-62	0	0	0	0	113	S155	S155-S157 PolarHBondContact O-N 3.5Å
158	N	86.9	Confident	92.2	Very high	58 Å²	58	47.1 Å²	47.1	31%	0.31	27%	0.268	S	S	.	.			trans	-156.2	125	-179.4	-170.6	-11.9	0	0	0	109.3	N160 F161	N158-N160 PolarHBondContact O-N 3.15Å; N158-N160 WeakPolarHBondContact OD1-CB 3.24Å; N158-N160 PolarHBondContact OD1-N 3.47Å; N158-N160 VanDerWaalsContact OD1-N 3.08Å; N158-F161 HydrophobicContact CB-CD2 3.44Å; N158-F161 VanDerWaalsContact CB-CD2 3.44Å; N158-F161 HydrophobicContact CB-CE2 3.88Å; N158-F161 HydrophobicContact CB-CG 4.14Å; N158-F161 WeakPolarHBondContact ND2-CE2 3.5Å; N158-F161 PolarHBondContact O-N 2.9Å; N158-F161 VanDerWaalsContact O-N 3.09Å
159	E	85.6	Confident	92.2	Very high	168 Å²	168	47.2 Å²	47.2	79%	0.785	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.5	179.5	-62.3	178.7	172.4	0	0	112.7	F161 L198	E159-F161 VanDerWaalsContact C-N 3.35Å; E159-L198 VanDerWaalsContact O-CD1 3.25Å; E159-L198 WeakPolarHBondContact O-CD1 3.41Å
160	N	88.2	Confident	92.1	Very high	129 Å²	129	48.7 Å²	48.7	69%	0.69	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.1	176.1	-65.6	-25.3	0	0	0	113.8	N158	N158-N160 PolarHBondContact O-N 3.15Å; N158-N160 WeakPolarHBondContact OD1-CB 3.24Å; N158-N160 PolarHBondContact OD1-N 3.47Å; N158-N160 VanDerWaalsContact OD1-N 3.08Å
161	F	92	Very high	92	Very high	73 Å²	73	53.1 Å²	53.1	32%	0.32	30%	0.298	S	S	.	.	S	Bend	trans	-105.9	147.5	179.4	-59.1	-38.4	0	0	0	110.6	S155 N158 E159 T192 V193 D194	S155-F161 WeakPolarHBondContact CB-O 3.47Å; S155-F161 PolarHBondContact N-O 2.77Å; N158-F161 HydrophobicContact CB-CD2 3.44Å; N158-F161 VanDerWaalsContact CB-CD2 3.44Å; N158-F161 HydrophobicContact CB-CE2 3.88Å; N158-F161 HydrophobicContact CB-CG 4.14Å; N158-F161 WeakPolarHBondContact ND2-CE2 3.5Å; N158-F161 PolarHBondContact O-N 2.9Å; N158-F161 VanDerWaalsContact O-N 3.09Å; E159-F161 VanDerWaalsContact C-N 3.35Å; F161-T192 HydrophobicContact CB-CG2 3.56Å; F161-T192 HydrophobicContact CD2-CG2 4.2Å; F161-T192 HydrophobicContact CG-CG2 4.18Å; F161-V193 WeakPolarHBondContact CA-O 3.44Å; F161-D194 HydrophobicContact CD1-CB 3.42Å; F161-D194 VanDerWaalsContact CD1-CB 3.42Å; F161-D194 HydrophobicContact CE1-CB 3.37Å
162	A	93	Very high	91.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.5	175.5	0	0	0	0	0	109.8	V164 T192 V193 I196 L198	A162-V164 HydrophobicContact CB-CG1 4.24Å; A162-T192 WeakPolarHBondContact O-CA 3.37Å; A162-V193 HydrophobicContact CB-CG2 4.44Å; A162-V193 PolarHBondContact N-O 2.83Å; A162-V193 PolarHBondContact O-N 2.9Å; A162-I196 HydrophobicContact CB-CB 4.42Å; A162-L198 HydrophobicContact CB-CD2 3.75Å; A162-L198 HydrophobicContact CB-CG 4.23Å
163	D	94.8	Very high	91.6	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126.5	164.4	-73.9	-9.5	0	0	0	108.8	L152 G153 S155 R190 T192	L152-D163 WeakPolarHBondContact CA-O 3.19Å; L152-D163 VanDerWaalsContact CB-O 3.26Å; L152-D163 WeakPolarHBondContact CB-O 3.39Å; L152-D163 PolarHBondContact N-O 3.22Å; G153-D163 PolarHBondContact N-O 2.82Å; G153-D163 PolarHBondContact O-N 3.49Å; S155-D163 VanDerWaalsContact CB-OD1 3.27Å; S155-D163 WeakPolarHBondContact CB-OD1 3.48Å; S155-D163 PolarHBondContact OG-OD1 2.83Å; D163-R190 HydrophobicContact CB-CG 4.28Å; D163-R190 IonicContact OD2-CZ 3.3Å; D163-R190 IonicContact OD2-NE 2.85Å; D163-R190 PolarHBondContact OD2-NE 2.86Å; D163-R190 IonicContact OD2-NH2 3.37Å; D163-R190 PolarHBondContact OD2-NH2 3.43Å; D163-T192 PolarHBondContact OD1-OG1 3.47Å
164	V	95.2	Very high	91.5	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	155.8	-177.6	-58.7	0	0	0	0	113	D149 I150 V151 A162 R166 R190 L191 V193 I196	D149-V164 HydrophobicContact CB-CB 4.23Å; D149-V164 HydrophobicContact CB-CG1 4.39Å; D149-V164 HydrophobicContact CB-CG2 4.32Å; I150-V164 CarbonylContact O-C 3.25Å; I150-V164 WeakPolarHBondContact O-CA 3.29Å; I150-V164 WeakPolarHBondContact O-CB 3.19Å; V151-V164 HydrophobicContact CG2-CG1 4.23Å; A162-V164 HydrophobicContact CB-CG1 4.24Å; V164-R166 HydrophobicContact CG2-CB 4.35Å; V164-R190 CarbonylContact O-C 3.54Å; V164-R190 WeakPolarHBondContact O-CA 3.34Å; V164-L191 HydrophobicContact CG2-CB 4.38Å; V164-L191 WeakPolarHBondContact CG2-O 3.3Å; V164-L191 PolarHBondContact N-O 3.43Å; V164-L191 PolarHBondContact O-N 2.79Å; V164-V193 HydrophobicContact CB-CG2 4.46Å; V164-V193 HydrophobicContact CG1-CG2 3.88Å; V164-V193 HydrophobicContact CG2-CB 4.45Å; V164-V193 HydrophobicContact CG2-CG1 3.81Å; V164-V193 HydrophobicContact CG2-CG2 3.72Å; V164-I196 HydrophobicContact CB-CD1 4.48Å; V164-I196 HydrophobicContact CG1-CD1 3.47Å; V164-I196 VanDerWaalsContact CG1-CD1 3.47Å
165	T	95.3	Very high	91.4	Very high	13 Å²	13	57.2 Å²	57.2	8%	0.08	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	112.7	158.6	-61.9	0	0	0	0	107.6	D149 I150 W188 K189	D149-T165 WeakPolarHBondContact CA-O 3.13Å; I150-T165 PolarHBondContact N-O 3.17Å; I150-T165 PolarHBondContact O-N 2.94Å; T165-W188 WeakPolarHBondContact CA-O 3.41Å; T165-W188 WeakPolarHBondContact CG2-O 3.47Å; T165-K189 PolarHBondContact OG1-O 2.85Å
166	R	94.9	Very high	91.4	Very high	38 Å²	38	61.8 Å²	61.8	14%	0.143	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.4	-177.8	-178.7	159.5	-72.7	-180	-9.2	111.1	V148 D149 V164 R187 W188 L191 D195	V148-R166 CarbonylContact O-C 3.58Å; V148-R166 WeakPolarHBondContact O-CA 3.36Å; D149-R166 WeakPolarHBondContact OD1-CA 3.37Å; D149-R166 WeakPolarHBondContact OD1-CB 3.34Å; D149-R166 WeakPolarHBondContact OD1-CD 3.47Å; D149-R166 WeakPolarHBondContact OD1-CG 3.25Å; D149-R166 IonicContact OD1-CZ 3.31Å; D149-R166 IonicContact OD1-NE 3.41Å; D149-R166 PolarHBondContact OD1-NE 3.19Å; D149-R166 IonicContact OD1-NH2 3.3Å; D149-R166 IonicContact OD2-CZ 3.53Å; D149-R166 IonicContact OD2-NE 2.76Å; D149-R166 PolarHBondContact OD2-NE 3.44Å; D149-R166 IonicContact OD2-NH2 3.22Å; D149-R166 PolarHBondContact OD2-NH2 3.37Å; V164-R166 HydrophobicContact CG2-CB 4.35Å; R166-R187 CarbonylContact O-C 3.54Å; R166-R187 WeakPolarHBondContact O-CA 3.39Å; R166-W188 HydrophobicContact CB-CE3 4Å; R166-W188 HydrophobicContact CG-CE3 3.98Å; R166-W188 HydrophobicContact CG-CZ3 4.24Å; R166-W188 PolarHBondContact N-O 3.46Å; R166-W188 PolarHBondContact O-N 2.99Å; R166-L191 HydrophobicContact CB-CD2 3.97Å; R166-L191 HydrophobicContact CG-CD2 4.33Å; R166-D195 IonicContact CZ-OD2 3.55Å; R166-D195 IonicContact NH1-OD2 2.78Å; R166-D195 IonicContact NH2-OD1 3.17Å; R166-D195 PolarHBondContact NH2-OD1 2.7Å; R166-D195 IonicContact NH2-OD2 2.64Å; R166-D195 PolarHBondContact NH2-OD2 3.2Å
167	L	94.4	Very high	91.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.8	162	-57.8	177.5	0	0	0	108.4	I102 C107 T147 V148 F185 R186 R187	I102-L167 HydrophobicContact CG2-CD1 3.94Å; C107-L167 VanDerWaalsContact SG-CD1 3.59Å; T147-L167 CarbonylContact C-O 3.56Å; T147-L167 VanDerWaalsContact CA-O 3.32Å; T147-L167 WeakPolarHBondContact CA-O 3.43Å; V148-L167 HydrophobicContact CB-CB 4.03Å; V148-L167 HydrophobicContact CB-CD1 4.38Å; V148-L167 HydrophobicContact CB-CG 4.49Å; V148-L167 HydrophobicContact CG2-CB 4.18Å; V148-L167 PolarHBondContact N-O 3.05Å; V148-L167 PolarHBondContact O-N 3.12Å; L167-F185 HydrophobicContact CB-CD1 4.38Å; L167-R186 CarbonylContact C-O 3.59Å; L167-R186 WeakPolarHBondContact CA-O 3.39Å; L167-R187 HydrophobicContact CD2-CB 3.64Å; L167-R187 HydrophobicContact CD2-CG 3.67Å
168	L	93.6	Very high	91.4	Very high	45 Å²	45	62.1 Å²	62.1	24%	0.236	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.9	171.7	175.3	70.6	0	0	0	108.7	T147 T170 F185 R186 W188	T147-L168 HydrophobicContact CG2-CD1 3.76Å; L168-T170 PolarHBondContact O-N 3.31Å; L168-F185 CarbonylContact O-C 3.5Å; L168-F185 WeakPolarHBondContact O-CA 3.06Å; L168-R186 PolarHBondContact N-O 3.24Å; L168-R186 PolarHBondContact O-N 2.81Å; L168-W188 HydrophobicContact CB-CH2 4.02Å; L168-W188 HydrophobicContact CB-CZ3 3.61Å; L168-W188 HydrophobicContact CD2-CH2 4.01Å; L168-W188 HydrophobicContact CD2-CZ3 4.45Å
169	V	92.9	Very high	91.4	Very high	2 Å²	2	66.8 Å²	66.8	1%	0.012	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	117.6	171.8	-177.9	0	0	0	0	108.6	V142 A143 G145 D146 V172 V183 F185	V142-V169 HydrophobicContact CG1-CB 4.46Å; V142-V169 HydrophobicContact CG1-CG1 3.91Å; V142-V169 HydrophobicContact CG1-CG2 3.85Å; A143-V169 WeakPolarHBondContact O-CG1 3.42Å; G145-V169 PolarHBondContact N-O 2.99Å; D146-V169 HydrophobicContact CB-CB 4.31Å; D146-V169 HydrophobicContact CB-CG2 3.91Å; D146-V169 PolarHBondContact O-N 3.09Å; V169-V172 HydrophobicContact CG1-CG2 3.58Å; V169-V183 HydrophobicContact CG1-CG1 3.86Å; V169-V183 HydrophobicContact CG2-CG1 4.36Å; V169-F185 HydrophobicContact CB-CD1 4.37Å; V169-F185 HydrophobicContact CG2-CD1 3.68Å; V169-F185 HydrophobicContact CG2-CE1 3.49Å; V169-F185 VanDerWaalsContact CG2-CE1 3.49Å
170	T	92.8	Very high	91.6	Very high	32 Å²	32	61 Å²	61	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-43.1	176.7	51.7	0	0	0	0	111.8	A144 L168 R184 R186	A144-T170 WeakPolarHBondContact CB-O 3.49Å; L168-T170 PolarHBondContact O-N 3.31Å; T170-R184 PolarHBondContact N-O 2.93Å; T170-R184 PolarHBondContact OG1-O 2.85Å; T170-R186 HydrophobicContact CG2-CB 4.34Å; T170-R186 HydrophobicContact CG2-CG 3.59Å
171	H	91.2	Very high	91.6	Very high	106 Å²	106	56.2 Å²	56.2	49%	0.491	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.6	-177.8	-61.5	-79.3	0	0	0	111.2	Y173 R184	H171-Y173 HydrophobicContact CB-CD1 4.32Å; H171-Y173 HydrophobicContact CB-CE1 4.47Å; H171-R184 HydrophobicContact CB-CB 4.17Å; H171-R184 PolarHBondContact N-O 2.92Å; H171-R184 PolarHBondContact O-N 2.8Å
172	V	90.3	Very high	91.5	Very high	52 Å²	52	52.8 Å²	52.8	32%	0.315	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.6	172.2	-174.1	0	0	0	0	106.5	V142 V169 V181 S182 V183	V142-V172 HydrophobicContact CB-CG2 4.25Å; V142-V172 HydrophobicContact CG1-CG2 3.73Å; V169-V172 HydrophobicContact CG1-CG2 3.58Å; V172-V181 HydrophobicContact CG1-CG1 3.5Å; V172-V181 VanDerWaalsContact CG1-CG1 3.5Å; V172-S182 WeakPolarHBondContact CA-O 3.27Å; V172-V183 HydrophobicContact CG1-CG2 4.44Å; V172-V183 HydrophobicContact CG2-CG1 4.23Å
173	Y	90.3	Very high	91.4	Very high	95 Å²	95	52.8 Å²	52.8	37%	0.373	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	149.4	178	52.5	-90.1	0	0	0	111.2	H171 S182	H171-Y173 HydrophobicContact CB-CD1 4.32Å; H171-Y173 HydrophobicContact CB-CE1 4.47Å; Y173-S182 WeakPolarHBondContact CE2-OG 3.41Å; Y173-S182 PolarHBondContact N-O 2.78Å; Y173-S182 PolarHBondContact O-N 2.94Å; Y173-S182 PolarHBondContact OH-OG 2.59Å
174	D	90.8	Very high	91.3	Very high	129 Å²	129	57.1 Å²	57.1	69%	0.69	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.1	175	-61.5	-38.2	0	0	0	110.1
175	V	89.5	Confident	91.1	Very high	29 Å²	29	57.2 Å²	57.2	18%	0.176	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-78.5	120.9	176.1	179.1	0	0	0	0	108.6	N177 S178 R180	V175-N177 PolarHBondContact O-N 3.31Å; V175-S178 PolarHBondContact O-N 2.95Å; V175-S178 VanDerWaalsContact O-N 3.15Å; V175-S178 VanDerWaalsContact O-O 3.06Å; V175-R180 WeakPolarHBondContact CB-O 3.27Å; V175-R180 HydrophobicContact CG2-CB 4.44Å; V175-R180 PolarHBondContact N-O 3.14Å
176	P	89.7	Confident	91	Very high	105 Å²	105	59 Å²	59	68%	0.682	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	137.8	-178.3	25.9	-34	0	0	0	110.8	S178	P176-S178 PolarHBondContact O-N 2.8Å
177	N	90.3	Very high	90.9	Very high	181 Å²	181	59 Å²	59	97%	0.968	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	17.1	-177.3	-45.8	-59.3	0	0	0	115	V175	V175-N177 PolarHBondContact O-N 3.31Å
178	S	87.2	Confident	90.9	Very high	46 Å²	46	60.3 Å²	60.3	32%	0.322	31%	0.307	S	S	.	.	S	Bend	trans	-133.8	151.1	174.3	-177.6	0	0	0	0	110.1	V175 P176 R180	V175-S178 PolarHBondContact O-N 2.95Å; V175-S178 VanDerWaalsContact O-N 3.15Å; V175-S178 VanDerWaalsContact O-O 3.06Å; P176-S178 PolarHBondContact O-N 2.8Å; S178-R180 PolarHBondContact O-N 2.84Å; S178-R180 WeakPolarHBondContact OG-CB 3.4Å; S178-R180 WeakPolarHBondContact OG-CG 3.31Å; S178-R180 PolarHBondContact OG-N 3.01Å
179	N	88.1	Confident	90.9	Very high	155 Å²	155	66.1 Å²	66.1	83%	0.829	33%	0.331	S	S	*	.	S	Bend	trans	-85.8	28.3	170.4	-72.9	-9.8	0	0	0	111.4
180	R	88.8	Confident	90.9	Very high	47 Å²	47	73.6 Å²	73.6	18%	0.177	36%	0.359	C	S	.	.			trans	-108.9	148.6	-178.8	-66	-176.7	-178.2	160.7	-3	110.6	D71 E73 K95 V175 S178	D71-R180 IonicContact OD1-CZ 2.78Å; D71-R180 IonicContact OD1-NE 3.14Å; D71-R180 PolarHBondContact OD1-NE 3.3Å; D71-R180 IonicContact OD1-NH2 2.77Å; D71-R180 PolarHBondContact OD1-NH2 3.26Å; D71-R180 IonicContact OD2-NE 3.89Å; D71-R180 PolarHBondContact OD2-NE 3.44Å; E73-R180 IonicContact OE1-CZ 3.81Å; E73-R180 IonicContact OE1-NH1 2.7Å; E73-R180 PolarHBondContact OE1-NH1 2.95Å; E73-R180 VanDerWaalsContact OE1-NH1 3.14Å; E73-R180 IonicContact OE1-NH2 3.2Å; E73-R180 PolarHBondContact OE1-NH2 3.23Å; E73-R180 IonicContact OE2-CZ 3.95Å; E73-R180 IonicContact OE2-NH1 3.88Å; E73-R180 PolarHBondContact OE2-NH1 3.22Å; E73-R180 IonicContact OE2-NH2 3.65Å; K95-R180 HydrophobicContact CB-CG 4.47Å; V175-R180 WeakPolarHBondContact CB-O 3.27Å; V175-R180 HydrophobicContact CG2-CB 4.44Å; V175-R180 PolarHBondContact N-O 3.14Å; S178-R180 PolarHBondContact O-N 2.84Å; S178-R180 WeakPolarHBondContact OG-CB 3.4Å; S178-R180 WeakPolarHBondContact OG-CG 3.31Å; S178-R180 PolarHBondContact OG-N 3.01Å
181	V	88.6	Confident	90.9	Very high	28 Å²	28	74.5 Å²	74.5	17%	0.17	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131.9	172.1	-178.4	0	0	0	0	108	V94 V172 V183	V94-V181 PolarHBondContact N-O 2.93Å; V94-V181 PolarHBondContact O-N 2.64Å; V94-V181 VanDerWaalsContact O-O 3.12Å; V172-V181 HydrophobicContact CG1-CG1 3.5Å; V172-V181 VanDerWaalsContact CG1-CG1 3.5Å; V181-V183 HydrophobicContact CG1-CG2 4.21Å
182	S	90.3	Very high	91	Very high	2 Å²	2	72.9 Å²	72.9	1%	0.014	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.6	171.7	-162.2	0	0	0	0	109.4	C91 V92 N93 V172 Y173	C91-S182 PolarHBondContact SG-OG 3.3Å; V92-S182 CarbonylContact O-C 3.54Å; V92-S182 VanDerWaalsContact O-CA 3.3Å; V92-S182 WeakPolarHBondContact O-CA 3.21Å; N93-S182 VanDerWaalsContact OD1-CB 3.27Å; N93-S182 WeakPolarHBondContact OD1-CB 3.36Å; N93-S182 PolarHBondContact OD1-OG 2.7Å; V172-S182 WeakPolarHBondContact CA-O 3.27Å; Y173-S182 WeakPolarHBondContact CE2-OG 3.41Å; Y173-S182 PolarHBondContact N-O 2.78Å; Y173-S182 PolarHBondContact O-N 2.94Å; Y173-S182 PolarHBondContact OH-OG 2.59Å
183	V	90.4	Very high	91.2	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	122.3	177.7	-168.6	0	0	0	0	109.1	C91 V92 P97 V142 V169 V172 V181 F185	C91-V183 WeakPolarHBondContact CA-O 3.31Å; V92-V183 HydrophobicContact CG1-CB 3.87Å; V92-V183 HydrophobicContact CG1-CG2 4.45Å; V92-V183 PolarHBondContact N-O 2.87Å; V92-V183 PolarHBondContact O-N 3.39Å; P97-V183 HydrophobicContact CB-CG2 4.47Å; P97-V183 HydrophobicContact CG-CG2 4.37Å; V142-V183 HydrophobicContact CG1-CG1 4.21Å; V169-V183 HydrophobicContact CG1-CG1 3.86Å; V169-V183 HydrophobicContact CG2-CG1 4.36Å; V172-V183 HydrophobicContact CG1-CG2 4.44Å; V172-V183 HydrophobicContact CG2-CG1 4.23Å; V181-V183 HydrophobicContact CG1-CG2 4.21Å; V183-F185 HydrophobicContact CB-CE1 4.46Å; V183-F185 HydrophobicContact CB-CE2 3.73Å; V183-F185 HydrophobicContact CB-CZ 3.59Å; V183-F185 HydrophobicContact CG1-CD1 4.22Å; V183-F185 HydrophobicContact CG1-CD2 4.3Å; V183-F185 HydrophobicContact CG1-CE1 3.5Å; V183-F185 HydrophobicContact CG1-CE2 3.58Å; V183-F185 HydrophobicContact CG1-CZ 3.1Å; V183-F185 WeakPolarHBondContact O-CE2 3.31Å
184	R	91.8	Very high	91.2	Very high	94 Å²	94	72.3 Å²	72.3	36%	0.355	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	133.2	174.6	-169.2	-179.5	-67.9	-169.9	-3.4	109.8	T89 R90 T170 H171	T89-R184 HydrophobicContact CG2-CG 3.81Å; R90-R184 CarbonylContact O-C 3.55Å; R90-R184 WeakPolarHBondContact O-CA 3.2Å; T170-R184 PolarHBondContact N-O 2.93Å; T170-R184 PolarHBondContact OG1-O 2.85Å; H171-R184 HydrophobicContact CB-CB 4.17Å; H171-R184 PolarHBondContact N-O 2.92Å; H171-R184 PolarHBondContact O-N 2.8Å
185	F	91.7	Very high	91	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.009	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.5	179.1	-48.8	-93.5	0	0	0	111.5	T89 R90 V92 I102 L167 L168 V169 V183	T89-F185 CarbonylContact C-O 3.49Å; T89-F185 VanDerWaalsContact CA-O 3.31Å; T89-F185 WeakPolarHBondContact CA-O 3.42Å; R90-F185 PolarHBondContact N-O 3.37Å; R90-F185 PolarHBondContact O-N 3.4Å; V92-F185 HydrophobicContact CB-CE2 4.46Å; V92-F185 HydrophobicContact CG1-CE2 3.51Å; V92-F185 HydrophobicContact CG1-CZ 4.13Å; I102-F185 HydrophobicContact CB-CZ 4.43Å; I102-F185 HydrophobicContact CD1-CE2 4.23Å; I102-F185 HydrophobicContact CD1-CZ 3.6Å; I102-F185 HydrophobicContact CG1-CZ 4.11Å; I102-F185 HydrophobicContact CG2-CE1 3.7Å; I102-F185 HydrophobicContact CG2-CE2 4.36Å; I102-F185 HydrophobicContact CG2-CZ 3.62Å; L167-F185 HydrophobicContact CB-CD1 4.38Å; L168-F185 CarbonylContact O-C 3.5Å; L168-F185 WeakPolarHBondContact O-CA 3.06Å; V169-F185 HydrophobicContact CB-CD1 4.37Å; V169-F185 HydrophobicContact CG2-CD1 3.68Å; V169-F185 HydrophobicContact CG2-CE1 3.49Å; V169-F185 VanDerWaalsContact CG2-CE1 3.49Å; V183-F185 HydrophobicContact CB-CE1 4.46Å; V183-F185 HydrophobicContact CB-CE2 3.73Å; V183-F185 HydrophobicContact CB-CZ 3.59Å; V183-F185 HydrophobicContact CG1-CD1 4.22Å; V183-F185 HydrophobicContact CG1-CD2 4.3Å; V183-F185 HydrophobicContact CG1-CE1 3.5Å; V183-F185 HydrophobicContact CG1-CE2 3.58Å; V183-F185 HydrophobicContact CG1-CZ 3.1Å; V183-F185 WeakPolarHBondContact O-CE2 3.31Å
186	R	92.9	Very high	90.7	Very high	51 Å²	51	68.5 Å²	68.5	19%	0.192	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	132.6	157.2	-69.8	170.9	84.5	-138.8	2.5	108.7	E83 D85 S87 L167 L168 T170 W188	E83-R186 IonicContact OE1-NE 3.29Å; E83-R186 IonicContact OE2-CZ 3.16Å; E83-R186 IonicContact OE2-NE 3.78Å; E83-R186 PolarHBondContact OE2-NE 2.65Å; E83-R186 IonicContact OE2-NH2 2.72Å; E83-R186 PolarHBondContact OE2-NH2 3.32Å; D85-R186 IonicContact OD1-NH2 2.66Å; D85-R186 PolarHBondContact OD1-NH2 3.35Å; D85-R186 VanDerWaalsContact OD1-NH2 3.14Å; D85-R186 IonicContact OD2-CZ 3.6Å; D85-R186 IonicContact OD2-NH1 3.13Å; D85-R186 IonicContact OD2-NH2 2.83Å; D85-R186 PolarHBondContact OD2-NH2 3.26Å; S87-R186 PolarHBondContact OG-NE 2.89Å; S87-R186 PolarHBondContact OG-NH2 2.77Å; S87-R186 VanDerWaalsContact OG-NH2 3.08Å; L167-R186 CarbonylContact C-O 3.59Å; L167-R186 WeakPolarHBondContact CA-O 3.39Å; L168-R186 PolarHBondContact N-O 3.24Å; L168-R186 PolarHBondContact O-N 2.81Å; T170-R186 HydrophobicContact CG2-CB 4.34Å; T170-R186 HydrophobicContact CG2-CG 3.59Å; R186-W188 HydrophobicContact CB-CH2 3.86Å; R186-W188 HydrophobicContact CB-CZ3 3.98Å
187	R	93.6	Very high	90.1	Very high	39 Å²	39	67.4 Å²	67.4	15%	0.147	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.9	-178.8	178.4	-164.7	-179.8	146.9	-2.3	110.5	S87 V88 G106 C107 R166 L167	S87-R187 CarbonylContact C-O 3.52Å; S87-R187 VanDerWaalsContact CA-O 3.25Å; S87-R187 WeakPolarHBondContact CA-O 3.49Å; V88-R187 PolarHBondContact N-O 3.14Å; V88-R187 WeakPolarHBondContact O-CB 2.99Å; V88-R187 PolarHBondContact O-N 2.78Å; G106-R187 WeakPolarHBondContact O-CD 3.21Å; G106-R187 PolarHBondContact O-NE 2.84Å; G106-R187 PolarHBondContact O-NH1 2.95Å; C107-R187 PolarHBondContact O-NH1 2.91Å; C107-R187 PolarHBondContact O-NH2 3.19Å; R166-R187 CarbonylContact O-C 3.54Å; R166-R187 WeakPolarHBondContact O-CA 3.39Å; L167-R187 HydrophobicContact CD2-CB 3.64Å; L167-R187 HydrophobicContact CD2-CG 3.67Å
188	W	94.5	Very high	89.2	Confident	27 Å²	27	62.3 Å²	62.3	10%	0.102	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.2	162.4	-64.5	-94.1	0	0	0	109.6	D85 T165 R166 L168 R186 R190 L191	D85-W188 WeakPolarHBondContact OD2-CZ2 3.27Å; D85-W188 PolarHBondContact OD2-NE1 3.41Å; T165-W188 WeakPolarHBondContact CA-O 3.41Å; T165-W188 WeakPolarHBondContact CG2-O 3.47Å; R166-W188 HydrophobicContact CB-CE3 4Å; R166-W188 HydrophobicContact CG-CE3 3.98Å; R166-W188 HydrophobicContact CG-CZ3 4.24Å; R166-W188 PolarHBondContact N-O 3.46Å; R166-W188 PolarHBondContact O-N 2.99Å; L168-W188 HydrophobicContact CB-CH2 4.02Å; L168-W188 HydrophobicContact CB-CZ3 3.61Å; L168-W188 HydrophobicContact CD2-CH2 4.01Å; L168-W188 HydrophobicContact CD2-CZ3 4.45Å; R186-W188 HydrophobicContact CB-CH2 3.86Å; R186-W188 HydrophobicContact CB-CZ3 3.98Å; W188-R190 VanDerWaalsContact C-N 3.32Å; W188-R190 PolarHBondContact O-N 3.15Å; W188-L191 HydrophobicContact CB-CB 4.03Å; W188-L191 HydrophobicContact CG-CB 4.48Å
189	K	92.5	Very high	88.2	Confident	167 Å²	167	67.5 Å²	67.5	73%	0.726	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	-39.2	177.6	-173.4	174.8	-179.4	177.8	0	111.7	T165	T165-K189 PolarHBondContact OG1-O 2.85Å
190	R	93.1	Very high	88.2	Confident	159 Å²	159	63.1 Å²	63.1	60%	0.6	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147	120.3	176.4	-169.5	173.4	-176.8	172.2	0	108.7	L152 D163 V164 W188	L152-R190 HydrophobicContact CD1-CB 4.45Å; L152-R190 HydrophobicContact CD1-CG 4.15Å; D163-R190 HydrophobicContact CB-CG 4.28Å; D163-R190 IonicContact OD2-CZ 3.3Å; D163-R190 IonicContact OD2-NE 2.85Å; D163-R190 PolarHBondContact OD2-NE 2.86Å; D163-R190 IonicContact OD2-NH2 3.37Å; D163-R190 PolarHBondContact OD2-NH2 3.43Å; V164-R190 CarbonylContact O-C 3.54Å; V164-R190 WeakPolarHBondContact O-CA 3.34Å; W188-R190 VanDerWaalsContact C-N 3.32Å; W188-R190 PolarHBondContact O-N 3.15Å
191	L	93.4	Very high	88.1	Confident	51 Å²	51	63.9 Å²	63.9	27%	0.267	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133	177	-176.4	69.9	0	0	0	107.8	V164 R166 W188 V193	V164-L191 HydrophobicContact CG2-CB 4.38Å; V164-L191 WeakPolarHBondContact CG2-O 3.3Å; V164-L191 PolarHBondContact N-O 3.43Å; V164-L191 PolarHBondContact O-N 2.79Å; R166-L191 HydrophobicContact CB-CD2 3.97Å; R166-L191 HydrophobicContact CG-CD2 4.33Å; W188-L191 HydrophobicContact CB-CB 4.03Å; W188-L191 HydrophobicContact CG-CB 4.48Å; L191-V193 HydrophobicContact CB-CG1 4.5Å; L191-V193 HydrophobicContact CD2-CG1 3.77Å; L191-V193 HydrophobicContact CG-CG1 3.84Å
192	T	93.8	Very high	88.1	Confident	71 Å²	71	65.9 Å²	65.9	44%	0.436	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.4	175.9	-56	0	0	0	0	109.1	S155 F161 A162 D163	S155-T192 WeakPolarHBondContact OG-CG2 3.5Å; F161-T192 HydrophobicContact CB-CG2 3.56Å; F161-T192 HydrophobicContact CD2-CG2 4.2Å; F161-T192 HydrophobicContact CG-CG2 4.18Å; A162-T192 WeakPolarHBondContact O-CA 3.37Å; D163-T192 PolarHBondContact OD1-OG1 3.47Å
193	V	93.1	Very high	88	Confident	10 Å²	10	69.7 Å²	69.7	6%	0.061	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	153.2	-173.5	-55.1	0	0	0	0	111.6	F161 A162 V164 L191 D195 I196	F161-V193 WeakPolarHBondContact CA-O 3.44Å; A162-V193 HydrophobicContact CB-CG2 4.44Å; A162-V193 PolarHBondContact N-O 2.83Å; A162-V193 PolarHBondContact O-N 2.9Å; V164-V193 HydrophobicContact CB-CG2 4.46Å; V164-V193 HydrophobicContact CG1-CG2 3.88Å; V164-V193 HydrophobicContact CG2-CB 4.45Å; V164-V193 HydrophobicContact CG2-CG1 3.81Å; V164-V193 HydrophobicContact CG2-CG2 3.72Å; L191-V193 HydrophobicContact CB-CG1 4.5Å; L191-V193 HydrophobicContact CD2-CG1 3.77Å; L191-V193 HydrophobicContact CG-CG1 3.84Å; V193-D195 VanDerWaalsContact CB-OD1 3.22Å; V193-D195 WeakPolarHBondContact CB-OD1 3.5Å; V193-D195 WeakPolarHBondContact CG2-OD1 3.34Å; V193-I196 HydrophobicContact CG2-CD1 3.76Å; V193-I196 HydrophobicContact CG2-CG1 4.19Å
194	D	91.3	Very high	87.8	Confident	125 Å²	125	74.1 Å²	74.1	67%	0.668	37%	0.374	S	S	*	.	S	Bend	trans	-110.8	-5.1	-176	68.1	-24.4	0	0	0	114	F161	F161-D194 HydrophobicContact CD1-CB 3.42Å; F161-D194 VanDerWaalsContact CD1-CB 3.42Å; F161-D194 HydrophobicContact CE1-CB 3.37Å
195	D	85.7	Confident	87.5	Confident	73 Å²	73	72.7 Å²	72.7	39%	0.39	38%	0.375	S	S	.	.	S	Bend	trans	-85.8	-12	-173.9	57.3	-15.3	0	0	0	113.8	R166 V193	R166-D195 IonicContact CZ-OD2 3.55Å; R166-D195 IonicContact NH1-OD2 2.78Å; R166-D195 IonicContact NH2-OD1 3.17Å; R166-D195 PolarHBondContact NH2-OD1 2.7Å; R166-D195 IonicContact NH2-OD2 2.64Å; R166-D195 PolarHBondContact NH2-OD2 3.2Å; V193-D195 VanDerWaalsContact CB-OD1 3.22Å; V193-D195 WeakPolarHBondContact CB-OD1 3.5Å; V193-D195 WeakPolarHBondContact CG2-OD1 3.34Å
196	I	84.2	Confident	87.3	Confident	6 Å²	6	77.8 Å²	77.8	3%	0.031	40%	0.401	C	S	.	.	S	Bend	trans	-100	121.3	-175.7	-64.8	170.4	0	0	0	110.4	F124 D149 V151 A162 V164 V193 L198	F124-I196 HydrophobicContact CD1-CG2 4.31Å; F124-I196 HydrophobicContact CD2-CG2 4Å; F124-I196 HydrophobicContact CE1-CG2 4.02Å; F124-I196 HydrophobicContact CE2-CG2 3.7Å; F124-I196 HydrophobicContact CG-CG1 4.46Å; F124-I196 HydrophobicContact CG-CG2 4.31Å; F124-I196 HydrophobicContact CZ-CG2 3.7Å; D149-I196 HydrophobicContact CB-CD1 3.68Å; V151-I196 HydrophobicContact CG2-CD1 4.32Å; V151-I196 HydrophobicContact CG2-CG2 3.83Å; A162-I196 HydrophobicContact CB-CB 4.42Å; V164-I196 HydrophobicContact CB-CD1 4.48Å; V164-I196 HydrophobicContact CG1-CD1 3.47Å; V164-I196 VanDerWaalsContact CG1-CD1 3.47Å; V193-I196 HydrophobicContact CG2-CD1 3.76Å; V193-I196 HydrophobicContact CG2-CG1 4.19Å; I196-L198 PolarHBondContact O-N 2.99Å; I196-L198 VanDerWaalsContact O-N 3.12Å
197	P	76.5	Confident	86.8	Confident	82 Å²	82	79.8 Å²	79.8	53%	0.532	42%	0.417	S	S	.	.			trans	-68.9	114.1	175.8	27.9	-32.7	0	0	0	109.9	F124 S199	F124-P197 HydrophobicContact CE1-CG 4.22Å; P197-S199 PolarHBondContact O-N 2.8Å; P197-S199 VanDerWaalsContact O-N 3.11Å
198	L	72.2	Confident	86.3	Confident	74 Å²	74	83.3 Å²	83.3	39%	0.387	44%	0.44	S	S	.	.			trans	-72.3	97.4	164.5	-64.8	174.4	0	0	0	107.2	P154 E159 A162 I196	P154-L198 HydrophobicContact CB-CD1 4.18Å; E159-L198 VanDerWaalsContact O-CD1 3.25Å; E159-L198 WeakPolarHBondContact O-CD1 3.41Å; A162-L198 HydrophobicContact CB-CD2 3.75Å; A162-L198 HydrophobicContact CB-CG 4.23Å; I196-L198 PolarHBondContact O-N 2.99Å; I196-L198 VanDerWaalsContact O-N 3.12Å
199	S	64.7	Low	85.5	Confident	154 Å²	154	88.4 Å²	88.4	100%	1.077	47%	0.471	S	S	*	.			trans	-79.6	0	179.2	60.8	0	0	0	0	112.7	R129 P197	R129-S199 PolarHBondContact NH2-OG 3.31Å; P197-S199 PolarHBondContact O-N 2.8Å; P197-S199 VanDerWaalsContact O-N 3.11Å

Retrieved 199 of 199 residues in 99.5 ms (Link to these results)

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