A0A096NGY4_PAPAN Loading...

Tetraspanin 17

AlphaFold DB (A0A2K5ZE71), UniProt , Accession A0A096NGY4, Species PAPAN (Papio anubis, Olive baboon), Gene TSPAN17, Length 246 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	40.9	Very low	39.4	Very low	227 Å²	227	146.7 Å²	146.7	100%	1.118	82%	0.824	S	S	*	*				0	101.7	0	-170.4	-178.9	-138	0	0	106.4
2	F	30.3	Very low	39.7	Very low	216 Å²	216	137.9 Å²	137.9	95%	0.947	79%	0.791	S	S	*	*			trans	-171.7	112.9	149.5	-87.7	-62.9	0	0	0	106.5
3	A	36.7	Very low	40.2	Very low	95 Å²	95	136.4 Å²	136.4	79%	0.785	78%	0.777	S	S	*	*			trans	-122.9	126.7	172.7	0	0	0	0	0	106
4	V	34	Very low	40.5	Very low	134 Å²	134	136 Å²	136	81%	0.812	77%	0.765	S	S	*	*			trans	-166.2	137.5	163.4	-177.7	0	0	0	0	104.8
5	E	33.4	Very low	41.1	Very low	171 Å²	171	135.6 Å²	135.6	80%	0.799	75%	0.754	S	S	*	*			cis	-174.3	146	-21.5	-156.1	162.5	-156.1	0	0	103.9
6	V	43.8	Very low	41.5	Very low	151 Å²	151	138.8 Å²	138.8	92%	0.915	75%	0.751	S	S	*	*			trans	-111	109.8	179.3	173.6	0	0	0	0	108.5
7	S	39.4	Very low	42.2	Very low	96 Å²	96	139 Å²	139	67%	0.671	74%	0.744	S	S	*	*			trans	-169.5	140.6	160.4	57.2	0	0	0	0	106.2
8	E	41.9	Very low	42.8	Very low	186 Å²	186	138.5 Å²	138.5	87%	0.869	74%	0.736	S	S	*	*			cis	-154.2	132.7	36.4	-66.4	168.1	131.4	0	0	108.7
9	A	47	Very low	43.4	Very low	96 Å²	96	137.6 Å²	137.6	79%	0.793	73%	0.727	S	S	*	*			trans	-148.9	42.2	168.2	0	0	0	0	0	110.8
10	K	46.1	Very low	44.1	Very low	191 Å²	191	137.8 Å²	137.8	83%	0.83	72%	0.724	S	S	*	*	S	Bend	trans	-118	-4.1	177.5	-76.6	-170.8	174.8	-177.7	0	114.6
11	G	40.5	Very low	44.5	Very low	51 Å²	51	138.2 Å²	138.2	53%	0.526	72%	0.72	S	S	.	*	S	Bend	trans	-77.2	-41.4	178.1	0	0	0	0	0	114.2	I13 Q14	G11-I13 PolarHBondContact O-N 3.46Å; G11-Q14 PolarHBondContact O-N 3.19Å
12	G	42.3	Very low	45.2	Very low	41 Å²	41	134.2 Å²	134.2	42%	0.423	70%	0.698	S	S	.	*	H	α-helix	trans	-74.1	-14	-168.6	0	0	0	0	0	116.6
13	I	46.2	Very low	46.2	Very low	118 Å²	118	130.7 Å²	130.7	61%	0.605	68%	0.682	S	S	*	*	H	α-helix	trans	-88.5	-20.3	178.9	-61.9	170.1	0	0	0	111.1	G11	G11-I13 PolarHBondContact O-N 3.46Å
14	Q	44.9	Very low	46.7	Very low	131 Å²	131	132.7 Å²	132.7	61%	0.612	68%	0.676	S	S	*	*	H	α-helix	trans	-82.2	-42.4	-179	-152	97.3	-16.9	0	0	110.8	G11 W16 K17 E18	G11-Q14 PolarHBondContact O-N 3.19Å; Q14-W16 PolarHBondContact O-N 3.24Å; Q14-K17 PolarHBondContact O-N 2.93Å; Q14-E18 PolarHBondContact O-N 2.98Å
15	E	48.6	Very low	47.3	Very low	130 Å²	130	133.6 Å²	133.6	61%	0.607	67%	0.669	S	S	*	*	H	α-helix	trans	-62	-39.9	177.3	-76.3	175.5	153.3	0	0	112.5	K17 E18 E19	E15-K17 VanDerWaalsContact C-N 3.27Å; E15-K17 PolarHBondContact O-N 2.83Å; E15-E18 PolarHBondContact O-N 2.7Å; E15-E19 PolarHBondContact O-N 2.64Å; E15-E19 VanDerWaalsContact O-N 3.12Å
16	W	48.5	Very low	48	Very low	187 Å²	187	132.7 Å²	132.7	71%	0.708	67%	0.665	S	S	*	*	H	α-helix	trans	-69.6	-25.8	-178.5	-71.4	50	0	0	0	112.7	Q14 E20	Q14-W16 PolarHBondContact O-N 3.24Å; W16-E20 PolarHBondContact O-N 3.24Å
17	K	52.2	Low	48.2	Very low	142 Å²	142	133 Å²	133	62%	0.617	66%	0.656	S	S	*	*	H	α-helix	trans	-82.7	-22.4	176	-75.2	-175.7	175.7	-177.2	0	113.2	Q14 E15	Q14-K17 PolarHBondContact O-N 2.93Å; E15-K17 VanDerWaalsContact C-N 3.27Å; E15-K17 PolarHBondContact O-N 2.83Å
18	E	53.3	Low	48.4	Very low	130 Å²	130	135.8 Å²	135.8	61%	0.607	66%	0.658	S	S	*	*	H	α-helix	trans	-80.1	-38.8	174.1	-75.1	179.8	166.9	0	0	110.8	Q14 E15 E20 K21 E22	Q14-E18 PolarHBondContact O-N 2.98Å; E15-E18 PolarHBondContact O-N 2.7Å; E18-E20 PolarHBondContact O-N 2.97Å; E18-K21 PolarHBondContact O-N 3.5Å; E18-E22 PolarHBondContact O-N 3.11Å; E18-E22 VanDerWaalsContact O-N 3.12Å
19	E	54.2	Low	48.5	Very low	121 Å²	121	130.5 Å²	130.5	57%	0.565	65%	0.646	S	S	*	*	H	α-helix	trans	-64.7	-36	174.8	-77.7	-172.3	156.2	0	0	113.9	E15 K21 K23	E15-E19 PolarHBondContact O-N 2.64Å; E15-E19 VanDerWaalsContact O-N 3.12Å; E19-K21 VanDerWaalsContact C-N 3.35Å; E19-K23 PolarHBondContact O-N 2.95Å
20	E	58.5	Low	48.5	Very low	141 Å²	141	129.7 Å²	129.7	66%	0.659	64%	0.64	S	S	*	*	H	α-helix	trans	-69.4	-33.3	174.3	-79.4	-166.2	156	0	0	112.3	W16 E18 K23 E24	W16-E20 PolarHBondContact O-N 3.24Å; E18-E20 PolarHBondContact O-N 2.97Å; E20-K23 PolarHBondContact O-N 3.38Å; E20-E24 PolarHBondContact O-N 3.27Å; E20-E24 VanDerWaalsContact O-N 3.14Å
21	K	52.3	Low	48.2	Very low	147 Å²	147	129 Å²	129	64%	0.639	64%	0.639	S	S	*	*	H	α-helix	trans	-75.3	-26.7	-179.8	-124.1	-179.4	-178.4	-179.5	0	113.5	E18 E19	E18-K21 PolarHBondContact O-N 3.5Å; E19-K21 VanDerWaalsContact C-N 3.35Å
22	E	54.7	Low	48.2	Very low	144 Å²	144	137.3 Å²	137.3	67%	0.673	66%	0.655	S	S	*	*	H	α-helix	trans	-76	-36.4	172.3	-76.5	-170.8	153.2	0	0	111.7	E18 K25 E26	E18-E22 PolarHBondContact O-N 3.11Å; E18-E22 VanDerWaalsContact O-N 3.12Å; E22-K25 PolarHBondContact O-N 3.02Å; E22-E26 PolarHBondContact O-N 3.48Å; E22-E26 VanDerWaalsContact O-N 3.14Å
23	K	51.1	Low	47.8	Very low	141 Å²	141	141.6 Å²	141.6	61%	0.613	67%	0.673	S	S	*	*	H	α-helix	trans	-66.5	-40.4	175.4	-76.7	178.5	179	170.4	0	113.4	E19 E20 K25 E26 E27	E19-K23 PolarHBondContact O-N 2.95Å; E20-K23 PolarHBondContact O-N 3.38Å; K23-K25 VanDerWaalsContact C-N 3.26Å; K23-K25 PolarHBondContact O-N 3.16Å; K23-E26 PolarHBondContact O-N 3.42Å; K23-E27 PolarHBondContact O-N 2.94Å
24	E	47.8	Very low	47.4	Very low	137 Å²	137	141.7 Å²	141.7	64%	0.64	68%	0.682	S	S	*	*	H	α-helix	trans	-64.7	-30.2	174.9	-76.6	-177.1	158.9	0	0	112.4	E20 E28	E20-E24 PolarHBondContact O-N 3.27Å; E20-E24 VanDerWaalsContact O-N 3.14Å; E24-E28 PolarHBondContact O-N 2.92Å
25	K	47.7	Very low	46.8	Very low	153 Å²	153	144.9 Å²	144.9	67%	0.665	70%	0.699	S	S	*	*	H	α-helix	trans	-77.7	-29.6	176.9	-82.5	-178.5	175.7	-179.6	0	113.8	E22 K23 A29	E22-K25 PolarHBondContact O-N 3.02Å; K23-K25 VanDerWaalsContact C-N 3.26Å; K23-K25 PolarHBondContact O-N 3.16Å; K25-A29 WeakPolarHBondContact O-CB 3.31Å; K25-A29 PolarHBondContact O-N 3.33Å
26	E	47.5	Very low	45.9	Very low	153 Å²	153	142 Å²	142	72%	0.715	70%	0.704	S	S	*	*	H	α-helix	trans	-72.9	-35.5	174.2	-89	-172.6	147.8	0	0	112.2	E22 K23 A30	E22-E26 PolarHBondContact O-N 3.48Å; E22-E26 VanDerWaalsContact O-N 3.14Å; K23-E26 PolarHBondContact O-N 3.42Å; E26-A30 PolarHBondContact O-N 3.48Å
27	E	47.1	Very low	45	Very low	157 Å²	157	142.9 Å²	142.9	73%	0.734	72%	0.716	S	S	*	*	H	α-helix	trans	-68.4	-38.6	174.7	-87.9	-174.8	150.4	0	0	112.6	K23 A29 A30	K23-E27 PolarHBondContact O-N 2.94Å; E27-A29 VanDerWaalsContact C-N 3.3Å; E27-A29 PolarHBondContact O-N 3.46Å; E27-A30 PolarHBondContact O-N 2.9Å
28	E	43.8	Very low	44.1	Very low	155 Å²	155	144.9 Å²	144.9	72%	0.724	73%	0.728	S	S	*	*	H	α-helix	trans	-73	-21.8	179.6	-150.3	-179.8	-171.5	0	0	113	E24	E24-E28 PolarHBondContact O-N 2.92Å
29	A	44.6	Very low	43	Very low	74 Å²	74	145.4 Å²	145.4	61%	0.612	74%	0.739	S	S	*	*	H	α-helix	trans	-83.4	-22.2	176	0	0	0	0	0	113.5	K25 E27	K25-A29 WeakPolarHBondContact O-CB 3.31Å; K25-A29 PolarHBondContact O-N 3.33Å; E27-A29 VanDerWaalsContact C-N 3.3Å; E27-A29 PolarHBondContact O-N 3.46Å
30	A	46.4	Very low	42.5	Very low	80 Å²	80	144.5 Å²	144.5	66%	0.661	74%	0.744	S	S	*	*	H	α-helix	trans	-80.7	-12.3	-178.5	0	0	0	0	0	114	E26 E27 R32	E26-A30 PolarHBondContact O-N 3.48Å; E27-A30 PolarHBondContact O-N 2.9Å; A30-R32 VanDerWaalsContact C-N 3.33Å; A30-R32 PolarHBondContact O-N 3.5Å
31	E	39.5	Very low	41.1	Very low	176 Å²	176	145.6 Å²	145.6	82%	0.822	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	22	-179.7	-148.8	-176.6	175	0	0	114
32	R	40.7	Very low	40.3	Very low	225 Å²	225	143.3 Å²	143.3	85%	0.849	76%	0.757	S	S	*	*			trans	-130.2	95.1	174.8	-66.6	-171.7	-176.7	-160.4	2.5	111.9	A30	A30-R32 VanDerWaalsContact C-N 3.33Å; A30-R32 PolarHBondContact O-N 3.5Å
33	T	33.9	Very low	39.5	Very low	131 Å²	131	142.1 Å²	142.1	80%	0.804	76%	0.761	S	S	*	*			trans	-125.2	134.8	164	-39.4	0	0	0	0	109.4
34	P	37.4	Very low	38.9	Very low	121 Å²	121	146.5 Å²	146.5	79%	0.786	77%	0.774	S	S	*	*			trans	-86.7	149	-162	33.9	-34.8	0	0	0	113.6
35	M	32.8	Very low	38.4	Very low	197 Å²	197	146.1 Å²	146.1	97%	0.97	78%	0.782	S	S	*	*			trans	-76.9	141.2	165	-87.5	-163.6	-61.9	0	0	111.4
36	G	30.2	Very low	37.8	Very low	70 Å²	70	146.9 Å²	146.9	72%	0.722	79%	0.792	S	S	*	*			trans	-169	105.9	156.9	0	0	0	0	0	112.4
37	E	29.9	Very low	37.5	Very low	206 Å²	206	148.2 Å²	148.2	96%	0.963	80%	0.803	S	S	*	*				-175	130.9	125.8	-99.1	179.5	-176.8	0	0	110.9
38	E	31.8	Very low	37.4	Very low	184 Å²	184	145.9 Å²	145.9	86%	0.86	80%	0.804	S	S	*	*			trans	-87.1	155.2	-174.6	-60	-179.5	142.8	0	0	113.3
39	V	32.1	Very low	37.4	Very low	140 Å²	140	146.7 Å²	146.7	85%	0.848	81%	0.812	S	S	*	*				-170.3	164.6	112	-115	0	0	0	0	111.4
40	P	42.2	Very low	37	Very low	102 Å²	102	155 Å²	155	66%	0.662	83%	0.828	S	S	*	*			trans	-118.7	157.8	-134.6	29.6	-6.8	0	0	0	113.8
41	N	29	Very low	36.6	Very low	165 Å²	165	154.7 Å²	154.7	88%	0.882	83%	0.833	S	S	*	*			trans	-172.8	130.3	133.5	-101.7	-25.6	0	0	0	113.5
42	S	36.7	Very low	36.7	Very low	98 Å²	98	156.2 Å²	156.2	69%	0.685	84%	0.837	S	S	*	*			trans	-54	131.7	176.8	171.1	0	0	0	0	114.1
43	P	37.6	Very low	36.5	Very low	119 Å²	119	150.3 Å²	150.3	77%	0.773	84%	0.836	S	S	*	*			trans	-102.1	81.4	167.7	34.5	-26.4	0	0	0	110.9
44	R	37.3	Very low	36.7	Very low	234 Å²	234	155.8 Å²	155.8	88%	0.883	84%	0.842	S	S	*	*			trans	-101.2	13.7	164.9	-106.7	-175.4	179.1	-179.2	0.8	114.3
45	T	39.1	Very low	37.3	Very low	129 Å²	129	159.2 Å²	159.2	79%	0.791	85%	0.85	S	S	*	*	S	Bend	trans	-134.5	40.3	-172.4	-32.6	0	0	0	0	114.9
46	L	34.7	Very low	38	Very low	169 Å²	169	153.2 Å²	153.2	89%	0.885	84%	0.838	S	S	*	*			trans	-133.9	38.5	170.9	-76	178.3	0	0	0	113.9
47	L	39.9	Very low	39.3	Very low	180 Å²	180	157 Å²	157	94%	0.942	84%	0.84	S	S	*	*	S	Bend	trans	-99.5	19.7	177.8	-110.6	163.4	0	0	0	114.7
48	S	45.8	Very low	40.3	Very low	108 Å²	108	153 Å²	153	76%	0.755	83%	0.832	S	S	*	*	S	Bend	trans	-129.6	-1.8	-170.6	-165.3	0	0	0	0	119.1
49	L	44.3	Very low	41.2	Very low	173 Å²	173	152.3 Å²	152.3	91%	0.906	83%	0.831	S	S	*	*	S	Bend	trans	-141.7	72.8	179.1	-78.8	167.4	0	0	0	112.8
50	R	36.5	Very low	42.4	Very low	247 Å²	247	154.3 Å²	154.3	93%	0.932	83%	0.831	S	S	*	*			trans	-157.6	71.8	151	-142.4	170.1	-177.6	-176.4	-0.5	112.4
51	G	36.5	Very low	43.3	Very low	74 Å²	74	155.1 Å²	155.1	76%	0.763	83%	0.834	S	S	*	*			trans	-72.7	125.5	160	0	0	0	0	0	110.6
52	K	41.6	Very low	44.9	Very low	209 Å²	209	155.8 Å²	155.8	91%	0.909	83%	0.829	S	S	*	*			trans	82.9	95.8	156.5	-58.8	173.7	-178.9	174.4	0	118.6
53	A	36.3	Very low	46.6	Very low	101 Å²	101	158.1 Å²	158.1	84%	0.835	83%	0.833	S	S	*	*			trans	-144.9	97.3	133.4	0	0	0	0	0	109.2
54	R	39.3	Very low	48.9	Very low	246 Å²	246	160.1 Å²	160.1	93%	0.928	83%	0.832	S	S	*	*			trans	27.3	120.3	151.5	-63.2	179	167.8	-179.1	-5.3	118.2	G56	R54-G56 PolarHBondContact O-N 3.16Å; R54-G56 VanDerWaalsContact O-N 3.08Å
55	M	50.1	Low	51.5	Low	193 Å²	193	153 Å²	153	95%	0.951	81%	0.811	S	S	*	*			trans	-46.8	112.6	155	-70.7	-152.1	-57.9	0	0	110.2
56	G	46.6	Very low	54.3	Low	71 Å²	71	152.6 Å²	152.6	73%	0.732	80%	0.8	S	S	*	*			trans	-91.6	117.1	162.5	0	0	0	0	0	108.1	R54	R54-G56 PolarHBondContact O-N 3.16Å; R54-G56 VanDerWaalsContact O-N 3.08Å
57	I	58	Low	57.3	Low	149 Å²	149	149.9 Å²	149.9	76%	0.764	79%	0.792	S	S	*	*			trans	-43.6	142	165.8	-61.5	156	0	0	0	108.9	M59	I57-M59 PolarHBondContact O-N 3.14Å
58	P	50.6	Low	60.1	Low	122 Å²	122	142.5 Å²	142.5	79%	0.792	75%	0.754	S	S	*	*			trans	-57.7	105.8	165.8	-14.8	28	0	0	0	106.8	E60	P58-E60 VanDerWaalsContact C-N 3.27Å; P58-E60 PolarHBondContact O-N 2.82Å
59	M	51.6	Low	62.5	Low	170 Å²	170	144.3 Å²	144.3	84%	0.837	75%	0.75	S	S	*	*			trans	-66.5	99.3	175.6	-160.9	174.7	-170.6	0	0	104.8	I57 V61	I57-M59 PolarHBondContact O-N 3.14Å; M59-V61 PolarHBondContact O-N 2.97Å
60	E	57.8	Low	65.1	Low	182 Å²	182	138.4 Å²	138.4	85%	0.85	72%	0.72	S	S	*	*			trans	-57.5	98.8	168.4	-169.7	171	-163.4	0	0	105.3	P58 K62	P58-E60 VanDerWaalsContact C-N 3.27Å; P58-E60 PolarHBondContact O-N 2.82Å; E60-K62 PolarHBondContact O-N 3.48Å
61	V	61.1	Low	68	Low	119 Å²	119	131.9 Å²	131.9	72%	0.721	70%	0.695	S	S	*	*			trans	-68.2	93.6	176.7	-173.4	0	0	0	0	104.6	M59 L63	M59-V61 PolarHBondContact O-N 2.97Å; V61-L63 VanDerWaalsContact C-N 3.34Å; V61-L63 PolarHBondContact O-N 3.42Å
62	K	60.9	Low	71	Confident	178 Å²	178	128.4 Å²	128.4	77%	0.774	66%	0.659	S	S	*	*			trans	-62.4	104.2	170.8	-142.1	178	-174.8	-176	0	105.2	E60 E64	E60-K62 PolarHBondContact O-N 3.48Å; K62-E64 PolarHBondContact O-N 2.89Å
63	L	73.4	Confident	73.7	Confident	147 Å²	147	118.5 Å²	118.5	77%	0.77	62%	0.616	S	S	*	*			trans	-62.4	94.9	170.8	-86.5	146.5	0	0	0	106.3	V61 L65	V61-L63 VanDerWaalsContact C-N 3.34Å; V61-L63 PolarHBondContact O-N 3.42Å; L63-L65 PolarHBondContact O-N 2.69Å; L63-L65 VanDerWaalsContact O-N 3.08Å
64	E	85	Confident	76.7	Confident	162 Å²	162	113.9 Å²	113.9	76%	0.757	58%	0.578	S	S	*	*			trans	-71.6	99.9	171.7	-68.6	-169.7	165.2	0	0	107.1	K62	K62-E64 PolarHBondContact O-N 2.89Å
65	L	93.3	Very high	79.5	Confident	85 Å²	85	103.7 Å²	103.7	45%	0.445	54%	0.539	S	S	.	.			trans	-71.9	147.7	173.4	-56.7	-179.8	0	0	0	109.6	L63 P67 E99	L63-L65 PolarHBondContact O-N 2.69Å; L63-L65 VanDerWaalsContact O-N 3.08Å; L65-P67 VanDerWaalsContact O-CD 3.29Å; L65-P67 WeakPolarHBondContact O-CD 3.29Å; L65-E99 WeakPolarHBondContact CA-OE2 3.1Å; L65-E99 HydrophobicContact CD2-CB 3.82Å; L65-E99 HydrophobicContact CD2-CG 3.72Å
66	H	97	Very high	81.8	Confident	119 Å²	119	97 Å²	97	55%	0.551	51%	0.505	S	S	*	.			trans	-92.6	107.8	177.3	-62.1	79.5	0	0	0	109	S97 V98 E99	H66-S97 CarbonylContact O-C 3.58Å; H66-S97 VanDerWaalsContact O-CA 3.26Å; H66-S97 WeakPolarHBondContact O-CA 3.42Å; H66-S97 WeakPolarHBondContact O-CB 3.41Å; H66-V98 HydrophobicContact CB-CB 4.11Å; H66-V98 HydrophobicContact CB-CG2 3.95Å; H66-V98 PolarHBondContact O-N 2.78Å; H66-E99 IonicContact CE1-OE1 2.75Å; H66-E99 IonicContact CG-OE1 4Å; H66-E99 PolarHBondContact N-OE1 3.17Å; H66-E99 PolarHBondContact N-OE2 2.72Å; H66-E99 IonicContact ND1-OE1 3.61Å; H66-E99 PolarHBondContact ND1-OE1 3.45Å; H66-E99 IonicContact ND1-OE2 2.89Å
67	P	97.8	Very high	84.2	Confident	112 Å²	112	94 Å²	94	73%	0.727	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	139.6	-176.4	28.6	-34.8	0	0	0	111.3	L65	L65-P67 VanDerWaalsContact O-CD 3.29Å; L65-P67 WeakPolarHBondContact O-CD 3.29Å
68	L	98.1	Very high	86.1	Confident	25 Å²	25	92.8 Å²	92.8	13%	0.131	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	153.5	168	-63.1	175.5	0	0	0	110.1	N70 D96 V98 I167	L68-N70 WeakPolarHBondContact CB-O 3.5Å; L68-N70 PolarHBondContact O-N 3.12Å; L68-D96 PolarHBondContact N-O 2.83Å; L68-V98 HydrophobicContact CD2-CG2 3.68Å; L68-I167 HydrophobicContact CD1-CB 4.11Å; L68-I167 HydrophobicContact CD1-CG2 4.28Å; L68-I167 HydrophobicContact CD2-CB 4.01Å; L68-I167 HydrophobicContact CD2-CG1 4.41Å
69	Q	97.7	Very high	88.1	Confident	146 Å²	146	91 Å²	91	68%	0.682	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	-34.2	176.3	-178.8	166.4	-68	0	0	112.5	E169	Q69-E169 HydrophobicContact CB-CG 3.78Å; Q69-E169 HydrophobicContact CG-CG 4.17Å; Q69-E169 PolarHBondContact NE2-OE2 2.98Å
70	N	98.1	Very high	90.1	Very high	50 Å²	50	86 Å²	86	27%	0.267	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.8	176.8	-71.4	-73.8	0	0	0	109.6	L68 W72 K124 E169	L68-N70 WeakPolarHBondContact CB-O 3.5Å; L68-N70 PolarHBondContact O-N 3.12Å; N70-W72 HydrophobicContact CB-CZ2 4.37Å; N70-W72 PolarHBondContact O-NE1 3.24Å; N70-K124 HydrophobicContact CB-CD 4.46Å; N70-K124 HydrophobicContact CB-CG 4.4Å; N70-E169 VanDerWaalsContact ND2-CD 3.28Å; N70-E169 PolarHBondContact ND2-OE1 3.2Å; N70-E169 PolarHBondContact ND2-OE2 3.07Å
71	R	98.3	Very high	91.6	Very high	109 Å²	109	88.2 Å²	88.2	41%	0.411	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138.5	163.5	-172.4	169.6	-169.1	-155.9	13.7	109.5	K94 V95 D96 D125	R71-K94 HydrophobicContact CG-CB 4.49Å; R71-V95 WeakPolarHBondContact CA-O 3.48Å; R71-V95 WeakPolarHBondContact CG-O 3.2Å; R71-D96 HydrophobicContact CB-CB 4.09Å; R71-D96 HydrophobicContact CG-CB 3.93Å; R71-D96 IonicContact NE-OD2 3.89Å; R71-D125 HydrophobicContact CB-CB 3.95Å; R71-D125 WeakPolarHBondContact CD-OD2 3.32Å; R71-D125 HydrophobicContact CG-CB 3.96Å; R71-D125 IonicContact CZ-OD2 2.69Å; R71-D125 IonicContact NE-OD2 3.71Å; R71-D125 IonicContact NH1-OD2 3.69Å; R71-D125 PolarHBondContact NH1-OD2 2.88Å; R71-D125 PolarHBondContact O-N 2.77Å
72	W	98.6	Very high	93.2	Very high	1 Å²	1	87.3 Å²	87.3	0%	0.004	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	146.2	-178.3	-61.8	87.3	0	0	0	110.9	N70 K94 V95 L122 F123 K124 L166 I167 E169	N70-W72 HydrophobicContact CB-CZ2 4.37Å; N70-W72 PolarHBondContact O-NE1 3.24Å; W72-K94 CarbonylContact O-C 3.42Å; W72-K94 WeakPolarHBondContact O-CA 3.4Å; W72-V95 HydrophobicContact CB-CG2 4.01Å; W72-V95 PolarHBondContact N-O 3.06Å; W72-V95 PolarHBondContact O-N 3.23Å; W72-L122 HydrophobicContact CB-CD1 3.83Å; W72-L122 HydrophobicContact CB-CD2 4.24Å; W72-L122 HydrophobicContact CB-CG 4.04Å; W72-L122 HydrophobicContact CD2-CD2 4.26Å; W72-L122 HydrophobicContact CD2-CG 4.45Å; W72-L122 HydrophobicContact CE3-CD2 4.13Å; W72-L122 HydrophobicContact CE3-CG 4.03Å; W72-L122 HydrophobicContact CG-CD2 4.31Å; W72-L122 HydrophobicContact CG-CG 4.48Å; W72-F123 CarbonylContact C-O 3.53Å; W72-F123 WeakPolarHBondContact CA-O 3.43Å; W72-F123 VanDerWaalsContact CE3-C 3.47Å; W72-K124 HydrophobicContact CD2-CG 4.33Å; W72-K124 HydrophobicContact CE3-CG 3.92Å; W72-K124 HydrophobicContact CH2-CD 4.27Å; W72-K124 HydrophobicContact CH2-CG 3.63Å; W72-K124 HydrophobicContact CZ2-CG 4.05Å; W72-K124 HydrophobicContact CZ3-CG 3.54Å; W72-L166 HydrophobicContact CE3-CD2 4.35Å; W72-L166 HydrophobicContact CH2-CB 3.66Å; W72-L166 HydrophobicContact CH2-CD2 4.1Å; W72-L166 HydrophobicContact CH2-CG 3.78Å; W72-L166 HydrophobicContact CZ2-CB 4.04Å; W72-L166 VanDerWaalsContact CZ2-O 3.25Å; W72-L166 WeakPolarHBondContact CZ2-O 3.09Å; W72-L166 HydrophobicContact CZ3-CB 3.99Å; W72-L166 HydrophobicContact CZ3-CD2 3.67Å; W72-L166 HydrophobicContact CZ3-CG 3.89Å; W72-I167 HydrophobicContact CD2-CG2 4.4Å; W72-I167 HydrophobicContact CG-CG2 4.21Å; W72-E169 WeakPolarHBondContact CZ2-OE1 3.35Å
73	A	98.6	Very high	94.6	Very high	1 Å²	1	84 Å²	84	1%	0.008	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.4	177	0	0	0	0	0	109	W75 L91 K94 L122 F123	A73-W75 VanDerWaalsContact O-CD1 3.26Å; A73-L91 HydrophobicContact CB-CD1 3.78Å; A73-K94 HydrophobicContact CB-CG 4.15Å; A73-L122 WeakPolarHBondContact O-CA 3.49Å; A73-F123 PolarHBondContact N-O 3.21Å; A73-F123 PolarHBondContact O-N 3.17Å
74	L	98.5	Very high	95.4	Very high	5 Å²	5	79.3 Å²	79.3	3%	0.026	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	129.7	171.7	-178.3	71.3	0	0	0	109.1	V92 T93 L104 I108 Y120 A121 L122	L74-V92 HydrophobicContact CB-CB 4.46Å; L74-V92 HydrophobicContact CD2-CB 4.26Å; L74-V92 HydrophobicContact CD2-CG1 4.3Å; L74-V92 HydrophobicContact CD2-CG2 4.49Å; L74-V92 HydrophobicContact CG-CB 4.34Å; L74-V92 HydrophobicContact CG-CG2 4.46Å; L74-V92 WeakPolarHBondContact O-CB 3.34Å; L74-V92 PolarHBondContact O-N 2.9Å; L74-T93 PolarHBondContact N-O 3.3Å; L74-T93 PolarHBondContact O-N 3Å; L74-L104 HydrophobicContact CB-CD2 3.95Å; L74-L104 HydrophobicContact CD2-CD1 3.96Å; L74-L104 HydrophobicContact CD2-CD2 3.79Å; L74-L104 HydrophobicContact CD2-CG 4.07Å; L74-L104 HydrophobicContact CG-CD2 4.46Å; L74-I108 HydrophobicContact CD2-CD1 3.95Å; L74-I108 HydrophobicContact CD2-CG2 4.28Å; L74-Y120 HydrophobicContact CD1-CD1 4.22Å; L74-A121 CarbonylContact C-O 3.49Å; L74-A121 WeakPolarHBondContact CA-O 3.3Å; L74-L122 HydrophobicContact CB-CD1 4.08Å; L74-L122 HydrophobicContact CD1-CD1 4.35Å
75	W	98.6	Very high	95.6	Very high	32 Å²	32	76.6 Å²	76.6	12%	0.121	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.6	176.8	-56.5	79.3	0	0	0	110	A73 L89 H90 L91 Y120 A121 E128 P129	A73-W75 VanDerWaalsContact O-CD1 3.26Å; W75-L89 HydrophobicContact CB-CD1 3.99Å; W75-L89 HydrophobicContact CE3-CD1 4.31Å; W75-L89 HydrophobicContact CE3-CD2 4.17Å; W75-L89 HydrophobicContact CE3-CG 3.87Å; W75-L89 HydrophobicContact CZ3-CD2 4.43Å; W75-L89 HydrophobicContact CZ3-CG 4.4Å; W75-H90 CarbonylContact C-O 3.45Å; W75-H90 VanDerWaalsContact CA-O 3.27Å; W75-H90 WeakPolarHBondContact CA-O 3.42Å; W75-L91 HydrophobicContact CD2-CB 4.35Å; W75-L91 HydrophobicContact CD2-CD1 4.07Å; W75-L91 HydrophobicContact CE3-CB 3.91Å; W75-L91 HydrophobicContact CE3-CD1 4.47Å; W75-L91 HydrophobicContact CH2-CB 4.22Å; W75-L91 HydrophobicContact CH2-CD1 4.49Å; W75-L91 HydrophobicContact CZ2-CD1 4.07Å; W75-L91 HydrophobicContact CZ3-CB 3.84Å; W75-Y120 WeakPolarHBondContact O-CA 3.28Å; W75-A121 HydrophobicContact CB-CB 4.23Å; W75-A121 PolarHBondContact N-O 2.89Å; W75-A121 PolarHBondContact O-N 2.9Å; W75-E128 HydrophobicContact CH2-CG 4.13Å; W75-E128 HydrophobicContact CZ2-CG 4.24Å; W75-P129 HydrophobicContact CB-CG 4.02Å; W75-P129 HydrophobicContact CD2-CG 3.98Å; W75-P129 HydrophobicContact CG-CG 3.73Å
76	F	98.3	Very high	95.3	Very high	52 Å²	52	77.1 Å²	77.1	23%	0.228	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.4	173.2	178.1	-108.8	0	0	0	109.2	K78 H90 V92 L114 C118 D119 Y120	F76-K78 HydrophobicContact CE1-CB 3.79Å; F76-K78 HydrophobicContact CZ-CB 4.15Å; F76-H90 PolarHBondContact N-O 3.39Å; F76-H90 PolarHBondContact O-N 3.08Å; F76-V92 HydrophobicContact CB-CG2 3.54Å; F76-L114 HydrophobicContact CE2-CD1 4.5Å; F76-L114 HydrophobicContact CE2-CD2 4.16Å; F76-C118 HydrophobicContact CE2-CB 3.94Å; F76-C118 HydrophobicContact CZ-CB 4.13Å; F76-D119 WeakPolarHBondContact CD2-O 3.47Å; F76-Y120 HydrophobicContact CB-CD1 4.27Å; F76-Y120 HydrophobicContact CB-CE1 4.2Å; F76-Y120 AromaticContact CD2-CD1 3.8Å; F76-Y120 HydrophobicContact CD2-CD1 3.8Å; F76-Y120 AromaticContact CD2-CE1 3.51Å; F76-Y120 HydrophobicContact CD2-CE1 3.51Å; F76-Y120 HydrophobicContact CE2-CE1 4.32Å; F76-Y120 HydrophobicContact CG-CE1 4.26Å
77	F	97.9	Very high	95.1	Very high	8 Å²	8	75.5 Å²	75.5	4%	0.035	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.2	173.5	173.4	-89.7	0	0	0	109.3	N79 W85 N88 L89 C118 D119	F77-N79 HydrophobicContact CE1-CB 3.74Å; F77-N79 HydrophobicContact CZ-CB 4.17Å; F77-W85 HydrophobicContact CD2-CZ2 4.32Å; F77-W85 AromaticContact CE2-CD1 3.5Å; F77-W85 VanDerWaalsContact CE2-CD1 3.5Å; F77-W85 HydrophobicContact CE2-CD2 4.07Å; F77-W85 AromaticContact CE2-CE2 3.63Å; F77-W85 AromaticContact CE2-CG 3.99Å; F77-W85 HydrophobicContact CE2-CG 3.99Å; F77-W85 HydrophobicContact CE2-CZ2 4.24Å; F77-W85 AromaticContact CE2-NE1 3.25Å; F77-W85 AromaticContact CZ-CD1 3.51Å; F77-W85 HydrophobicContact CZ-CG 4.39Å; F77-W85 AromaticContact CZ-NE1 3.34Å; F77-W85 VanDerWaalsContact CZ-NE1 3.34Å; F77-N88 WeakPolarHBondContact CA-O 3.31Å; F77-N88 HydrophobicContact CD2-CB 3.8Å; F77-N88 HydrophobicContact CE2-CB 3.44Å; F77-N88 VanDerWaalsContact CE2-CB 3.44Å; F77-N88 HydrophobicContact CZ-CB 4.11Å; F77-L89 HydrophobicContact CB-CD1 4.04Å; F77-L89 HydrophobicContact CD2-CB 4.23Å; F77-C118 CarbonylContact O-C 3.54Å; F77-C118 WeakPolarHBondContact O-CA 3.43Å; F77-D119 HydrophobicContact CB-CB 4.02Å; F77-D119 HydrophobicContact CD1-CB 4.37Å; F77-D119 WeakPolarHBondContact CD1-OD2 3.42Å; F77-D119 PolarHBondContact N-O 3.02Å; F77-D119 PolarHBondContact O-N 3.26Å
78	K	96.5	Very high	94.9	Very high	123 Å²	123	70.3 Å²	70.3	54%	0.535	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.9	170.9	179.6	177.3	179.6	-177	0	109	F76 D80 N88	F76-K78 HydrophobicContact CE1-CB 3.79Å; F76-K78 HydrophobicContact CZ-CB 4.15Å; K78-D80 PolarHBondContact O-N 2.95Å; K78-N88 PolarHBondContact N-O 3.01Å; K78-N88 VanDerWaalsContact O-CB 3.27Å; K78-N88 WeakPolarHBondContact O-CB 3.4Å; K78-N88 VanDerWaalsContact O-CG 3.27Å
79	N	93.7	Very high	94.8	Very high	84 Å²	84	70 Å²	70	45%	0.449	33%	0.33	S	S	.	.			trans	-66.9	95.4	-178.7	-169.7	28.9	0	0	0	112.2	F77 G117	F77-N79 HydrophobicContact CE1-CB 3.74Å; F77-N79 HydrophobicContact CZ-CB 4.17Å; N79-G117 VanDerWaalsContact CB-O 3.31Å; N79-G117 WeakPolarHBondContact CB-O 3.26Å; N79-G117 PolarHBondContact N-O 3.29Å
80	D	92.8	Very high	94.8	Very high	67 Å²	67	67.1 Å²	67.1	36%	0.358	32%	0.316	S	S	.	.			trans	-98	112.2	165	-172.5	-17.5	0	0	0	109.1	K78 S82 R83 N88	K78-D80 PolarHBondContact O-N 2.95Å; D80-S82 PolarHBondContact O-N 3.21Å; D80-S82 VanDerWaalsContact O-N 3.16Å; D80-S82 WeakPolarHBondContact OD1-CB 3.45Å; D80-S82 PolarHBondContact OD1-N 3.29Å; D80-S82 PolarHBondContact OD1-OG 2.87Å; D80-S82 PolarHBondContact OD2-OG 2.85Å; D80-R83 HydrophobicContact CB-CG 4.4Å; D80-R83 PolarHBondContact O-N 2.85Å; D80-N88 WeakPolarHBondContact CB-OD1 3.46Å; D80-N88 PolarHBondContact N-ND2 3.39Å; D80-N88 PolarHBondContact O-ND2 2.8Å
81	R	90.5	Very high	94.7	Very high	227 Å²	227	68.6 Å²	68.6	86%	0.857	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.3	-176.9	-62.9	179.3	64	92.9	3.2	113.4
82	S	93.1	Very high	94.7	Very high	101 Å²	101	66.8 Å²	66.8	71%	0.706	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-13.3	177.4	70.4	0	0	0	0	113.4	D80	D80-S82 PolarHBondContact O-N 3.21Å; D80-S82 VanDerWaalsContact O-N 3.16Å; D80-S82 WeakPolarHBondContact OD1-CB 3.45Å; D80-S82 PolarHBondContact OD1-N 3.29Å; D80-S82 PolarHBondContact OD1-OG 2.87Å; D80-S82 PolarHBondContact OD2-OG 2.85Å
83	R	90.6	Very high	94.6	Very high	107 Å²	107	69.5 Å²	69.5	40%	0.404	34%	0.341	S	S	.	.	S	Bend	trans	-113.9	158.8	-175.1	-60.7	175.5	71.8	-150.3	2.2	111.1	D80 D87 N88	D80-R83 HydrophobicContact CB-CG 4.4Å; D80-R83 PolarHBondContact O-N 2.85Å; R83-D87 HydrophobicContact CB-CB 4.33Å; R83-D87 PolarHBondContact NH1-O 3.33Å; R83-D87 PolarHBondContact NH2-O 2.91Å; R83-N88 PolarHBondContact NH1-OD1 3.45Å
84	A	89.6	Confident	94.6	Very high	50 Å²	50	72.9 Å²	72.9	41%	0.413	36%	0.355	S	S	.	.			trans	-63.1	153.1	169.4	0	0	0	0	0	110	Q86 D87	A84-Q86 VanDerWaalsContact C-N 3.31Å; A84-Q86 PolarHBondContact O-N 2.67Å; A84-D87 WeakPolarHBondContact O-CB 3.4Å; A84-D87 PolarHBondContact O-N 2.83Å
85	W	89.6	Confident	94.5	Very high	105 Å²	105	72.8 Å²	72.8	40%	0.398	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-42.6	-175.8	-178.8	91.7	0	0	0	112	F77 D87 N88 L89 M130	F77-W85 HydrophobicContact CD2-CZ2 4.32Å; F77-W85 AromaticContact CE2-CD1 3.5Å; F77-W85 VanDerWaalsContact CE2-CD1 3.5Å; F77-W85 HydrophobicContact CE2-CD2 4.07Å; F77-W85 AromaticContact CE2-CE2 3.63Å; F77-W85 AromaticContact CE2-CG 3.99Å; F77-W85 HydrophobicContact CE2-CG 3.99Å; F77-W85 HydrophobicContact CE2-CZ2 4.24Å; F77-W85 AromaticContact CE2-NE1 3.25Å; F77-W85 AromaticContact CZ-CD1 3.51Å; F77-W85 HydrophobicContact CZ-CG 4.39Å; F77-W85 AromaticContact CZ-NE1 3.34Å; F77-W85 VanDerWaalsContact CZ-NE1 3.34Å; W85-D87 PolarHBondContact O-N 3.25Å; W85-N88 WeakPolarHBondContact O-CB 3.36Å; W85-N88 PolarHBondContact O-N 3.3Å; W85-N88 VanDerWaalsContact O-N 3.14Å; W85-L89 HydrophobicContact CH2-CD2 4.18Å; W85-L89 HydrophobicContact CZ3-CD2 4.29Å; W85-M130 HydrophobicContact CH2-CB 4.06Å; W85-M130 HydrophobicContact CZ3-CB 3.94Å; W85-M130 HydrophobicContact CZ3-CE 4.35Å
86	Q	88.3	Confident	94.5	Very high	96 Å²	96	75 Å²	75	45%	0.449	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-61	-36.6	-179.7	-63.9	85.1	-8.6	0	0	111.6	A84 N88 L89	A84-Q86 VanDerWaalsContact C-N 3.31Å; A84-Q86 PolarHBondContact O-N 2.67Å; Q86-N88 PolarHBondContact O-N 3.09Å; Q86-L89 WeakPolarHBondContact O-CB 3.49Å; Q86-L89 PolarHBondContact O-N 2.83Å; Q86-L89 VanDerWaalsContact O-N 3.16Å
87	D	91.4	Very high	94.5	Very high	84 Å²	84	72.6 Å²	72.6	45%	0.449	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-69.1	-20.7	-178.6	-62.6	-25.6	0	0	0	113	R83 A84 W85 L89 H90	R83-D87 HydrophobicContact CB-CB 4.33Å; R83-D87 PolarHBondContact NH1-O 3.33Å; R83-D87 PolarHBondContact NH2-O 2.91Å; A84-D87 WeakPolarHBondContact O-CB 3.4Å; A84-D87 PolarHBondContact O-N 2.83Å; W85-D87 PolarHBondContact O-N 3.25Å; D87-L89 VanDerWaalsContact C-N 3.32Å; D87-H90 PolarHBondContact O-CE1 3.43Å; D87-H90 PolarHBondContact O-NE2 3.45Å
88	N	94.8	Very high	94.5	Very high	3 Å²	3	74.6 Å²	74.6	2%	0.016	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-84.8	-8.8	178.4	-74.5	-27.4	0	0	0	113.2	F77 K78 D80 R83 W85 Q86	F77-N88 WeakPolarHBondContact CA-O 3.31Å; F77-N88 HydrophobicContact CD2-CB 3.8Å; F77-N88 HydrophobicContact CE2-CB 3.44Å; F77-N88 VanDerWaalsContact CE2-CB 3.44Å; F77-N88 HydrophobicContact CZ-CB 4.11Å; K78-N88 PolarHBondContact N-O 3.01Å; K78-N88 VanDerWaalsContact O-CB 3.27Å; K78-N88 WeakPolarHBondContact O-CB 3.4Å; K78-N88 VanDerWaalsContact O-CG 3.27Å; D80-N88 WeakPolarHBondContact CB-OD1 3.46Å; D80-N88 PolarHBondContact N-ND2 3.39Å; D80-N88 PolarHBondContact O-ND2 2.8Å; R83-N88 PolarHBondContact NH1-OD1 3.45Å; W85-N88 WeakPolarHBondContact O-CB 3.36Å; W85-N88 PolarHBondContact O-N 3.3Å; W85-N88 VanDerWaalsContact O-N 3.14Å; Q86-N88 PolarHBondContact O-N 3.09Å
89	L	95.8	Very high	94.5	Very high	20 Å²	20	71.6 Å²	71.6	11%	0.105	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.3	177.9	-177.4	68.1	0	0	0	109.6	W75 F77 W85 Q86 D87 P129 M130	W75-L89 HydrophobicContact CB-CD1 3.99Å; W75-L89 HydrophobicContact CE3-CD1 4.31Å; W75-L89 HydrophobicContact CE3-CD2 4.17Å; W75-L89 HydrophobicContact CE3-CG 3.87Å; W75-L89 HydrophobicContact CZ3-CD2 4.43Å; W75-L89 HydrophobicContact CZ3-CG 4.4Å; F77-L89 HydrophobicContact CB-CD1 4.04Å; F77-L89 HydrophobicContact CD2-CB 4.23Å; W85-L89 HydrophobicContact CH2-CD2 4.18Å; W85-L89 HydrophobicContact CZ3-CD2 4.29Å; Q86-L89 WeakPolarHBondContact O-CB 3.49Å; Q86-L89 PolarHBondContact O-N 2.83Å; Q86-L89 VanDerWaalsContact O-N 3.16Å; D87-L89 VanDerWaalsContact C-N 3.32Å; L89-P129 HydrophobicContact CD1-CG 3.81Å; L89-P129 HydrophobicContact CD2-CG 3.66Å; L89-P129 HydrophobicContact CG-CG 4.27Å; L89-M130 HydrophobicContact CD2-CE 4.02Å
90	H	96.3	Very high	94.7	Very high	85 Å²	85	70.5 Å²	70.5	39%	0.394	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.3	-175.7	-62.1	-66.1	0	0	0	110.8	W75 F76 D87 V92	W75-H90 CarbonylContact C-O 3.45Å; W75-H90 VanDerWaalsContact CA-O 3.27Å; W75-H90 WeakPolarHBondContact CA-O 3.42Å; F76-H90 PolarHBondContact N-O 3.39Å; F76-H90 PolarHBondContact O-N 3.08Å; D87-H90 PolarHBondContact O-CE1 3.43Å; D87-H90 PolarHBondContact O-NE2 3.45Å; H90-V92 PolarHBondContact O-N 3.21Å
91	L	97.6	Very high	94.9	Very high	81 Å²	81	67.6 Å²	67.6	42%	0.424	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	123.4	167.3	179.3	67.4	0	0	0	108.4	A73 W75 K94	A73-L91 HydrophobicContact CB-CD1 3.78Å; W75-L91 HydrophobicContact CD2-CB 4.35Å; W75-L91 HydrophobicContact CD2-CD1 4.07Å; W75-L91 HydrophobicContact CE3-CB 3.91Å; W75-L91 HydrophobicContact CE3-CD1 4.47Å; W75-L91 HydrophobicContact CH2-CB 4.22Å; W75-L91 HydrophobicContact CH2-CD1 4.49Å; W75-L91 HydrophobicContact CZ2-CD1 4.07Å; W75-L91 HydrophobicContact CZ3-CB 3.84Å; L91-K94 HydrophobicContact CD1-CG 4.45Å
92	V	96.8	Very high	95.3	Very high	71 Å²	71	62.1 Å²	62.1	43%	0.43	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-60	177.6	-178.8	0	0	0	0	109.5	L74 F76 H90	L74-V92 HydrophobicContact CB-CB 4.46Å; L74-V92 HydrophobicContact CD2-CB 4.26Å; L74-V92 HydrophobicContact CD2-CG1 4.3Å; L74-V92 HydrophobicContact CD2-CG2 4.49Å; L74-V92 HydrophobicContact CG-CB 4.34Å; L74-V92 HydrophobicContact CG-CG2 4.46Å; L74-V92 WeakPolarHBondContact O-CB 3.34Å; L74-V92 PolarHBondContact O-N 2.9Å; F76-V92 HydrophobicContact CB-CG2 3.54Å; H90-V92 PolarHBondContact O-N 3.21Å
93	T	97.4	Very high	95.4	Very high	57 Å²	57	59.6 Å²	59.6	35%	0.35	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	174.3	178.5	-166.1	0	0	0	0	111.1	L74 V95 L104	L74-T93 PolarHBondContact N-O 3.3Å; L74-T93 PolarHBondContact O-N 3Å; T93-V95 HydrophobicContact CG2-CG1 4.38Å; T93-L104 HydrophobicContact CG2-CD1 3.5Å; T93-L104 HydrophobicContact CG2-CD2 3.57Å; T93-L104 HydrophobicContact CG2-CG 4.1Å
94	K	98.1	Very high	95.7	Very high	72 Å²	72	55.8 Å²	55.8	31%	0.313	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	144	172.3	-56	-176.8	-178.8	-168.4	0	110	R71 W72 A73 L91 D125	R71-K94 HydrophobicContact CG-CB 4.49Å; W72-K94 CarbonylContact O-C 3.42Å; W72-K94 WeakPolarHBondContact O-CA 3.4Å; A73-K94 HydrophobicContact CB-CG 4.15Å; L91-K94 HydrophobicContact CD1-CG 4.45Å; K94-D125 VanDerWaalsContact CE-OD1 3.24Å; K94-D125 WeakPolarHBondContact CE-OD1 3.18Å; K94-D125 IonicContact NZ-OD1 3.25Å; K94-D125 PolarHBondContact NZ-OD1 3.37Å; K94-D125 IonicContact NZ-OD2 3.92Å; K94-D125 PolarHBondContact NZ-OD2 3.48Å
95	V	97.6	Very high	96	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.024	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.1	-179.7	-59.4	0	0	0	0	110	R71 W72 T93 D100 L104	R71-V95 WeakPolarHBondContact CA-O 3.48Å; R71-V95 WeakPolarHBondContact CG-O 3.2Å; W72-V95 HydrophobicContact CB-CG2 4.01Å; W72-V95 PolarHBondContact N-O 3.06Å; W72-V95 PolarHBondContact O-N 3.23Å; T93-V95 HydrophobicContact CG2-CG1 4.38Å; V95-D100 HydrophobicContact CB-CB 3.95Å; V95-D100 HydrophobicContact CG1-CB 3.94Å; V95-L104 HydrophobicContact CG1-CB 4.23Å; V95-L104 HydrophobicContact CG1-CD2 3.72Å
96	D	97.8	Very high	96.3	Very high	77 Å²	77	54 Å²	54	41%	0.412	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	2.5	176.5	49.1	24.9	0	0	0	113.4	L68 R71	L68-D96 PolarHBondContact N-O 2.83Å; R71-D96 HydrophobicContact CB-CB 4.09Å; R71-D96 HydrophobicContact CG-CB 3.93Å; R71-D96 IonicContact NE-OD2 3.89Å
97	S	98.1	Very high	96.6	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	160.5	171.4	73.6	0	0	0	0	112.6	H66 E99 D100 F101	H66-S97 CarbonylContact O-C 3.58Å; H66-S97 VanDerWaalsContact O-CA 3.26Å; H66-S97 WeakPolarHBondContact O-CA 3.42Å; H66-S97 WeakPolarHBondContact O-CB 3.41Å; S97-E99 VanDerWaalsContact C-N 3.31Å; S97-D100 PolarHBondContact O-N 2.95Å; S97-D100 WeakPolarHBondContact OG-CB 3.42Å; S97-D100 PolarHBondContact OG-N 3.24Å; S97-D100 PolarHBondContact OG-OD2 2.87Å; S97-F101 PolarHBondContact O-N 2.91Å; S97-F101 VanDerWaalsContact O-N 3.09Å
98	V	97.9	Very high	96.8	Very high	49 Å²	49	54.9 Å²	54.9	30%	0.297	29%	0.287	S	S	.	.	H	α-helix	trans	-63.5	-40.5	175.6	174.6	0	0	0	0	110.6	H66 L68 F101 W102	H66-V98 HydrophobicContact CB-CB 4.11Å; H66-V98 HydrophobicContact CB-CG2 3.95Å; H66-V98 PolarHBondContact O-N 2.78Å; L68-V98 HydrophobicContact CD2-CG2 3.68Å; V98-F101 WeakPolarHBondContact O-CB 3.33Å; V98-F101 PolarHBondContact O-N 2.88Å; V98-W102 PolarHBondContact O-N 2.84Å
99	E	97.4	Very high	96.9	Very high	60 Å²	60	59.5 Å²	59.5	28%	0.28	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-45.1	177.6	-67.5	76.2	-171.3	0	0	111.3	L65 H66 S97 F101 W102 A103	L65-E99 WeakPolarHBondContact CA-OE2 3.1Å; L65-E99 HydrophobicContact CD2-CB 3.82Å; L65-E99 HydrophobicContact CD2-CG 3.72Å; H66-E99 IonicContact CE1-OE1 2.75Å; H66-E99 IonicContact CG-OE1 4Å; H66-E99 PolarHBondContact N-OE1 3.17Å; H66-E99 PolarHBondContact N-OE2 2.72Å; H66-E99 IonicContact ND1-OE1 3.61Å; H66-E99 PolarHBondContact ND1-OE1 3.45Å; H66-E99 IonicContact ND1-OE2 2.89Å; S97-E99 VanDerWaalsContact C-N 3.31Å; E99-F101 VanDerWaalsContact C-N 3.29Å; E99-F101 PolarHBondContact O-N 3.04Å; E99-W102 PolarHBondContact O-N 3.04Å; E99-A103 VanDerWaalsContact O-CB 3.27Å; E99-A103 WeakPolarHBondContact O-CB 3.38Å; E99-A103 PolarHBondContact O-N 3.38Å
100	D	96.4	Very high	97	Very high	62 Å²	62	61.3 Å²	61.3	33%	0.332	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-38	177.3	-67.7	-38.4	0	0	0	111.5	V95 S97 L104	V95-D100 HydrophobicContact CB-CB 3.95Å; V95-D100 HydrophobicContact CG1-CB 3.94Å; S97-D100 PolarHBondContact O-N 2.95Å; S97-D100 WeakPolarHBondContact OG-CB 3.42Å; S97-D100 PolarHBondContact OG-N 3.24Å; S97-D100 PolarHBondContact OG-OD2 2.87Å; D100-L104 VanDerWaalsContact O-CB 3.23Å; D100-L104 WeakPolarHBondContact O-CB 3.46Å; D100-L104 PolarHBondContact O-N 2.98Å
101	F	98.1	Very high	97.1	Very high	5 Å²	5	57.3 Å²	57.3	2%	0.022	30%	0.3	C	S	.	.	H	α-helix	trans	-60.7	-48.5	174.4	170.2	-96.1	0	0	0	111.7	S97 V98 E99 L104 Y105 L160 L163 L164 I167	S97-F101 PolarHBondContact O-N 2.91Å; S97-F101 VanDerWaalsContact O-N 3.09Å; V98-F101 WeakPolarHBondContact O-CB 3.33Å; V98-F101 PolarHBondContact O-N 2.88Å; E99-F101 VanDerWaalsContact C-N 3.29Å; E99-F101 PolarHBondContact O-N 3.04Å; F101-L104 PolarHBondContact O-N 3.25Å; F101-Y105 WeakPolarHBondContact O-CB 3.42Å; F101-Y105 PolarHBondContact O-N 3.39Å; F101-L160 HydrophobicContact CZ-CD1 4.27Å; F101-L163 HydrophobicContact CE2-CB 3.93Å; F101-L163 HydrophobicContact CE2-CD1 4.1Å; F101-L163 HydrophobicContact CZ-CB 3.84Å; F101-L163 HydrophobicContact CZ-CD1 4.16Å; F101-L164 HydrophobicContact CE1-CD2 3.96Å; F101-L164 HydrophobicContact CZ-CD2 4.39Å; F101-I167 HydrophobicContact CB-CD1 4.14Å; F101-I167 HydrophobicContact CD1-CD1 3.35Å; F101-I167 HydrophobicContact CD2-CD1 3.69Å; F101-I167 HydrophobicContact CD2-CG2 4.15Å; F101-I167 HydrophobicContact CE1-CD1 3.57Å; F101-I167 HydrophobicContact CE2-CD1 3.89Å; F101-I167 HydrophobicContact CE2-CG2 4.38Å; F101-I167 HydrophobicContact CG-CD1 3.41Å; F101-I167 VanDerWaalsContact CG-CD1 3.41Å; F101-I167 HydrophobicContact CZ-CD1 3.83Å
102	W	97.9	Very high	97.1	Very high	113 Å²	113	53.9 Å²	53.9	43%	0.428	28%	0.283	S	S	.	.	H	α-helix	trans	-71.5	-35.2	-179.7	-75.2	115.7	0	0	0	112.9	V98 E99 Y105 S106 L160 L164	V98-W102 PolarHBondContact O-N 2.84Å; E99-W102 PolarHBondContact O-N 3.04Å; W102-Y105 HydrophobicContact CE3-CD1 4.28Å; W102-Y105 HydrophobicContact CZ3-CD1 4.07Å; W102-Y105 PolarHBondContact O-N 3.25Å; W102-S106 WeakPolarHBondContact O-CB 3.47Å; W102-S106 PolarHBondContact O-N 3.44Å; W102-S106 PolarHBondContact O-OG 2.95Å; W102-L160 HydrophobicContact CH2-CD1 4.02Å; W102-L160 HydrophobicContact CH2-CD2 4.39Å; W102-L160 HydrophobicContact CZ3-CD1 4.08Å; W102-L164 HydrophobicContact CH2-CD2 4.22Å; W102-L164 HydrophobicContact CZ2-CD2 3.87Å
103	A	96.5	Very high	97.2	Very high	47 Å²	47	57.3 Å²	57.3	39%	0.388	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-47.3	170.5	0	0	0	0	0	110.3	E99 S106 H107	E99-A103 VanDerWaalsContact O-CB 3.27Å; E99-A103 WeakPolarHBondContact O-CB 3.38Å; E99-A103 PolarHBondContact O-N 3.38Å; A103-S106 PolarHBondContact O-OG 3.1Å; A103-H107 PolarHBondContact O-N 3.34Å; A103-H107 PolarHBondContact O-ND1 3.46Å
104	L	95.8	Very high	97.2	Very high	28 Å²	28	55.2 Å²	55.2	15%	0.147	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-52.4	174.5	176.4	59.9	0	0	0	111.9	L74 T93 V95 D100 F101 S106 H107 I108	L74-L104 HydrophobicContact CB-CD2 3.95Å; L74-L104 HydrophobicContact CD2-CD1 3.96Å; L74-L104 HydrophobicContact CD2-CD2 3.79Å; L74-L104 HydrophobicContact CD2-CG 4.07Å; L74-L104 HydrophobicContact CG-CD2 4.46Å; T93-L104 HydrophobicContact CG2-CD1 3.5Å; T93-L104 HydrophobicContact CG2-CD2 3.57Å; T93-L104 HydrophobicContact CG2-CG 4.1Å; V95-L104 HydrophobicContact CG1-CB 4.23Å; V95-L104 HydrophobicContact CG1-CD2 3.72Å; D100-L104 VanDerWaalsContact O-CB 3.23Å; D100-L104 WeakPolarHBondContact O-CB 3.46Å; D100-L104 PolarHBondContact O-N 2.98Å; F101-L104 PolarHBondContact O-N 3.25Å; L104-S106 VanDerWaalsContact C-N 3.26Å; L104-S106 PolarHBondContact O-N 3.35Å; L104-H107 PolarHBondContact O-N 3.03Å; L104-H107 VanDerWaalsContact O-N 3.1Å; L104-I108 HydrophobicContact CD1-CG2 3.69Å; L104-I108 HydrophobicContact CG-CG2 4.42Å; L104-I108 WeakPolarHBondContact O-CG2 3.18Å; L104-I108 PolarHBondContact O-N 3.48Å; L104-I108 VanDerWaalsContact O-N 3.12Å
105	Y	96.4	Very high	97.1	Very high	35 Å²	35	55.2 Å²	55.2	14%	0.137	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-34.5	-174.7	-172.6	-96.3	0	0	0	112.6	F101 W102 L110 L160 L163	F101-Y105 WeakPolarHBondContact O-CB 3.42Å; F101-Y105 PolarHBondContact O-N 3.39Å; W102-Y105 HydrophobicContact CE3-CD1 4.28Å; W102-Y105 HydrophobicContact CZ3-CD1 4.07Å; W102-Y105 PolarHBondContact O-N 3.25Å; Y105-L110 HydrophobicContact CE1-CD2 4.37Å; Y105-L160 HydrophobicContact CD1-CD1 4.33Å; Y105-L160 HydrophobicContact CD2-CD1 4.23Å; Y105-L160 HydrophobicContact CE1-CD1 3.99Å; Y105-L160 HydrophobicContact CE1-CD2 4.17Å; Y105-L160 HydrophobicContact CE2-CB 4.45Å; Y105-L160 HydrophobicContact CE2-CD1 3.88Å; Y105-L160 HydrophobicContact CG-CD1 4.45Å; Y105-L163 HydrophobicContact CD2-CD1 3.92Å; Y105-L163 HydrophobicContact CE2-CD1 3.97Å
106	S	96	Very high	97	Very high	82 Å²	82	57.8 Å²	57.8	57%	0.573	31%	0.305	S	S	*	.	H	α-helix	trans	-73.8	-24	177.3	54.3	0	0	0	0	114.2	W102 A103 L104	W102-S106 WeakPolarHBondContact O-CB 3.47Å; W102-S106 PolarHBondContact O-N 3.44Å; W102-S106 PolarHBondContact O-OG 2.95Å; A103-S106 PolarHBondContact O-OG 3.1Å; L104-S106 VanDerWaalsContact C-N 3.26Å; L104-S106 PolarHBondContact O-N 3.35Å
107	H	94.8	Very high	96.9	Very high	163 Å²	163	54.6 Å²	54.6	76%	0.755	29%	0.291	S	S	*	.	H	α-helix	trans	-99.4	-12	-177.1	-70.6	80.1	0	0	0	113.9	A103 L104	A103-H107 PolarHBondContact O-N 3.34Å; A103-H107 PolarHBondContact O-ND1 3.46Å; L104-H107 PolarHBondContact O-N 3.03Å; L104-H107 VanDerWaalsContact O-N 3.1Å
108	I	96	Very high	96.9	Very high	35 Å²	35	54.6 Å²	54.6	18%	0.179	29%	0.291	C	S	.	.	S	Bend	trans	-90.7	151.7	174.6	65	175.7	0	0	0	111.7	L74 L104 L110 Y120	L74-I108 HydrophobicContact CD2-CD1 3.95Å; L74-I108 HydrophobicContact CD2-CG2 4.28Å; L104-I108 HydrophobicContact CD1-CG2 3.69Å; L104-I108 HydrophobicContact CG-CG2 4.42Å; L104-I108 WeakPolarHBondContact O-CG2 3.18Å; L104-I108 PolarHBondContact O-N 3.48Å; L104-I108 VanDerWaalsContact O-N 3.12Å; I108-L110 PolarHBondContact O-N 3.49Å; I108-Y120 HydrophobicContact CD1-CE2 4.45Å
109	Q	97.1	Very high	96.9	Very high	101 Å²	101	52.9 Å²	52.9	47%	0.472	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-67.1	133.8	172.8	-173	169.5	-55.3	0	0	110.5	K113 L114 Y120	Q109-K113 HydrophobicContact CG-CB 3.73Å; Q109-K113 PolarHBondContact NE2-O 2.78Å; Q109-L114 HydrophobicContact CB-CD2 4.33Å; Q109-L114 HydrophobicContact CG-CD2 4.34Å; Q109-Y120 VanDerWaalsContact O-CE2 3.25Å; Q109-Y120 WeakPolarHBondContact O-CE2 3.21Å; Q109-Y120 PolarHBondContact O-OH 3.25Å
110	L	98.1	Very high	97	Very high	57 Å²	57	50.8 Å²	50.8	30%	0.298	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-56.3	147.7	174.9	-66.6	177.2	0	0	0	112.2	Y105 I108 S112 K113 L114	Y105-L110 HydrophobicContact CE1-CD2 4.37Å; I108-L110 PolarHBondContact O-N 3.49Å; L110-S112 VanDerWaalsContact C-N 3.29Å; L110-S112 PolarHBondContact O-N 3.24Å; L110-K113 HydrophobicContact CB-CD 4.45Å; L110-K113 HydrophobicContact CB-CG 4.41Å; L110-K113 PolarHBondContact O-N 3.15Å; L110-L114 PolarHBondContact O-N 3.31Å
111	A	97.9	Very high	97.1	Very high	2 Å²	2	48.1 Å²	48.1	2%	0.017	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-58.4	-39.9	-176.9	0	0	0	0	0	112.1	K113 L114 L155 D156 W159 V183 I185	A111-K113 PolarHBondContact O-N 3.42Å; A111-L114 WeakPolarHBondContact O-CB 3.29Å; A111-L114 PolarHBondContact O-N 2.99Å; A111-L155 HydrophobicContact CB-CD2 4.16Å; A111-L155 HydrophobicContact CB-CG 4.37Å; A111-D156 PolarHBondContact N-OD1 3.49Å; A111-W159 HydrophobicContact CB-CG 4.41Å; A111-V183 HydrophobicContact CB-CG1 4.25Å; A111-V183 HydrophobicContact CB-CG2 4.26Å; A111-I185 HydrophobicContact CB-CD1 4.32Å; A111-I185 VanDerWaalsContact O-CD1 3.31Å; A111-I185 WeakPolarHBondContact O-CD1 3.48Å
112	S	97.8	Very high	97.1	Very high	9 Å²	9	48 Å²	48	6%	0.063	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-64	-22.7	178.4	72.2	0	0	0	0	114.5	L110 R151 D156	L110-S112 VanDerWaalsContact C-N 3.29Å; L110-S112 PolarHBondContact O-N 3.24Å; S112-R151 WeakPolarHBondContact CB-O 3.41Å; S112-R151 WeakPolarHBondContact O-CD 3.48Å; S112-D156 WeakPolarHBondContact CB-OD1 3.23Å; S112-D156 VanDerWaalsContact CB-OD2 3.23Å; S112-D156 WeakPolarHBondContact CB-OD2 3.46Å; S112-D156 PolarHBondContact N-OD1 2.93Å; S112-D156 VanDerWaalsContact OG-CG 3.31Å; S112-D156 PolarHBondContact OG-OD1 3.27Å; S112-D156 PolarHBondContact OG-OD2 3.13Å
113	K	97.6	Very high	97.1	Very high	143 Å²	143	42.6 Å²	42.6	62%	0.622	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-90.7	-13.2	-179.2	-65.1	-176.6	179.2	179.9	0	112.7	Q109 L110 A111	Q109-K113 HydrophobicContact CG-CB 3.73Å; Q109-K113 PolarHBondContact NE2-O 2.78Å; L110-K113 HydrophobicContact CB-CD 4.45Å; L110-K113 HydrophobicContact CB-CG 4.41Å; L110-K113 PolarHBondContact O-N 3.15Å; A111-K113 PolarHBondContact O-N 3.42Å
114	L	97.2	Very high	97.2	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.068	22%	0.221	C	C	.	.	S	Bend	trans	-66.2	151.6	179.9	-63.8	178.6	0	0	0	112.1	F76 Q109 L110 A111 C118 Y120 I185	F76-L114 HydrophobicContact CE2-CD1 4.5Å; F76-L114 HydrophobicContact CE2-CD2 4.16Å; Q109-L114 HydrophobicContact CB-CD2 4.33Å; Q109-L114 HydrophobicContact CG-CD2 4.34Å; L110-L114 PolarHBondContact O-N 3.31Å; A111-L114 WeakPolarHBondContact O-CB 3.29Å; A111-L114 PolarHBondContact O-N 2.99Å; L114-C118 HydrophobicContact CB-CB 4.15Å; L114-C118 HydrophobicContact CD1-CB 4.2Å; L114-Y120 HydrophobicContact CD1-CD2 3.7Å; L114-Y120 HydrophobicContact CD1-CE2 3.59Å; L114-Y120 HydrophobicContact CD1-CG 4.48Å; L114-Y120 HydrophobicContact CD2-CE2 4.1Å; L114-Y120 HydrophobicContact CG-CE2 4.17Å; L114-I185 HydrophobicContact CB-CG1 4.05Å; L114-I185 HydrophobicContact CD1-CG1 4.04Å
115	S	96.2	Very high	97.4	Very high	71 Å²	71	42.8 Å²	42.8	50%	0.497	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-67.5	149.1	171.3	52.7	0	0	0	0	111.9	G117 C118	S115-G117 PolarHBondContact O-N 2.74Å; S115-C118 WeakPolarHBondContact O-CB 3.2Å; S115-C118 PolarHBondContact O-N 3.04Å; S115-C118 VanDerWaalsContact O-N 3.13Å; S115-C118 PolarHBondContact OG-SG 3.27Å
116	S	96.3	Very high	97.4	Very high	58 Å²	58	44.4 Å²	44.4	41%	0.406	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	134.2	172.8	-171.4	0	0	0	0	111	T187	S116-T187 PolarHBondContact OG-N 3.08Å; S116-T187 PolarHBondContact OG-OG1 2.65Å
117	G	95.6	Very high	97.5	Very high	11 Å²	11	41.1 Å²	41.1	11%	0.113	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	-0.5	-173.9	0	0	0	0	0	114.3	N79 S115 I185	N79-G117 VanDerWaalsContact CB-O 3.31Å; N79-G117 WeakPolarHBondContact CB-O 3.26Å; N79-G117 PolarHBondContact N-O 3.29Å; S115-G117 PolarHBondContact O-N 2.74Å; G117-I185 PolarHBondContact N-O 3.31Å
118	C	97.8	Very high	97.6	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.02	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	150.3	169.8	-62.7	0	0	0	0	112.1	F76 F77 L114 S115 I185 R186	F76-C118 HydrophobicContact CE2-CB 3.94Å; F76-C118 HydrophobicContact CZ-CB 4.13Å; F77-C118 CarbonylContact O-C 3.54Å; F77-C118 WeakPolarHBondContact O-CA 3.43Å; L114-C118 HydrophobicContact CB-CB 4.15Å; L114-C118 HydrophobicContact CD1-CB 4.2Å; S115-C118 WeakPolarHBondContact O-CB 3.2Å; S115-C118 PolarHBondContact O-N 3.04Å; S115-C118 VanDerWaalsContact O-N 3.13Å; S115-C118 PolarHBondContact OG-SG 3.27Å; C118-I185 WeakPolarHBondContact O-CB 3.42Å; C118-I185 WeakPolarHBondContact O-CG1 3.42Å; C118-I185 PolarHBondContact O-N 2.89Å; C118-R186 PolarHBondContact O-NH1 3.3Å
119	D	98.1	Very high	97.6	Very high	12 Å²	12	36.2 Å²	36.2	6%	0.064	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.9	174.3	-47.5	-45.5	0	0	0	110.6	F76 F77 V182 V183 N184 R186	F76-D119 WeakPolarHBondContact CD2-O 3.47Å; F77-D119 HydrophobicContact CB-CB 4.02Å; F77-D119 HydrophobicContact CD1-CB 4.37Å; F77-D119 WeakPolarHBondContact CD1-OD2 3.42Å; F77-D119 PolarHBondContact N-O 3.02Å; F77-D119 PolarHBondContact O-N 3.26Å; D119-V182 HydrophobicContact CB-CG1 4.41Å; D119-V183 WeakPolarHBondContact CA-O 3.29Å; D119-V183 WeakPolarHBondContact CB-O 3.46Å; D119-N184 WeakPolarHBondContact OD1-CA 3.47Å; D119-N184 WeakPolarHBondContact OD1-CB 3.26Å; D119-N184 PolarHBondContact OD1-ND2 3.08Å; D119-N184 PolarHBondContact OD2-ND2 3.39Å; D119-R186 VanDerWaalsContact CG-NH2 3.33Å; D119-R186 IonicContact OD1-CZ 3.4Å; D119-R186 IonicContact OD1-NH1 3.01Å; D119-R186 PolarHBondContact OD1-NH1 3.36Å; D119-R186 IonicContact OD1-NH2 2.68Å; D119-R186 PolarHBondContact OD1-NH2 2.85Å; D119-R186 IonicContact OD2-CZ 3.16Å; D119-R186 IonicContact OD2-NH1 2.62Å; D119-R186 IonicContact OD2-NH2 2.87Å; D119-R186 PolarHBondContact OD2-NH2 3.17Å
120	Y	98.7	Very high	97.4	Very high	17 Å²	17	32.4 Å²	32.4	7%	0.067	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	148.5	157.7	-76.7	-56.3	0	0	0	109.5	L74 W75 F76 I108 Q109 L114 V182 V183	L74-Y120 HydrophobicContact CD1-CD1 4.22Å; W75-Y120 WeakPolarHBondContact O-CA 3.28Å; F76-Y120 HydrophobicContact CB-CD1 4.27Å; F76-Y120 HydrophobicContact CB-CE1 4.2Å; F76-Y120 AromaticContact CD2-CD1 3.8Å; F76-Y120 HydrophobicContact CD2-CD1 3.8Å; F76-Y120 AromaticContact CD2-CE1 3.51Å; F76-Y120 HydrophobicContact CD2-CE1 3.51Å; F76-Y120 HydrophobicContact CE2-CE1 4.32Å; F76-Y120 HydrophobicContact CG-CE1 4.26Å; I108-Y120 HydrophobicContact CD1-CE2 4.45Å; Q109-Y120 VanDerWaalsContact O-CE2 3.25Å; Q109-Y120 WeakPolarHBondContact O-CE2 3.21Å; Q109-Y120 PolarHBondContact O-OH 3.25Å; L114-Y120 HydrophobicContact CD1-CD2 3.7Å; L114-Y120 HydrophobicContact CD1-CE2 3.59Å; L114-Y120 HydrophobicContact CD1-CG 4.48Å; L114-Y120 HydrophobicContact CD2-CE2 4.1Å; L114-Y120 HydrophobicContact CG-CE2 4.17Å; Y120-V182 CarbonylContact O-C 3.41Å; Y120-V182 WeakPolarHBondContact O-CA 3.36Å; Y120-V183 PolarHBondContact N-O 3.19Å; Y120-V183 PolarHBondContact O-N 2.72Å
121	A	98.6	Very high	97	Very high	5 Å²	5	35.7 Å²	35.7	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	128.3	172.2	0	0	0	0	0	110.6	L74 W75 F123 P129 A181 V182	L74-A121 CarbonylContact C-O 3.49Å; L74-A121 WeakPolarHBondContact CA-O 3.3Å; W75-A121 HydrophobicContact CB-CB 4.23Å; W75-A121 PolarHBondContact N-O 2.89Å; W75-A121 PolarHBondContact O-N 2.9Å; A121-F123 HydrophobicContact CB-CD2 3.9Å; A121-F123 HydrophobicContact CB-CE2 3.82Å; A121-P129 HydrophobicContact CB-CB 3.65Å; A121-P129 HydrophobicContact CB-CG 4.08Å; A121-A181 CarbonylContact C-O 3.54Å; A121-A181 WeakPolarHBondContact CA-O 3.38Å; A121-V182 HydrophobicContact CB-CG1 4.48Å; A121-V182 HydrophobicContact CB-CG2 3.95Å
122	L	98.8	Very high	96.7	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	113.9	171.8	-171.8	77	0	0	0	108.3	W72 A73 L74 L163 L166 I167 G180 A181	W72-L122 HydrophobicContact CB-CD1 3.83Å; W72-L122 HydrophobicContact CB-CD2 4.24Å; W72-L122 HydrophobicContact CB-CG 4.04Å; W72-L122 HydrophobicContact CD2-CD2 4.26Å; W72-L122 HydrophobicContact CD2-CG 4.45Å; W72-L122 HydrophobicContact CE3-CD2 4.13Å; W72-L122 HydrophobicContact CE3-CG 4.03Å; W72-L122 HydrophobicContact CG-CD2 4.31Å; W72-L122 HydrophobicContact CG-CG 4.48Å; A73-L122 WeakPolarHBondContact O-CA 3.49Å; L74-L122 HydrophobicContact CB-CD1 4.08Å; L74-L122 HydrophobicContact CD1-CD1 4.35Å; L122-L163 HydrophobicContact CB-CD2 3.69Å; L122-L163 HydrophobicContact CD2-CD2 3.7Å; L122-L163 HydrophobicContact CG-CD2 4.27Å; L122-L166 HydrophobicContact CD2-CD2 4.47Å; L122-I167 HydrophobicContact CD2-CG2 3.9Å; L122-G180 CarbonylContact O-C 3.44Å; L122-G180 WeakPolarHBondContact O-CA 3.02Å; L122-A181 PolarHBondContact N-O 3.02Å; L122-A181 PolarHBondContact O-N 3.34Å
123	F	98.8	Very high	96.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153.5	-177.4	-83.1	-113.5	0	0	0	110.3	W72 A73 A121 I127 P129 C179 A181 V182 W195	W72-F123 CarbonylContact C-O 3.53Å; W72-F123 WeakPolarHBondContact CA-O 3.43Å; W72-F123 VanDerWaalsContact CE3-C 3.47Å; A73-F123 PolarHBondContact N-O 3.21Å; A73-F123 PolarHBondContact O-N 3.17Å; A121-F123 HydrophobicContact CB-CD2 3.9Å; A121-F123 HydrophobicContact CB-CE2 3.82Å; F123-I127 WeakPolarHBondContact CB-O 3.12Å; F123-I127 HydrophobicContact CD1-CB 4.4Å; F123-I127 HydrophobicContact CD1-CG2 3.87Å; F123-P129 HydrophobicContact CD1-CB 4.38Å; F123-P129 HydrophobicContact CD2-CB 3.6Å; F123-P129 HydrophobicContact CE1-CB 4.26Å; F123-P129 HydrophobicContact CE2-CB 3.49Å; F123-P129 VanDerWaalsContact CE2-CB 3.49Å; F123-P129 HydrophobicContact CG-CB 4.07Å; F123-P129 HydrophobicContact CZ-CB 3.83Å; F123-C179 WeakPolarHBondContact CA-O 3.37Å; F123-C179 HydrophobicContact CD1-CB 4.13Å; F123-C179 HydrophobicContact CE1-CB 4.08Å; F123-A181 WeakPolarHBondContact CE2-O 3.1Å; F123-V182 HydrophobicContact CE2-CG2 3.59Å; F123-V182 HydrophobicContact CZ-CG2 3.9Å; F123-W195 HydrophobicContact CE1-CB 4.18Å; F123-W195 HydrophobicContact CE1-CD2 4.18Å; F123-W195 AromaticContact CE1-CE3 3.95Å; F123-W195 HydrophobicContact CE1-CE3 3.95Å; F123-W195 HydrophobicContact CE1-CG 4.31Å; F123-W195 HydrophobicContact CZ-CB 4.1Å; F123-W195 AromaticContact CZ-CD2 3.74Å; F123-W195 HydrophobicContact CZ-CD2 3.74Å; F123-W195 AromaticContact CZ-CE3 3.89Å; F123-W195 HydrophobicContact CZ-CE3 3.89Å; F123-W195 AromaticContact CZ-CG 3.84Å; F123-W195 HydrophobicContact CZ-CG 3.84Å
124	K	98.6	Very high	96.4	Very high	21 Å²	21	37.5 Å²	37.5	9%	0.091	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	145	172.8	-68.2	-178.8	177.2	173.6	0	109.7	N70 W72 G126 I127 S175 V178 C179	N70-K124 HydrophobicContact CB-CD 4.46Å; N70-K124 HydrophobicContact CB-CG 4.4Å; W72-K124 HydrophobicContact CD2-CG 4.33Å; W72-K124 HydrophobicContact CE3-CG 3.92Å; W72-K124 HydrophobicContact CH2-CD 4.27Å; W72-K124 HydrophobicContact CH2-CG 3.63Å; W72-K124 HydrophobicContact CZ2-CG 4.05Å; W72-K124 HydrophobicContact CZ3-CG 3.54Å; K124-G126 PolarHBondContact O-N 3.05Å; K124-I127 HydrophobicContact CB-CD1 4.03Å; K124-I127 HydrophobicContact CB-CG1 4.4Å; K124-I127 WeakPolarHBondContact O-CB 3.37Å; K124-I127 PolarHBondContact O-N 3.38Å; K124-S175 PolarHBondContact NZ-O 2.9Å; K124-V178 WeakPolarHBondContact CD-O 3.33Å; K124-V178 VanDerWaalsContact CE-O 3.29Å; K124-V178 WeakPolarHBondContact CE-O 3.37Å; K124-V178 PolarHBondContact NZ-O 3.34Å; K124-V178 VanDerWaalsContact NZ-O 3.15Å; K124-C179 PolarHBondContact N-O 3.09Å
125	D	98.1	Very high	96.4	Very high	58 Å²	58	42.3 Å²	42.3	31%	0.31	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	136.3	-179.3	-166.8	13.8	0	0	0	110.8	R71 K94 I127	R71-D125 HydrophobicContact CB-CB 3.95Å; R71-D125 WeakPolarHBondContact CD-OD2 3.32Å; R71-D125 HydrophobicContact CG-CB 3.96Å; R71-D125 IonicContact CZ-OD2 2.69Å; R71-D125 IonicContact NE-OD2 3.71Å; R71-D125 IonicContact NH1-OD2 3.69Å; R71-D125 PolarHBondContact NH1-OD2 2.88Å; R71-D125 PolarHBondContact O-N 2.77Å; K94-D125 VanDerWaalsContact CE-OD1 3.24Å; K94-D125 WeakPolarHBondContact CE-OD1 3.18Å; K94-D125 IonicContact NZ-OD1 3.25Å; K94-D125 PolarHBondContact NZ-OD1 3.37Å; K94-D125 IonicContact NZ-OD2 3.92Å; K94-D125 PolarHBondContact NZ-OD2 3.48Å; D125-I127 VanDerWaalsContact C-N 3.34Å
126	G	97.1	Very high	96.4	Very high	69 Å²	69	39 Å²	39	71%	0.711	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	7.6	-173.8	0	0	0	0	0	115.6	K124	K124-G126 PolarHBondContact O-N 3.05Å
127	I	98	Very high	96.4	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.067	22%	0.219	C	C	.	.			trans	-115.6	120	169.6	-49.1	-176.1	0	0	0	109.1	F123 K124 D125 R135 C179	F123-I127 WeakPolarHBondContact CB-O 3.12Å; F123-I127 HydrophobicContact CD1-CB 4.4Å; F123-I127 HydrophobicContact CD1-CG2 3.87Å; K124-I127 HydrophobicContact CB-CD1 4.03Å; K124-I127 HydrophobicContact CB-CG1 4.4Å; K124-I127 WeakPolarHBondContact O-CB 3.37Å; K124-I127 PolarHBondContact O-N 3.38Å; D125-I127 VanDerWaalsContact C-N 3.34Å; I127-R135 HydrophobicContact CD1-CB 4.08Å; I127-R135 HydrophobicContact CD1-CG 4.09Å; I127-R135 HydrophobicContact CG1-CB 4.31Å; I127-R135 HydrophobicContact CG1-CG 4.09Å; I127-R135 HydrophobicContact CG2-CB 4.03Å; I127-C179 HydrophobicContact CD1-CB 4.19Å; I127-C179 HydrophobicContact CG2-CB 4.29Å
128	E	96.9	Very high	96.4	Very high	87 Å²	87	49 Å²	49	41%	0.407	24%	0.242	S	C	.	.			trans	-81.8	142.6	175.2	-62.1	-173	136.8	0	0	110.4	W75 M130 D133 N136	W75-E128 HydrophobicContact CH2-CG 4.13Å; W75-E128 HydrophobicContact CZ2-CG 4.24Å; E128-M130 HydrophobicContact CB-CE 4.06Å; E128-M130 HydrophobicContact CB-CG 3.98Å; E128-M130 PolarHBondContact O-N 3.15Å; E128-D133 PolarHBondContact N-OD2 2.87Å; E128-N136 PolarHBondContact O-ND2 3.43Å
129	P	96.4	Very high	96.4	Very high	9 Å²	9	48.9 Å²	48.9	6%	0.058	24%	0.242	C	C	.	.	S	Bend	trans	-77.4	50.6	-178.8	34.6	-38.9	0	0	0	112.1	W75 L89 A121 F123	W75-P129 HydrophobicContact CB-CG 4.02Å; W75-P129 HydrophobicContact CD2-CG 3.98Å; W75-P129 HydrophobicContact CG-CG 3.73Å; L89-P129 HydrophobicContact CD1-CG 3.81Å; L89-P129 HydrophobicContact CD2-CG 3.66Å; L89-P129 HydrophobicContact CG-CG 4.27Å; A121-P129 HydrophobicContact CB-CB 3.65Å; A121-P129 HydrophobicContact CB-CG 4.08Å; F123-P129 HydrophobicContact CD1-CB 4.38Å; F123-P129 HydrophobicContact CD2-CB 3.6Å; F123-P129 HydrophobicContact CE1-CB 4.26Å; F123-P129 HydrophobicContact CE2-CB 3.49Å; F123-P129 VanDerWaalsContact CE2-CB 3.49Å; F123-P129 HydrophobicContact CG-CB 4.07Å; F123-P129 HydrophobicContact CZ-CB 3.83Å
130	M	93.6	Very high	96.4	Very high	21 Å²	21	48.3 Å²	48.3	10%	0.103	24%	0.239	C	C	.	.	S	Bend	trans	-136.1	155.3	-179.7	70.1	176.3	72.7	0	0	110.9	W85 L89 E128 E132 D133 N136	W85-M130 HydrophobicContact CH2-CB 4.06Å; W85-M130 HydrophobicContact CZ3-CB 3.94Å; W85-M130 HydrophobicContact CZ3-CE 4.35Å; L89-M130 HydrophobicContact CD2-CE 4.02Å; E128-M130 HydrophobicContact CB-CE 4.06Å; E128-M130 HydrophobicContact CB-CG 3.98Å; E128-M130 PolarHBondContact O-N 3.15Å; M130-E132 VanDerWaalsContact C-N 3.29Å; M130-E132 WeakPolarHBondContact CB-OE2 3.46Å; M130-E132 HydrophobicContact CG-CB 4.38Å; M130-E132 HydrophobicContact SD-CB 4.26Å; M130-D133 HydrophobicContact CG-CB 4.34Å; M130-D133 WeakPolarHBondContact O-CB 3.47Å; M130-D133 PolarHBondContact O-N 2.84Å; M130-N136 VanDerWaalsContact O-CB 3.31Å; M130-N136 WeakPolarHBondContact O-CB 3.27Å; M130-N136 PolarHBondContact O-ND2 3.12Å
131	W	88.8	Confident	96.3	Very high	125 Å²	125	49.3 Å²	49.3	47%	0.473	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-19.6	-173.8	57.9	-60.2	0	0	0	111.9	D133 K137 H229 A233	W131-D133 VanDerWaalsContact C-N 3.3Å; W131-K137 WeakPolarHBondContact O-CA 3.11Å; W131-K137 WeakPolarHBondContact O-CB 3.31Å; W131-K137 PolarHBondContact O-N 2.89Å; W131-H229 HydrophobicContact CB-CB 4.36Å; W131-A233 HydrophobicContact CD2-CB 3.8Å; W131-A233 HydrophobicContact CE3-CB 3.23Å; W131-A233 HydrophobicContact CH2-CB 3.54Å; W131-A233 HydrophobicContact CZ2-CB 4.07Å; W131-A233 HydrophobicContact CZ3-CB 3.09Å
132	E	91.8	Very high	96.3	Very high	89 Å²	89	49 Å²	49	42%	0.416	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-23.9	174.4	-60.6	87	164.5	0	0	112.6	M130 S134	M130-E132 VanDerWaalsContact C-N 3.29Å; M130-E132 WeakPolarHBondContact CB-OE2 3.46Å; M130-E132 HydrophobicContact CG-CB 4.38Å; M130-E132 HydrophobicContact SD-CB 4.26Å; E132-S134 PolarHBondContact O-N 2.9Å
133	D	94.5	Very high	96.3	Very high	18 Å²	18	49.7 Å²	49.7	10%	0.096	24%	0.244	C	C	.	.	S	Bend	trans	-57.1	134.5	177.4	-172.2	-63.3	0	0	0	110.2	E128 M130 W131 R135 N136 K137	E128-D133 PolarHBondContact N-OD2 2.87Å; M130-D133 HydrophobicContact CG-CB 4.34Å; M130-D133 WeakPolarHBondContact O-CB 3.47Å; M130-D133 PolarHBondContact O-N 2.84Å; W131-D133 VanDerWaalsContact C-N 3.3Å; D133-R135 PolarHBondContact O-N 2.78Å; D133-R135 VanDerWaalsContact OD1-CB 3.3Å; D133-R135 WeakPolarHBondContact OD1-CB 3.08Å; D133-R135 PolarHBondContact OD1-N 3.02Å; D133-N136 HydrophobicContact CB-CB 4.31Å; D133-N136 PolarHBondContact O-N 3.27Å; D133-K137 PolarHBondContact O-N 3.46Å
134	S	95.5	Very high	96.3	Very high	86 Å²	86	50.1 Å²	50.1	60%	0.601	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.1	-178.6	69.7	0	0	0	0	114.4	E132	E132-S134 PolarHBondContact O-N 2.9Å
135	R	96.3	Very high	96.2	Very high	114 Å²	114	52.8 Å²	52.8	43%	0.43	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-22.3	178.7	-64.3	-99.9	176.7	165.5	2.6	112.5	I127 D133 R197	I127-R135 HydrophobicContact CD1-CB 4.08Å; I127-R135 HydrophobicContact CD1-CG 4.09Å; I127-R135 HydrophobicContact CG1-CB 4.31Å; I127-R135 HydrophobicContact CG1-CG 4.09Å; I127-R135 HydrophobicContact CG2-CB 4.03Å; D133-R135 PolarHBondContact O-N 2.78Å; D133-R135 VanDerWaalsContact OD1-CB 3.3Å; D133-R135 WeakPolarHBondContact OD1-CB 3.08Å; D133-R135 PolarHBondContact OD1-N 3.02Å; R135-R197 WeakPolarHBondContact O-CA 3.5Å; R135-R197 VanDerWaalsContact O-CB 3.28Å; R135-R197 WeakPolarHBondContact O-CB 3.24Å
136	N	96.7	Very high	96.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-25.9	-177.1	-63.4	-27.4	0	0	0	113	E128 M130 D133 R138 G139 C179 W195 H229	E128-N136 PolarHBondContact O-ND2 3.43Å; M130-N136 VanDerWaalsContact O-CB 3.31Å; M130-N136 WeakPolarHBondContact O-CB 3.27Å; M130-N136 PolarHBondContact O-ND2 3.12Å; D133-N136 HydrophobicContact CB-CB 4.31Å; D133-N136 PolarHBondContact O-N 3.27Å; N136-R138 VanDerWaalsContact C-N 3.26Å; N136-R138 PolarHBondContact O-N 3.48Å; N136-R138 VanDerWaalsContact O-N 3.08Å; N136-G139 WeakPolarHBondContact O-CA 3.37Å; N136-G139 PolarHBondContact O-N 2.82Å; N136-C179 VanDerWaalsContact OD1-CB 3.3Å; N136-C179 WeakPolarHBondContact OD1-CB 3.43Å; N136-C179 PolarHBondContact OD1-SG 2.85Å; N136-W195 HydrophobicContact CB-CE3 4.17Å; N136-W195 HydrophobicContact CB-CZ3 4.21Å; N136-H229 PolarHBondContact O-CD2 3.49Å
137	K	94.9	Very high	96.1	Very high	117 Å²	117	49.3 Å²	49.3	51%	0.509	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-31	-171.5	68.6	-178.3	178.7	180	0	116.1	W131 D133	W131-K137 WeakPolarHBondContact O-CA 3.11Å; W131-K137 WeakPolarHBondContact O-CB 3.31Å; W131-K137 PolarHBondContact O-N 2.89Å; D133-K137 PolarHBondContact O-N 3.46Å
138	R	96.5	Very high	95.9	Very high	162 Å²	162	54.4 Å²	54.4	61%	0.611	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	1.5	175	-61.8	-160.2	-56.8	-114	-4.9	113.3	N136 R197 E198 A199	N136-R138 VanDerWaalsContact C-N 3.26Å; N136-R138 PolarHBondContact O-N 3.48Å; N136-R138 VanDerWaalsContact O-N 3.08Å; R138-R197 CarbonylContact C-O 3.49Å; R138-E198 IonicContact CZ-OE2 2.64Å; R138-E198 IonicContact NE-OE2 3.48Å; R138-E198 PolarHBondContact NE-OE2 3.2Å; R138-E198 IonicContact NH2-OE2 3.64Å; R138-E198 PolarHBondContact NH2-OE2 3.35Å; R138-A199 WeakPolarHBondContact O-CB 3.47Å; R138-A199 PolarHBondContact O-N 3.43Å
139	G	97.3	Very high	95.9	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.01	27%	0.274	C	S	.	.			trans	-87.6	-162.9	-174.5	0	0	0	0	0	113.8	N136 T196 R197 H229	N136-G139 WeakPolarHBondContact O-CA 3.37Å; N136-G139 PolarHBondContact O-N 2.82Å; G139-T196 CarbonylContact C-O 3.54Å; G139-T196 WeakPolarHBondContact CA-O 3.34Å; G139-R197 WeakPolarHBondContact CA-O 3.48Å; G139-R197 PolarHBondContact N-O 3.35Å; G139-H229 PolarHBondContact O-N 2.84Å
140	G	97.8	Very high	95.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	-172.8	176.9	0	0	0	0	0	110.4	W195 T196 Y226 Q227 H229	G140-W195 CarbonylContact O-C 3.55Å; G140-W195 WeakPolarHBondContact O-CA 3.43Å; G140-T196 PolarHBondContact N-O 3.2Å; G140-T196 VanDerWaalsContact N-O 3.09Å; G140-T196 PolarHBondContact O-N 2.82Å; G140-Y226 VanDerWaalsContact C-CZ 3.45Å; G140-Y226 VanDerWaalsContact C-OH 3.32Å; G140-Y226 VanDerWaalsContact CA-CZ 3.48Å; G140-Y226 WeakPolarHBondContact CA-OH 3.27Å; G140-Y226 PolarHBondContact N-OH 3.43Å; G140-Q227 CarbonylContact C-O 3.51Å; G140-Q227 WeakPolarHBondContact CA-O 3.36Å; G140-H229 VanDerWaalsContact CA-CD2 3.47Å; G140-H229 WeakPolarHBondContact CA-CD2 3.26Å; G140-H229 WeakPolarHBondContact CA-NE2 3.44Å; G140-H229 PolarHBondContact N-CD2 2.82Å; G140-H229 PolarHBondContact N-NE2 2.97Å; G140-H229 PolarHBondContact O-NE2 2.93Å
141	R	98.1	Very high	96	Very high	38 Å²	38	61 Å²	61	14%	0.143	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	139.6	-174.6	68	-174.3	-178.8	-175.9	-4.1	113.2	A193 V194 W195 Y226 Q227	R141-A193 HydrophobicContact CB-CB 4.16Å; R141-A193 HydrophobicContact CG-CB 4.33Å; R141-V194 CarbonylContact C-O 3.58Å; R141-V194 WeakPolarHBondContact CA-O 3.39Å; R141-W195 HydrophobicContact CB-CG 4.16Å; R141-Y226 VanDerWaalsContact C-CD2 3.4Å; R141-Y226 CarbonylContact O-C 3.6Å; R141-Y226 VanDerWaalsContact O-CA 3.27Å; R141-Y226 WeakPolarHBondContact O-CA 3.44Å; R141-Y226 WeakPolarHBondContact O-CD2 3.49Å; R141-Q227 HydrophobicContact CG-CB 4.47Å; R141-Q227 PolarHBondContact N-O 3.41Å; R141-Q227 PolarHBondContact O-N 3.02Å
142	W	98.6	Very high	96.4	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.1	160.6	-79.5	109.4	0	0	0	109.1	A193 V194 V205 G209 Y212 I224 G225 Y226 F244 V246	W142-A193 CarbonylContact O-C 3.45Å; W142-A193 WeakPolarHBondContact O-CA 3.4Å; W142-A193 WeakPolarHBondContact O-CB 3.44Å; W142-V194 PolarHBondContact N-O 3.4Å; W142-V194 PolarHBondContact O-N 2.81Å; W142-V194 VanDerWaalsContact O-N 3.12Å; W142-V205 HydrophobicContact CZ2-CG1 3.91Å; W142-V205 WeakPolarHBondContact CZ2-O 3.33Å; W142-V205 PolarHBondContact NE1-O 3.28Å; W142-G209 VanDerWaalsContact NE1-CA 3.28Å; W142-Y212 HydrophobicContact CB-CD1 4.29Å; W142-I224 HydrophobicContact CD2-CD1 4.41Å; W142-I224 HydrophobicContact CE3-CB 4.46Å; W142-I224 HydrophobicContact CE3-CD1 3.92Å; W142-I224 HydrophobicContact CE3-CG1 3.81Å; W142-I224 HydrophobicContact CZ3-CG1 4.07Å; W142-I224 WeakPolarHBondContact CZ3-O 3.29Å; W142-G225 VanDerWaalsContact CE3-C 3.43Å; W142-Y226 AromaticContact CD1-CD2 3.7Å; W142-Y226 AromaticContact CD2-CD2 3.89Å; W142-Y226 HydrophobicContact CD2-CD2 3.89Å; W142-Y226 HydrophobicContact CD2-CG 4.38Å; W142-Y226 AromaticContact CE2-CD2 3.75Å; W142-Y226 AromaticContact CG-CD2 3.85Å; W142-Y226 HydrophobicContact CG-CD2 3.85Å; W142-Y226 HydrophobicContact CZ2-CD2 4.39Å; W142-Y226 HydrophobicContact CZ2-CG 4.44Å; W142-Y226 VanDerWaalsContact CZ3-N 3.34Å; W142-Y226 AromaticContact NE1-CD2 3.64Å; W142-F244 HydrophobicContact CH2-CB 3.97Å; W142-F244 HydrophobicContact CZ2-CB 4.35Å; W142-V246 HydrophobicContact CE3-CG2 4.25Å; W142-V246 HydrophobicContact CH2-CB 4.2Å; W142-V246 HydrophobicContact CH2-CG1 3.71Å; W142-V246 HydrophobicContact CH2-CG2 3.72Å; W142-V246 HydrophobicContact CZ2-CG1 4.14Å; W142-V246 HydrophobicContact CZ2-CG2 4.29Å; W142-V246 HydrophobicContact CZ3-CB 4.49Å; W142-V246 HydrophobicContact CZ3-CG1 4.47Å; W142-V246 HydrophobicContact CZ3-CG2 3.69Å
143	L	97.9	Very high	96.6	Very high	15 Å²	15	63.7 Å²	63.7	8%	0.079	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.7	-174	-172.6	68.1	0	0	0	111.7	K191 A193 G225	L143-K191 HydrophobicContact CD1-CB 3.92Å; L143-K191 HydrophobicContact CD1-CD 4.13Å; L143-K191 HydrophobicContact CD1-CG 4.19Å; L143-K191 HydrophobicContact CD2-CD 4.48Å; L143-A193 HydrophobicContact CD1-CB 3.99Å; L143-G225 PolarHBondContact N-O 2.74Å
144	V	97.9	Very high	96.7	Very high	9 Å²	9	65.7 Å²	65.7	6%	0.055	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.6	167.5	-176.7	0	0	0	0	107.8	L146 K191 I192 Y212 L216 L218 I224	V144-L146 HydrophobicContact CG1-CD1 4.12Å; V144-K191 CarbonylContact O-C 3.56Å; V144-K191 VanDerWaalsContact O-CA 3.3Å; V144-K191 WeakPolarHBondContact O-CA 3.39Å; V144-I192 HydrophobicContact CB-CB 4.5Å; V144-I192 PolarHBondContact N-O 2.99Å; V144-I192 PolarHBondContact O-N 3.4Å; V144-Y212 HydrophobicContact CG2-CE1 3.88Å; V144-L216 HydrophobicContact CG2-CD1 3.8Å; V144-L218 HydrophobicContact CG2-CD1 4.39Å; V144-I224 HydrophobicContact CG2-CG2 4.04Å
145	S	96.8	Very high	96.9	Very high	77 Å²	77	61.6 Å²	61.6	54%	0.538	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.8	177.5	-61.1	0	0	0	0	110
146	L	96.7	Very high	97	Very high	9 Å²	9	57.7 Å²	57.7	5%	0.047	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	136.1	177.2	-72.4	92.3	0	0	0	110	V144 Q150 E154 L155 L158 G189 D190 I192	V144-L146 HydrophobicContact CG1-CD1 4.12Å; L146-Q150 HydrophobicContact CB-CB 4.38Å; L146-Q150 HydrophobicContact CD2-CB 4.06Å; L146-E154 HydrophobicContact CD2-CB 3.82Å; L146-L155 HydrophobicContact CD1-CD1 4.24Å; L146-L155 HydrophobicContact CD2-CB 4.32Å; L146-L155 HydrophobicContact CD2-CD1 4.33Å; L146-L158 HydrophobicContact CD1-CD1 4.09Å; L146-L158 HydrophobicContact CD2-CD1 3.9Å; L146-L158 HydrophobicContact CG-CD1 4.27Å; L146-G189 CarbonylContact O-C 3.5Å; L146-G189 WeakPolarHBondContact O-CA 3.49Å; L146-D190 HydrophobicContact CB-CB 4.38Å; L146-D190 PolarHBondContact N-O 2.81Å; L146-D190 PolarHBondContact O-N 3.25Å; L146-I192 HydrophobicContact CD1-CD1 4.27Å; L146-I192 HydrophobicContact CD1-CG1 4.43Å
147	A	96.7	Very high	97	Very high	45 Å²	45	63 Å²	63	37%	0.372	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	151.3	167.4	0	0	0	0	0	109.9	Q149 Q150	A147-Q149 PolarHBondContact O-N 2.83Å; A147-Q149 VanDerWaalsContact O-N 3.08Å; A147-Q150 HydrophobicContact CB-CG 4.42Å; A147-Q150 WeakPolarHBondContact O-CB 3.49Å; A147-Q150 PolarHBondContact O-N 3.16Å
148	K	94.6	Very high	97.2	Very high	120 Å²	120	57.7 Å²	57.7	52%	0.522	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-52.1	-37.1	-178.7	-176.3	-175.2	177.4	-175.4	0	112.7	Q150 R151	K148-Q150 PolarHBondContact O-N 3.09Å; K148-R151 VanDerWaalsContact O-CB 3.28Å; K148-R151 WeakPolarHBondContact O-CB 3.25Å; K148-R151 PolarHBondContact O-N 2.91Å
149	Q	96.3	Very high	97.3	Very high	149 Å²	149	50.2 Å²	50.2	70%	0.696	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-64.3	-26.2	180	-62.4	82.8	-11.9	0	0	112.6	A147 R151	A147-Q149 PolarHBondContact O-N 2.83Å; A147-Q149 VanDerWaalsContact O-N 3.08Å; Q149-R151 VanDerWaalsContact C-N 3.32Å
150	Q	96.3	Very high	97.4	Very high	82 Å²	82	52 Å²	52	38%	0.383	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-83.3	-8	179.6	-59.5	175.6	-72.9	0	0	112.6	L146 A147 K148 H152 I153 E154	L146-Q150 HydrophobicContact CB-CB 4.38Å; L146-Q150 HydrophobicContact CD2-CB 4.06Å; A147-Q150 HydrophobicContact CB-CG 4.42Å; A147-Q150 WeakPolarHBondContact O-CB 3.49Å; A147-Q150 PolarHBondContact O-N 3.16Å; K148-Q150 PolarHBondContact O-N 3.09Å; Q150-H152 PolarHBondContact O-N 3.49Å; Q150-I153 PolarHBondContact O-N 3.22Å; Q150-I153 VanDerWaalsContact O-N 3.07Å; Q150-E154 PolarHBondContact O-N 3.45Å
151	R	96.6	Very high	97.4	Very high	25 Å²	25	54 Å²	54	9%	0.094	27%	0.265	C	S	.	.	I	π-helix	trans	-53.8	-49.8	-176.3	177.1	173.4	-62.8	174.1	6.7	112.7	S112 K148 Q149 I153 L155 R186 D190	S112-R151 WeakPolarHBondContact CB-O 3.41Å; S112-R151 WeakPolarHBondContact O-CD 3.48Å; K148-R151 VanDerWaalsContact O-CB 3.28Å; K148-R151 WeakPolarHBondContact O-CB 3.25Å; K148-R151 PolarHBondContact O-N 2.91Å; Q149-R151 VanDerWaalsContact C-N 3.32Å; R151-I153 VanDerWaalsContact C-N 3.25Å; R151-I153 PolarHBondContact O-N 3.43Å; R151-L155 HydrophobicContact CG-CD2 3.95Å; R151-L155 WeakPolarHBondContact O-CB 3.44Å; R151-R186 PolarHBondContact NH2-O 2.88Å; R151-D190 IonicContact CZ-OD1 3.42Å; R151-D190 IonicContact CZ-OD2 3.38Å; R151-D190 IonicContact NE-OD1 3.54Å; R151-D190 IonicContact NE-OD2 2.72Å; R151-D190 PolarHBondContact NE-OD2 3.36Å; R151-D190 VanDerWaalsContact NH2-CG 3.29Å; R151-D190 IonicContact NH2-OD1 2.62Å; R151-D190 PolarHBondContact NH2-OD1 2.84Å; R151-D190 IonicContact NH2-OD2 3.19Å; R151-D190 PolarHBondContact NH2-OD2 2.86Å
152	H	96.1	Very high	97.5	Very high	146 Å²	146	52.2 Å²	52.2	68%	0.676	26%	0.258	S	S	*	.	I	π-helix	trans	-86.6	3.4	-176.3	-58.8	-63.1	0	0	0	113.2	Q150	Q150-H152 PolarHBondContact O-N 3.49Å
153	I	96.4	Very high	97.5	Very high	125 Å²	125	52.5 Å²	52.5	64%	0.641	26%	0.26	S	S	*	.	I	π-helix	trans	-111.6	-50.3	-176.9	-53.9	175.2	0	0	0	110.2	Q150 R151	Q150-I153 PolarHBondContact O-N 3.22Å; Q150-I153 VanDerWaalsContact O-N 3.07Å; R151-I153 VanDerWaalsContact C-N 3.25Å; R151-I153 PolarHBondContact O-N 3.43Å
154	E	97.3	Very high	97.5	Very high	59 Å²	59	54.1 Å²	54.1	28%	0.276	27%	0.268	S	S	.	.	I	π-helix	trans	-116.3	-26.9	-167.9	-69.1	-64.6	150.8	0	0	113.8	L146 Q150 D156 R157 L158	L146-E154 HydrophobicContact CD2-CB 3.82Å; Q150-E154 PolarHBondContact O-N 3.45Å; E154-D156 PolarHBondContact O-N 3.05Å; E154-R157 PolarHBondContact O-N 3Å; E154-R157 IonicContact OE2-CZ 3.25Å; E154-R157 VanDerWaalsContact OE2-CZ 3.31Å; E154-R157 IonicContact OE2-NE 3.91Å; E154-R157 PolarHBondContact OE2-NE 3.46Å; E154-R157 IonicContact OE2-NH2 3.31Å; E154-R157 PolarHBondContact OE2-NH2 2.86Å; E154-L158 HydrophobicContact CB-CD1 4.15Å; E154-L158 HydrophobicContact CB-CG 4.43Å; E154-L158 WeakPolarHBondContact O-CB 3.48Å; E154-L158 WeakPolarHBondContact O-CG 3.4Å; E154-L158 PolarHBondContact O-N 2.79Å
155	L	98.3	Very high	97.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.265	C	S	.	.	I	π-helix	trans	-61.2	-49.1	-164.9	-176.4	69	0	0	0	112.9	A111 L146 R151 R157 L158 W159 V183 I185 D190 I192	A111-L155 HydrophobicContact CB-CD2 4.16Å; A111-L155 HydrophobicContact CB-CG 4.37Å; L146-L155 HydrophobicContact CD1-CD1 4.24Å; L146-L155 HydrophobicContact CD2-CB 4.32Å; L146-L155 HydrophobicContact CD2-CD1 4.33Å; R151-L155 HydrophobicContact CG-CD2 3.95Å; R151-L155 WeakPolarHBondContact O-CB 3.44Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 2.94Å; L155-L158 PolarHBondContact O-N 2.84Å; L155-W159 VanDerWaalsContact O-CB 3.24Å; L155-W159 WeakPolarHBondContact O-CB 3.46Å; L155-W159 PolarHBondContact O-N 2.91Å; L155-V183 HydrophobicContact CD1-CG2 3.94Å; L155-I185 HydrophobicContact CD2-CD1 3.52Å; L155-D190 HydrophobicContact CD1-CB 3.85Å; L155-D190 HydrophobicContact CD2-CB 4.33Å; L155-I192 HydrophobicContact CD1-CD1 4.02Å; L155-I192 HydrophobicContact CD1-CG1 4.12Å
156	D	98.4	Very high	97.6	Very high	32 Å²	32	50.1 Å²	50.1	17%	0.171	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-37.9	-177.3	-65.1	-30	0	0	0	111.3	A111 S112 E154 W159 L160	A111-D156 PolarHBondContact N-OD1 3.49Å; S112-D156 WeakPolarHBondContact CB-OD1 3.23Å; S112-D156 VanDerWaalsContact CB-OD2 3.23Å; S112-D156 WeakPolarHBondContact CB-OD2 3.46Å; S112-D156 PolarHBondContact N-OD1 2.93Å; S112-D156 VanDerWaalsContact OG-CG 3.31Å; S112-D156 PolarHBondContact OG-OD1 3.27Å; S112-D156 PolarHBondContact OG-OD2 3.13Å; E154-D156 PolarHBondContact O-N 3.05Å; D156-W159 PolarHBondContact O-N 2.72Å; D156-L160 WeakPolarHBondContact O-CB 3.3Å; D156-L160 PolarHBondContact O-N 3.2Å
157	R	98.3	Very high	97.7	Very high	113 Å²	113	50.3 Å²	50.3	43%	0.426	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-51.7	175.3	-174	-168.7	71.3	79.9	-6.1	111.2	E154 L155 W159 L160 E161 L216	E154-R157 PolarHBondContact O-N 3Å; E154-R157 IonicContact OE2-CZ 3.25Å; E154-R157 VanDerWaalsContact OE2-CZ 3.31Å; E154-R157 IonicContact OE2-NE 3.91Å; E154-R157 PolarHBondContact OE2-NE 3.46Å; E154-R157 IonicContact OE2-NH2 3.31Å; E154-R157 PolarHBondContact OE2-NH2 2.86Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 2.94Å; R157-W159 VanDerWaalsContact C-N 3.31Å; R157-W159 PolarHBondContact O-N 2.69Å; R157-L160 PolarHBondContact O-N 3.09Å; R157-E161 WeakPolarHBondContact O-CB 3.48Å; R157-E161 PolarHBondContact O-N 2.75Å; R157-L216 PolarHBondContact NH1-O 3.5Å; R157-L216 VanDerWaalsContact NH1-O 3.09Å; R157-L216 PolarHBondContact NH2-O 2.83Å
158	L	98.6	Very high	97.8	Very high	5 Å²	5	50.7 Å²	50.7	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-65.6	-36.4	-179.7	-68.6	178.9	0	0	0	111.7	L146 E154 L155 T162 I192 L216 L218	L146-L158 HydrophobicContact CD1-CD1 4.09Å; L146-L158 HydrophobicContact CD2-CD1 3.9Å; L146-L158 HydrophobicContact CG-CD1 4.27Å; E154-L158 HydrophobicContact CB-CD1 4.15Å; E154-L158 HydrophobicContact CB-CG 4.43Å; E154-L158 WeakPolarHBondContact O-CB 3.48Å; E154-L158 WeakPolarHBondContact O-CG 3.4Å; E154-L158 PolarHBondContact O-N 2.79Å; L155-L158 PolarHBondContact O-N 2.84Å; L158-T162 WeakPolarHBondContact O-CB 3.3Å; L158-T162 PolarHBondContact O-N 2.91Å; L158-T162 PolarHBondContact O-OG1 2.85Å; L158-I192 HydrophobicContact CB-CD1 3.5Å; L158-L216 HydrophobicContact CB-CD2 4.43Å; L158-L216 HydrophobicContact CD2-CB 3.91Å; L158-L216 HydrophobicContact CD2-CD1 4.28Å; L158-L216 HydrophobicContact CD2-CD2 3.87Å; L158-L216 HydrophobicContact CD2-CG 4.22Å; L158-L218 HydrophobicContact CD2-CD2 4.22Å
159	W	98.8	Very high	97.9	Very high	4 Å²	4	46 Å²	46	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-66.3	-48.8	176.5	-179.3	-127.6	0	0	0	111.1	A111 L155 D156 R157 E161 T162 L163 A181 V183 I192	A111-W159 HydrophobicContact CB-CG 4.41Å; L155-W159 VanDerWaalsContact O-CB 3.24Å; L155-W159 WeakPolarHBondContact O-CB 3.46Å; L155-W159 PolarHBondContact O-N 2.91Å; D156-W159 PolarHBondContact O-N 2.72Å; R157-W159 VanDerWaalsContact C-N 3.31Å; R157-W159 PolarHBondContact O-N 2.69Å; W159-E161 PolarHBondContact O-N 2.82Å; W159-T162 HydrophobicContact CE3-CG2 4.39Å; W159-T162 HydrophobicContact CZ3-CG2 4.22Å; W159-T162 VanDerWaalsContact O-CB 3.31Å; W159-T162 WeakPolarHBondContact O-CB 3.37Å; W159-T162 PolarHBondContact O-N 2.76Å; W159-T162 VanDerWaalsContact O-N 3.13Å; W159-L163 HydrophobicContact CD2-CD2 4.39Å; W159-L163 HydrophobicContact CD2-CG 4.21Å; W159-L163 HydrophobicContact CH2-CD2 3.71Å; W159-L163 HydrophobicContact CZ2-CD1 4.37Å; W159-L163 HydrophobicContact CZ2-CD2 3.49Å; W159-L163 VanDerWaalsContact CZ2-CD2 3.49Å; W159-L163 HydrophobicContact CZ2-CG 4.13Å; W159-L163 HydrophobicContact CZ3-CD2 4.25Å; W159-L163 WeakPolarHBondContact O-CG 3.31Å; W159-L163 PolarHBondContact O-N 2.88Å; W159-A181 HydrophobicContact CH2-CB 4.18Å; W159-A181 HydrophobicContact CZ3-CB 3.87Å; W159-V183 HydrophobicContact CD2-CB 3.8Å; W159-V183 HydrophobicContact CD2-CG1 3.64Å; W159-V183 VanDerWaalsContact CE2-CG1 3.48Å; W159-V183 HydrophobicContact CE3-CB 3.73Å; W159-V183 HydrophobicContact CE3-CG1 4.01Å; W159-V183 HydrophobicContact CG-CB 4.33Å; W159-V183 HydrophobicContact CG-CG1 4.12Å; W159-V183 HydrophobicContact CH2-CB 4.36Å; W159-V183 HydrophobicContact CH2-CG1 4.11Å; W159-V183 HydrophobicContact CZ2-CB 4.41Å; W159-V183 HydrophobicContact CZ2-CG1 3.73Å; W159-V183 HydrophobicContact CZ3-CB 4.03Å; W159-V183 HydrophobicContact CZ3-CG1 4.24Å; W159-I192 HydrophobicContact CB-CD1 4.26Å; W159-I192 HydrophobicContact CE3-CG2 3.9Å; W159-I192 HydrophobicContact CZ3-CG2 4.19Å
160	L	98.6	Very high	98	Very high	39 Å²	39	40 Å²	40	20%	0.204	20%	0.204	C	C	.	.	H	α-helix	trans	-58.6	-47.5	175.7	180	56.8	0	0	0	111.9	F101 W102 Y105 D156 R157 T162 L163 L164	F101-L160 HydrophobicContact CZ-CD1 4.27Å; W102-L160 HydrophobicContact CH2-CD1 4.02Å; W102-L160 HydrophobicContact CH2-CD2 4.39Å; W102-L160 HydrophobicContact CZ3-CD1 4.08Å; Y105-L160 HydrophobicContact CD1-CD1 4.33Å; Y105-L160 HydrophobicContact CD2-CD1 4.23Å; Y105-L160 HydrophobicContact CE1-CD1 3.99Å; Y105-L160 HydrophobicContact CE1-CD2 4.17Å; Y105-L160 HydrophobicContact CE2-CB 4.45Å; Y105-L160 HydrophobicContact CE2-CD1 3.88Å; Y105-L160 HydrophobicContact CG-CD1 4.45Å; D156-L160 WeakPolarHBondContact O-CB 3.3Å; D156-L160 PolarHBondContact O-N 3.2Å; R157-L160 PolarHBondContact O-N 3.09Å; L160-T162 PolarHBondContact O-N 2.82Å; L160-L163 WeakPolarHBondContact O-CB 3.4Å; L160-L163 PolarHBondContact O-N 3.44Å; L160-L164 HydrophobicContact CD1-CD1 4.38Å; L160-L164 HydrophobicContact CD1-CD2 4.46Å; L160-L164 HydrophobicContact CD1-CG 4.15Å; L160-L164 HydrophobicContact CG-CD1 4.19Å; L160-L164 HydrophobicContact CG-CG 4.38Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 2.69Å
161	E	98.7	Very high	98.1	Very high	43 Å²	43	36.1 Å²	36.1	20%	0.201	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-35.3	177.8	-172.7	60.7	-147.6	0	0	111.7	R157 W159 L164 C165 R215 L216	R157-E161 WeakPolarHBondContact O-CB 3.48Å; R157-E161 PolarHBondContact O-N 2.75Å; W159-E161 PolarHBondContact O-N 2.82Å; E161-L164 PolarHBondContact O-N 3.25Å; E161-C165 WeakPolarHBondContact O-CB 3.31Å; E161-C165 PolarHBondContact O-N 3.04Å; E161-C165 PolarHBondContact O-SG 2.68Å; E161-R215 WeakPolarHBondContact CG-O 3.44Å; E161-R215 IonicContact OE1-CZ 2.94Å; E161-R215 IonicContact OE1-NE 3.17Å; E161-R215 PolarHBondContact OE1-NE 3.12Å; E161-R215 IonicContact OE1-NH2 3.68Å; E161-R215 PolarHBondContact OE1-NH2 3.48Å; E161-R215 VanDerWaalsContact OE1-NH2 3.17Å; E161-L216 HydrophobicContact CB-CD2 3.95Å; E161-L216 HydrophobicContact CG-CD2 3.98Å
162	T	98.8	Very high	98	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-47.6	172.9	-56.8	0	0	0	0	111	L158 W159 L160 L164 C165 L166 A181 I192 V194 Y212	L158-T162 WeakPolarHBondContact O-CB 3.3Å; L158-T162 PolarHBondContact O-N 2.91Å; L158-T162 PolarHBondContact O-OG1 2.85Å; W159-T162 HydrophobicContact CE3-CG2 4.39Å; W159-T162 HydrophobicContact CZ3-CG2 4.22Å; W159-T162 VanDerWaalsContact O-CB 3.31Å; W159-T162 WeakPolarHBondContact O-CB 3.37Å; W159-T162 PolarHBondContact O-N 2.76Å; W159-T162 VanDerWaalsContact O-N 3.13Å; L160-T162 PolarHBondContact O-N 2.82Å; T162-L164 VanDerWaalsContact C-N 3.32Å; T162-L164 PolarHBondContact O-N 3.09Å; T162-C165 WeakPolarHBondContact O-CB 3.15Å; T162-C165 PolarHBondContact O-N 3.32Å; T162-L166 HydrophobicContact CG2-CD1 4.18Å; T162-L166 VanDerWaalsContact O-CD1 3.23Å; T162-L166 WeakPolarHBondContact O-CD1 3.35Å; T162-L166 PolarHBondContact O-N 2.81Å; T162-L166 VanDerWaalsContact O-N 3.09Å; T162-A181 HydrophobicContact CG2-CB 3.62Å; T162-I192 HydrophobicContact CG2-CG2 4.11Å; T162-V194 HydrophobicContact CG2-CG2 3.73Å; T162-Y212 HydrophobicContact CG2-CE2 3.9Å; T162-Y212 WeakPolarHBondContact CG2-OH 3.27Å; T162-Y212 WeakPolarHBondContact OG1-CE2 3.41Å; T162-Y212 PolarHBondContact OG1-OH 2.85Å
163	L	98.8	Very high	98	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-43.4	177.1	-64.2	-179.7	0	0	0	111.7	F101 Y105 L122 W159 L160 C165 L166 I167	F101-L163 HydrophobicContact CE2-CB 3.93Å; F101-L163 HydrophobicContact CE2-CD1 4.1Å; F101-L163 HydrophobicContact CZ-CB 3.84Å; F101-L163 HydrophobicContact CZ-CD1 4.16Å; Y105-L163 HydrophobicContact CD2-CD1 3.92Å; Y105-L163 HydrophobicContact CE2-CD1 3.97Å; L122-L163 HydrophobicContact CB-CD2 3.69Å; L122-L163 HydrophobicContact CD2-CD2 3.7Å; L122-L163 HydrophobicContact CG-CD2 4.27Å; W159-L163 HydrophobicContact CD2-CD2 4.39Å; W159-L163 HydrophobicContact CD2-CG 4.21Å; W159-L163 HydrophobicContact CH2-CD2 3.71Å; W159-L163 HydrophobicContact CZ2-CD1 4.37Å; W159-L163 HydrophobicContact CZ2-CD2 3.49Å; W159-L163 VanDerWaalsContact CZ2-CD2 3.49Å; W159-L163 HydrophobicContact CZ2-CG 4.13Å; W159-L163 HydrophobicContact CZ3-CD2 4.25Å; W159-L163 WeakPolarHBondContact O-CG 3.31Å; W159-L163 PolarHBondContact O-N 2.88Å; L160-L163 WeakPolarHBondContact O-CB 3.4Å; L160-L163 PolarHBondContact O-N 3.44Å; L163-C165 VanDerWaalsContact C-N 3.35Å; L163-C165 PolarHBondContact O-N 3.4Å; L163-L166 WeakPolarHBondContact O-CB 3.45Å; L163-L166 PolarHBondContact O-N 2.88Å; L163-L166 VanDerWaalsContact O-N 3.16Å; L163-I167 PolarHBondContact O-N 3.42Å
164	L	98.7	Very high	98	Very high	48 Å²	48	35.7 Å²	35.7	25%	0.251	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-38.3	176.8	-65.5	178.7	0	0	0	112.1	F101 W102 L160 E161 T162 L166 I167 G168	F101-L164 HydrophobicContact CE1-CD2 3.96Å; F101-L164 HydrophobicContact CZ-CD2 4.39Å; W102-L164 HydrophobicContact CH2-CD2 4.22Å; W102-L164 HydrophobicContact CZ2-CD2 3.87Å; L160-L164 HydrophobicContact CD1-CD1 4.38Å; L160-L164 HydrophobicContact CD1-CD2 4.46Å; L160-L164 HydrophobicContact CD1-CG 4.15Å; L160-L164 HydrophobicContact CG-CD1 4.19Å; L160-L164 HydrophobicContact CG-CG 4.38Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 2.69Å; E161-L164 PolarHBondContact O-N 3.25Å; T162-L164 VanDerWaalsContact C-N 3.32Å; T162-L164 PolarHBondContact O-N 3.09Å; L164-L166 VanDerWaalsContact C-N 3.27Å; L164-L166 PolarHBondContact O-N 3.45Å; L164-I167 HydrophobicContact CD2-CD1 4.17Å; L164-G168 WeakPolarHBondContact O-CA 3.44Å; L164-G168 PolarHBondContact O-N 2.91Å
165	C	98.6	Very high	98	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-35.9	173.4	-72.1	0	0	0	0	112.8	E161 T162 L163 E169 S170 F171	E161-C165 WeakPolarHBondContact O-CB 3.31Å; E161-C165 PolarHBondContact O-N 3.04Å; E161-C165 PolarHBondContact O-SG 2.68Å; T162-C165 WeakPolarHBondContact O-CB 3.15Å; T162-C165 PolarHBondContact O-N 3.32Å; L163-C165 VanDerWaalsContact C-N 3.35Å; L163-C165 PolarHBondContact O-N 3.4Å; C165-E169 PolarHBondContact O-N 3.49Å; C165-S170 PolarHBondContact O-N 2.85Å; C165-F171 HydrophobicContact CB-CE2 4.23Å; C165-F171 HydrophobicContact CB-CZ 3.87Å
166	L	98.6	Very high	98	Very high	3 Å²	3	40 Å²	40	2%	0.016	20%	0.197	C	C	.	.	H	α-helix	trans	-70.3	-62.9	177.7	-93.1	62.2	0	0	0	110.8	W72 L122 T162 L163 L164 G168 E169 F171 V178 A181 V194	W72-L166 HydrophobicContact CE3-CD2 4.35Å; W72-L166 HydrophobicContact CH2-CB 3.66Å; W72-L166 HydrophobicContact CH2-CD2 4.1Å; W72-L166 HydrophobicContact CH2-CG 3.78Å; W72-L166 HydrophobicContact CZ2-CB 4.04Å; W72-L166 VanDerWaalsContact CZ2-O 3.25Å; W72-L166 WeakPolarHBondContact CZ2-O 3.09Å; W72-L166 HydrophobicContact CZ3-CB 3.99Å; W72-L166 HydrophobicContact CZ3-CD2 3.67Å; W72-L166 HydrophobicContact CZ3-CG 3.89Å; L122-L166 HydrophobicContact CD2-CD2 4.47Å; T162-L166 HydrophobicContact CG2-CD1 4.18Å; T162-L166 VanDerWaalsContact O-CD1 3.23Å; T162-L166 WeakPolarHBondContact O-CD1 3.35Å; T162-L166 PolarHBondContact O-N 2.81Å; T162-L166 VanDerWaalsContact O-N 3.09Å; L163-L166 WeakPolarHBondContact O-CB 3.45Å; L163-L166 PolarHBondContact O-N 2.88Å; L163-L166 VanDerWaalsContact O-N 3.16Å; L164-L166 VanDerWaalsContact C-N 3.27Å; L164-L166 PolarHBondContact O-N 3.45Å; L166-G168 PolarHBondContact O-N 2.76Å; L166-E169 PolarHBondContact O-N 2.94Å; L166-F171 HydrophobicContact CD1-CE2 4.29Å; L166-V178 HydrophobicContact CD1-CG1 4.37Å; L166-V178 HydrophobicContact CG-CG1 4.24Å; L166-A181 HydrophobicContact CD1-CB 4.11Å; L166-A181 HydrophobicContact CD2-CB 3.6Å; L166-V194 HydrophobicContact CD1-CG1 4.5Å; L166-V194 HydrophobicContact CD1-CG2 4.3Å
167	I	98.4	Very high	97.9	Very high	12 Å²	12	39.7 Å²	39.7	6%	0.062	19%	0.194	C	C	.	.	H	α-helix	trans	-67.4	-27.9	-173.5	71.8	179.7	0	0	0	112.6	L68 W72 F101 L122 L163 L164 E169	L68-I167 HydrophobicContact CD1-CB 4.11Å; L68-I167 HydrophobicContact CD1-CG2 4.28Å; L68-I167 HydrophobicContact CD2-CB 4.01Å; L68-I167 HydrophobicContact CD2-CG1 4.41Å; W72-I167 HydrophobicContact CD2-CG2 4.4Å; W72-I167 HydrophobicContact CG-CG2 4.21Å; F101-I167 HydrophobicContact CB-CD1 4.14Å; F101-I167 HydrophobicContact CD1-CD1 3.35Å; F101-I167 HydrophobicContact CD2-CD1 3.69Å; F101-I167 HydrophobicContact CD2-CG2 4.15Å; F101-I167 HydrophobicContact CE1-CD1 3.57Å; F101-I167 HydrophobicContact CE2-CD1 3.89Å; F101-I167 HydrophobicContact CE2-CG2 4.38Å; F101-I167 HydrophobicContact CG-CD1 3.41Å; F101-I167 VanDerWaalsContact CG-CD1 3.41Å; F101-I167 HydrophobicContact CZ-CD1 3.83Å; L122-I167 HydrophobicContact CD2-CG2 3.9Å; L163-I167 PolarHBondContact O-N 3.42Å; L164-I167 HydrophobicContact CD2-CD1 4.17Å; I167-E169 VanDerWaalsContact C-N 3.3Å
168	G	98.1	Very high	97.9	Very high	53 Å²	53	34.6 Å²	34.6	55%	0.546	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	0.2	175.7	0	0	0	0	0	114.1	L164 L166 S170	L164-G168 WeakPolarHBondContact O-CA 3.44Å; L164-G168 PolarHBondContact O-N 2.91Å; L166-G168 PolarHBondContact O-N 2.76Å; G168-S170 VanDerWaalsContact C-N 3.25Å; G168-S170 PolarHBondContact O-N 3.46Å
169	E	97.9	Very high	97.9	Very high	21 Å²	21	34.4 Å²	34.4	10%	0.098	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	41.9	179.3	-56.1	-77.6	138.3	0	0	113	Q69 N70 W72 C165 L166 I167 F171 E172 S175	Q69-E169 HydrophobicContact CB-CG 3.78Å; Q69-E169 HydrophobicContact CG-CG 4.17Å; Q69-E169 PolarHBondContact NE2-OE2 2.98Å; N70-E169 VanDerWaalsContact ND2-CD 3.28Å; N70-E169 PolarHBondContact ND2-OE1 3.2Å; N70-E169 PolarHBondContact ND2-OE2 3.07Å; W72-E169 WeakPolarHBondContact CZ2-OE1 3.35Å; C165-E169 PolarHBondContact O-N 3.49Å; L166-E169 PolarHBondContact O-N 2.94Å; I167-E169 VanDerWaalsContact C-N 3.3Å; E169-F171 PolarHBondContact O-N 2.9Å; E169-E172 PolarHBondContact O-N 3.47Å; E169-S175 PolarHBondContact O-OG 3.07Å; E169-S175 WeakPolarHBondContact OE2-CB 3.48Å
170	S	97.9	Very high	97.9	Very high	23 Å²	23	34.2 Å²	34.2	16%	0.161	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-5.4	-172.2	-67.3	0	0	0	0	115.3	C165 G168 V211 R215	C165-S170 PolarHBondContact O-N 2.85Å; G168-S170 VanDerWaalsContact C-N 3.25Å; G168-S170 PolarHBondContact O-N 3.46Å; S170-V211 WeakPolarHBondContact O-CG1 3.49Å; S170-R215 PolarHBondContact OG-NH1 3.43Å
171	F	97.9	Very high	97.9	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.009	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	17.6	179.9	-44.6	-73.2	0	0	0	113	C165 L166 E169 E173 H174 S175 V178 I208 V211	C165-F171 HydrophobicContact CB-CE2 4.23Å; C165-F171 HydrophobicContact CB-CZ 3.87Å; L166-F171 HydrophobicContact CD1-CE2 4.29Å; E169-F171 PolarHBondContact O-N 2.9Å; F171-E173 PolarHBondContact O-N 3.28Å; F171-H174 CarbonylContact O-C 3.46Å; F171-H174 WeakPolarHBondContact O-CA 3.05Å; F171-H174 WeakPolarHBondContact O-CB 3.41Å; F171-H174 PolarHBondContact O-N 3.39Å; F171-S175 WeakPolarHBondContact CA-OG 3.44Å; F171-S175 WeakPolarHBondContact CB-OG 3.2Å; F171-S175 PolarHBondContact N-OG 3.33Å; F171-S175 VanDerWaalsContact N-OG 3.07Å; F171-S175 PolarHBondContact O-N 2.89Å; F171-V178 HydrophobicContact CD2-CG2 3.59Å; F171-V178 HydrophobicContact CE2-CG2 3.85Å; F171-V178 HydrophobicContact CG-CG2 4.3Å; F171-I208 HydrophobicContact CB-CG1 4Å; F171-I208 HydrophobicContact CD1-CB 4.22Å; F171-I208 HydrophobicContact CD1-CG1 4.2Å; F171-I208 HydrophobicContact CD1-CG2 3.9Å; F171-I208 HydrophobicContact CE1-CG2 3.91Å; F171-I208 HydrophobicContact CG-CG1 4.12Å; F171-I208 HydrophobicContact CG-CG2 4.35Å; F171-I208 HydrophobicContact CZ-CG2 4.36Å; F171-V211 HydrophobicContact CD1-CB 4.17Å; F171-V211 HydrophobicContact CD1-CG1 4.01Å; F171-V211 HydrophobicContact CE1-CG1 4.36Å
172	E	94.9	Very high	97.9	Very high	141 Å²	141	30.9 Å²	30.9	66%	0.659	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	52.8	-128.8	173	-56.4	175	-174.2	0	0	112.1	E169 H174 S175	E169-E172 PolarHBondContact O-N 3.47Å; E172-H174 PolarHBondContact O-N 3.01Å; E172-H174 VanDerWaalsContact O-N 3.11Å; E172-S175 PolarHBondContact N-OG 3.35Å; E172-S175 WeakPolarHBondContact O-CB 3.42Å; E172-S175 PolarHBondContact O-N 2.84Å; E172-S175 PolarHBondContact O-OG 3.14Å
173	E	95.6	Very high	97.9	Very high	124 Å²	124	30.9 Å²	30.9	58%	0.579	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-61.1	-21	179.5	64.4	177.2	-167.9	0	0	113.7	F171 R176	F171-E173 PolarHBondContact O-N 3.28Å; E173-R176 WeakPolarHBondContact O-CG 3.39Å; E173-R176 VanDerWaalsContact O-CZ 3.29Å; E173-R176 PolarHBondContact O-NE 2.89Å; E173-R176 PolarHBondContact O-NH1 3.2Å
174	H	97.5	Very high	97.9	Very high	21 Å²	21	31.5 Å²	31.5	10%	0.097	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-91.7	-4	178.9	-61.4	-58.8	0	0	0	113.4	F171 E172 R176 E177 G204 H207 I208	F171-H174 CarbonylContact O-C 3.46Å; F171-H174 WeakPolarHBondContact O-CA 3.05Å; F171-H174 WeakPolarHBondContact O-CB 3.41Å; F171-H174 PolarHBondContact O-N 3.39Å; E172-H174 PolarHBondContact O-N 3.01Å; E172-H174 VanDerWaalsContact O-N 3.11Å; H174-R176 PolarHBondContact O-N 3.32Å; H174-R176 VanDerWaalsContact O-N 3.12Å; H174-E177 VanDerWaalsContact O-CB 3.29Å; H174-E177 WeakPolarHBondContact O-CB 3.09Å; H174-E177 PolarHBondContact O-N 2.87Å; H174-G204 WeakPolarHBondContact ND1-CA 3.45Å; H174-H207 AromaticContact CD2-CD2 3.42Å; H174-H207 PolarHBondContact CD2-CD2 3.18Å; H174-H207 VanDerWaalsContact CD2-CD2 3.42Å; H174-H207 AromaticContact CD2-CG 3.36Å; H174-H207 AromaticContact CD2-ND1 3.93Å; H174-H207 AromaticContact NE2-CG 3.99Å; H174-I208 HydrophobicContact CB-CD1 4.11Å; H174-I208 HydrophobicContact CB-CG1 3.95Å
175	S	97.6	Very high	97.9	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.014	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-59.5	-25.8	175.1	-63.1	0	0	0	0	112.7	K124 E169 F171 E172 E177 V178	K124-S175 PolarHBondContact NZ-O 2.9Å; E169-S175 PolarHBondContact O-OG 3.07Å; E169-S175 WeakPolarHBondContact OE2-CB 3.48Å; F171-S175 WeakPolarHBondContact CA-OG 3.44Å; F171-S175 WeakPolarHBondContact CB-OG 3.2Å; F171-S175 PolarHBondContact N-OG 3.33Å; F171-S175 VanDerWaalsContact N-OG 3.07Å; F171-S175 PolarHBondContact O-N 2.89Å; E172-S175 PolarHBondContact N-OG 3.35Å; E172-S175 WeakPolarHBondContact O-CB 3.42Å; E172-S175 PolarHBondContact O-N 2.84Å; E172-S175 PolarHBondContact O-OG 3.14Å; S175-E177 PolarHBondContact O-N 2.62Å; S175-V178 PolarHBondContact O-N 3.03Å
176	R	96.5	Very high	97.8	Very high	149 Å²	149	33.1 Å²	33.1	56%	0.562	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-63.9	-22.7	171.5	71.4	-175.6	179.1	-122.3	5.5	114.3	E173 H174	E173-R176 WeakPolarHBondContact O-CG 3.39Å; E173-R176 VanDerWaalsContact O-CZ 3.29Å; E173-R176 PolarHBondContact O-NE 2.89Å; E173-R176 PolarHBondContact O-NH1 3.2Å; H174-R176 PolarHBondContact O-N 3.32Å; H174-R176 VanDerWaalsContact O-N 3.12Å
177	E	97.8	Very high	97.6	Very high	25 Å²	25	37.7 Å²	37.7	12%	0.117	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-82.6	-18.8	178.7	-56.4	-58.5	145.3	0	0	111.9	H174 S175 T196 R197 I208	H174-E177 VanDerWaalsContact O-CB 3.29Å; H174-E177 WeakPolarHBondContact O-CB 3.09Å; H174-E177 PolarHBondContact O-N 2.87Å; S175-E177 PolarHBondContact O-N 2.62Å; E177-T196 CarbonylContact O-C 3.58Å; E177-T196 WeakPolarHBondContact O-CA 3.47Å; E177-T196 WeakPolarHBondContact O-CB 3.28Å; E177-R197 HydrophobicContact CB-CG 4.49Å; E177-R197 PolarHBondContact O-N 3.45Å; E177-R197 VanDerWaalsContact OE2-CD 3.32Å; E177-R197 WeakPolarHBondContact OE2-CD 3.4Å; E177-R197 WeakPolarHBondContact OE2-CG 3.31Å; E177-I208 HydrophobicContact CB-CD1 4.02Å
178	V	98.5	Very high	97.4	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.03	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	127.2	178.4	178.8	0	0	0	0	110.3	K124 L166 F171 S175 V194 I208	K124-V178 WeakPolarHBondContact CD-O 3.33Å; K124-V178 VanDerWaalsContact CE-O 3.29Å; K124-V178 WeakPolarHBondContact CE-O 3.37Å; K124-V178 PolarHBondContact NZ-O 3.34Å; K124-V178 VanDerWaalsContact NZ-O 3.15Å; L166-V178 HydrophobicContact CD1-CG1 4.37Å; L166-V178 HydrophobicContact CG-CG1 4.24Å; F171-V178 HydrophobicContact CD2-CG2 3.59Å; F171-V178 HydrophobicContact CE2-CG2 3.85Å; F171-V178 HydrophobicContact CG-CG2 4.3Å; S175-V178 PolarHBondContact O-N 3.03Å; V178-V194 HydrophobicContact CG1-CG1 4.01Å; V178-V194 HydrophobicContact CG2-CG1 4.39Å; V178-I208 HydrophobicContact CG2-CD1 3.91Å; V178-I208 HydrophobicContact CG2-CG1 4.43Å; V178-I208 HydrophobicContact CG2-CG2 4.46Å
179	C	98.6	Very high	97.3	Very high	2 Å²	2	45 Å²	45	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-42.5	173.8	-66.6	0	0	0	0	111.7	F123 K124 I127 N136 W195	F123-C179 WeakPolarHBondContact CA-O 3.37Å; F123-C179 HydrophobicContact CD1-CB 4.13Å; F123-C179 HydrophobicContact CE1-CB 4.08Å; K124-C179 PolarHBondContact N-O 3.09Å; I127-C179 HydrophobicContact CD1-CB 4.19Å; I127-C179 HydrophobicContact CG2-CB 4.29Å; N136-C179 VanDerWaalsContact OD1-CB 3.3Å; N136-C179 WeakPolarHBondContact OD1-CB 3.43Å; N136-C179 PolarHBondContact OD1-SG 2.85Å; C179-W195 HydrophobicContact CB-CB 4.37Å; C179-W195 PolarHBondContact N-O 2.89Å
180	G	98.7	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.5	-171.2	-172.3	0	0	0	0	0	112.8	L122 W195	L122-G180 CarbonylContact O-C 3.44Å; L122-G180 WeakPolarHBondContact O-CA 3.02Å; G180-W195 PolarHBondContact O-N 3.46Å
181	A	98.8	Very high	97.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	152.8	176.9	0	0	0	0	0	111.3	A121 L122 F123 W159 T162 L166 A193 V194	A121-A181 CarbonylContact C-O 3.54Å; A121-A181 WeakPolarHBondContact CA-O 3.38Å; L122-A181 PolarHBondContact N-O 3.02Å; L122-A181 PolarHBondContact O-N 3.34Å; F123-A181 WeakPolarHBondContact CE2-O 3.1Å; W159-A181 HydrophobicContact CH2-CB 4.18Å; W159-A181 HydrophobicContact CZ3-CB 3.87Å; T162-A181 HydrophobicContact CG2-CB 3.62Å; L166-A181 HydrophobicContact CD1-CB 4.11Å; L166-A181 HydrophobicContact CD2-CB 3.6Å; A181-A193 CarbonylContact C-O 3.52Å; A181-A193 WeakPolarHBondContact CA-O 3.49Å; A181-A193 WeakPolarHBondContact CB-O 3.36Å; A181-V194 HydrophobicContact CB-CG2 4.25Å
182	V	98.7	Very high	97.3	Very high	12 Å²	12	46.2 Å²	46.2	7%	0.073	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.8	-179.9	-174.2	0	0	0	0	109.3	D119 Y120 A121 F123 N184 I192 A193 W195	D119-V182 HydrophobicContact CB-CG1 4.41Å; Y120-V182 CarbonylContact O-C 3.41Å; Y120-V182 WeakPolarHBondContact O-CA 3.36Å; A121-V182 HydrophobicContact CB-CG1 4.48Å; A121-V182 HydrophobicContact CB-CG2 3.95Å; F123-V182 HydrophobicContact CE2-CG2 3.59Å; F123-V182 HydrophobicContact CZ-CG2 3.9Å; V182-N184 WeakPolarHBondContact CG1-ND2 3.3Å; V182-I192 CarbonylContact O-C 3.51Å; V182-I192 WeakPolarHBondContact O-CA 3.33Å; V182-A193 PolarHBondContact N-O 2.62Å; V182-A193 PolarHBondContact O-N 2.93Å; V182-W195 HydrophobicContact CG2-CZ2 4.23Å
183	V	98.8	Very high	97.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.1	163.4	59.1	0	0	0	0	109.6	A111 D119 Y120 L155 W159 I185 K191 I192	A111-V183 HydrophobicContact CB-CG1 4.25Å; A111-V183 HydrophobicContact CB-CG2 4.26Å; D119-V183 WeakPolarHBondContact CA-O 3.29Å; D119-V183 WeakPolarHBondContact CB-O 3.46Å; Y120-V183 PolarHBondContact N-O 3.19Å; Y120-V183 PolarHBondContact O-N 2.72Å; L155-V183 HydrophobicContact CD1-CG2 3.94Å; W159-V183 HydrophobicContact CD2-CB 3.8Å; W159-V183 HydrophobicContact CD2-CG1 3.64Å; W159-V183 VanDerWaalsContact CE2-CG1 3.48Å; W159-V183 HydrophobicContact CE3-CB 3.73Å; W159-V183 HydrophobicContact CE3-CG1 4.01Å; W159-V183 HydrophobicContact CG-CB 4.33Å; W159-V183 HydrophobicContact CG-CG1 4.12Å; W159-V183 HydrophobicContact CH2-CB 4.36Å; W159-V183 HydrophobicContact CH2-CG1 4.11Å; W159-V183 HydrophobicContact CZ2-CB 4.41Å; W159-V183 HydrophobicContact CZ2-CG1 3.73Å; W159-V183 HydrophobicContact CZ3-CB 4.03Å; W159-V183 HydrophobicContact CZ3-CG1 4.24Å; V183-I185 HydrophobicContact CG2-CD1 3.96Å; V183-K191 CarbonylContact C-O 3.58Å; V183-K191 WeakPolarHBondContact CA-O 3.48Å; V183-I192 HydrophobicContact CB-CG1 4.29Å; V183-I192 HydrophobicContact CG2-CG1 3.96Å
184	N	98.3	Very high	97.6	Very high	19 Å²	19	33.6 Å²	33.6	10%	0.102	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.1	179.9	-55.8	123.9	0	0	0	111.8	D119 V182 R186 D190 K191	D119-N184 WeakPolarHBondContact OD1-CA 3.47Å; D119-N184 WeakPolarHBondContact OD1-CB 3.26Å; D119-N184 PolarHBondContact OD1-ND2 3.08Å; D119-N184 PolarHBondContact OD2-ND2 3.39Å; V182-N184 WeakPolarHBondContact CG1-ND2 3.3Å; N184-R186 HydrophobicContact CB-CG 4.49Å; N184-D190 WeakPolarHBondContact O-CA 3.43Å; N184-K191 HydrophobicContact CB-CB 4.28Å; N184-K191 PolarHBondContact N-O 2.99Å; N184-K191 PolarHBondContact O-N 2.79Å; N184-K191 VanDerWaalsContact O-N 3.09Å
185	I	98.2	Very high	97.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.155	C	C	.	.			trans	-95.8	113.9	178.4	-49	-57.1	0	0	0	109.1	A111 L114 G117 C118 L155 V183 D190	A111-I185 HydrophobicContact CB-CD1 4.32Å; A111-I185 VanDerWaalsContact O-CD1 3.31Å; A111-I185 WeakPolarHBondContact O-CD1 3.48Å; L114-I185 HydrophobicContact CB-CG1 4.05Å; L114-I185 HydrophobicContact CD1-CG1 4.04Å; G117-I185 PolarHBondContact N-O 3.31Å; C118-I185 WeakPolarHBondContact O-CB 3.42Å; C118-I185 WeakPolarHBondContact O-CG1 3.42Å; C118-I185 PolarHBondContact O-N 2.89Å; L155-I185 HydrophobicContact CD2-CD1 3.52Å; V183-I185 HydrophobicContact CG2-CD1 3.96Å; I185-D190 WeakPolarHBondContact CA-OD1 3.15Å
186	R	96.4	Very high	97.7	Very high	82 Å²	82	33.5 Å²	33.5	31%	0.309	15%	0.154	S	C	.	.			trans	-134.9	157.6	-175.8	-57.9	-71.2	179.1	-83.3	-1.4	112	C118 D119 R151 N184 K188 G189 D190	C118-R186 PolarHBondContact O-NH1 3.3Å; D119-R186 VanDerWaalsContact CG-NH2 3.33Å; D119-R186 IonicContact OD1-CZ 3.4Å; D119-R186 IonicContact OD1-NH1 3.01Å; D119-R186 PolarHBondContact OD1-NH1 3.36Å; D119-R186 IonicContact OD1-NH2 2.68Å; D119-R186 PolarHBondContact OD1-NH2 2.85Å; D119-R186 IonicContact OD2-CZ 3.16Å; D119-R186 IonicContact OD2-NH1 2.62Å; D119-R186 IonicContact OD2-NH2 2.87Å; D119-R186 PolarHBondContact OD2-NH2 3.17Å; R151-R186 PolarHBondContact NH2-O 2.88Å; N184-R186 HydrophobicContact CB-CG 4.49Å; R186-K188 VanDerWaalsContact C-N 3.28Å; R186-K188 PolarHBondContact O-N 3.41Å; R186-G189 WeakPolarHBondContact CB-O 3.24Å; R186-G189 PolarHBondContact O-N 3.06Å; R186-D190 PolarHBondContact N-OD1 3.45Å
187	T	94.5	Very high	97.8	Very high	98 Å²	98	30.4 Å²	30.4	60%	0.601	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-32.4	-175.1	-50.8	0	0	0	0	112.9	S116	S116-T187 PolarHBondContact OG-N 3.08Å; S116-T187 PolarHBondContact OG-OG1 2.65Å
188	K	93.8	Very high	97.8	Very high	206 Å²	206	31.5 Å²	31.5	90%	0.896	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-13.7	-176.8	-66.4	-174.1	177.6	-178	0	114	R186	R186-K188 VanDerWaalsContact C-N 3.28Å; R186-K188 PolarHBondContact O-N 3.41Å
189	G	96.1	Very high	97.7	Very high	14 Å²	14	31.4 Å²	31.4	14%	0.144	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.3	154.2	-171.4	0	0	0	0	0	110.8	L146 R186	L146-G189 CarbonylContact O-C 3.5Å; L146-G189 WeakPolarHBondContact O-CA 3.49Å; R186-G189 WeakPolarHBondContact CB-O 3.24Å; R186-G189 PolarHBondContact O-N 3.06Å
190	D	97.9	Very high	97.6	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	159.9	-171.5	-57.4	-44	0	0	0	111.3	L146 R151 L155 N184 I185 R186	L146-D190 HydrophobicContact CB-CB 4.38Å; L146-D190 PolarHBondContact N-O 2.81Å; L146-D190 PolarHBondContact O-N 3.25Å; R151-D190 IonicContact CZ-OD1 3.42Å; R151-D190 IonicContact CZ-OD2 3.38Å; R151-D190 IonicContact NE-OD1 3.54Å; R151-D190 IonicContact NE-OD2 2.72Å; R151-D190 PolarHBondContact NE-OD2 3.36Å; R151-D190 VanDerWaalsContact NH2-CG 3.29Å; R151-D190 IonicContact NH2-OD1 2.62Å; R151-D190 PolarHBondContact NH2-OD1 2.84Å; R151-D190 IonicContact NH2-OD2 3.19Å; R151-D190 PolarHBondContact NH2-OD2 2.86Å; L155-D190 HydrophobicContact CD1-CB 3.85Å; L155-D190 HydrophobicContact CD2-CB 4.33Å; N184-D190 WeakPolarHBondContact O-CA 3.43Å; I185-D190 WeakPolarHBondContact CA-OD1 3.15Å; R186-D190 PolarHBondContact N-OD1 3.45Å
191	K	98.1	Very high	97.5	Very high	69 Å²	69	39.7 Å²	39.7	30%	0.3	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	137.5	178.9	-67.4	173.1	179	-176.8	0	109.6	L143 V144 V183 N184	L143-K191 HydrophobicContact CD1-CB 3.92Å; L143-K191 HydrophobicContact CD1-CD 4.13Å; L143-K191 HydrophobicContact CD1-CG 4.19Å; L143-K191 HydrophobicContact CD2-CD 4.48Å; V144-K191 CarbonylContact O-C 3.56Å; V144-K191 VanDerWaalsContact O-CA 3.3Å; V144-K191 WeakPolarHBondContact O-CA 3.39Å; V183-K191 CarbonylContact C-O 3.58Å; V183-K191 WeakPolarHBondContact CA-O 3.48Å; N184-K191 HydrophobicContact CB-CB 4.28Å; N184-K191 PolarHBondContact N-O 2.99Å; N184-K191 PolarHBondContact O-N 2.79Å; N184-K191 VanDerWaalsContact O-N 3.09Å
192	I	98.7	Very high	97.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.2	165.7	-58.3	168.2	0	0	0	106.8	V144 L146 L155 L158 W159 T162 V182 V183 Y212	V144-I192 HydrophobicContact CB-CB 4.5Å; V144-I192 PolarHBondContact N-O 2.99Å; V144-I192 PolarHBondContact O-N 3.4Å; L146-I192 HydrophobicContact CD1-CD1 4.27Å; L146-I192 HydrophobicContact CD1-CG1 4.43Å; L155-I192 HydrophobicContact CD1-CD1 4.02Å; L155-I192 HydrophobicContact CD1-CG1 4.12Å; L158-I192 HydrophobicContact CB-CD1 3.5Å; W159-I192 HydrophobicContact CB-CD1 4.26Å; W159-I192 HydrophobicContact CE3-CG2 3.9Å; W159-I192 HydrophobicContact CZ3-CG2 4.19Å; T162-I192 HydrophobicContact CG2-CG2 4.11Å; V182-I192 CarbonylContact O-C 3.51Å; V182-I192 WeakPolarHBondContact O-CA 3.33Å; V183-I192 HydrophobicContact CB-CG1 4.29Å; V183-I192 HydrophobicContact CG2-CG1 3.96Å; I192-Y212 VanDerWaalsContact CG2-OH 3.28Å; I192-Y212 WeakPolarHBondContact CG2-OH 3.25Å
193	A	98.5	Very high	97.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	132.6	-179.4	0	0	0	0	0	113	R141 W142 L143 A181 V182	R141-A193 HydrophobicContact CB-CB 4.16Å; R141-A193 HydrophobicContact CG-CB 4.33Å; W142-A193 CarbonylContact O-C 3.45Å; W142-A193 WeakPolarHBondContact O-CA 3.4Å; W142-A193 WeakPolarHBondContact O-CB 3.44Å; L143-A193 HydrophobicContact CD1-CB 3.99Å; A181-A193 CarbonylContact C-O 3.52Å; A181-A193 WeakPolarHBondContact CA-O 3.49Å; A181-A193 WeakPolarHBondContact CB-O 3.36Å; V182-A193 PolarHBondContact N-O 2.62Å; V182-A193 PolarHBondContact O-N 2.93Å
194	V	98.8	Very high	97.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.4	170.1	175.7	0	0	0	0	108.5	R141 W142 T162 L166 V178 A181 I208 Y212	R141-V194 CarbonylContact C-O 3.58Å; R141-V194 WeakPolarHBondContact CA-O 3.39Å; W142-V194 PolarHBondContact N-O 3.4Å; W142-V194 PolarHBondContact O-N 2.81Å; W142-V194 VanDerWaalsContact O-N 3.12Å; T162-V194 HydrophobicContact CG2-CG2 3.73Å; L166-V194 HydrophobicContact CD1-CG1 4.5Å; L166-V194 HydrophobicContact CD1-CG2 4.3Å; V178-V194 HydrophobicContact CG1-CG1 4.01Å; V178-V194 HydrophobicContact CG2-CG1 4.39Å; A181-V194 HydrophobicContact CB-CG2 4.25Å; V194-I208 HydrophobicContact CG1-CG2 4.49Å; V194-Y212 HydrophobicContact CB-CE1 4.43Å; V194-Y212 HydrophobicContact CG2-CD1 4.12Å; V194-Y212 HydrophobicContact CG2-CD2 4.16Å; V194-Y212 HydrophobicContact CG2-CE1 3.7Å; V194-Y212 HydrophobicContact CG2-CE2 3.76Å; V194-Y212 HydrophobicContact CG2-CG 4.33Å
195	W	98.6	Very high	97.3	Very high	21 Å²	21	47 Å²	47	8%	0.08	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	134.8	-176.4	-71.1	39.2	0	0	0	110.2	F123 N136 G140 R141 C179 G180 V182 H229	F123-W195 HydrophobicContact CE1-CB 4.18Å; F123-W195 HydrophobicContact CE1-CD2 4.18Å; F123-W195 AromaticContact CE1-CE3 3.95Å; F123-W195 HydrophobicContact CE1-CE3 3.95Å; F123-W195 HydrophobicContact CE1-CG 4.31Å; F123-W195 HydrophobicContact CZ-CB 4.1Å; F123-W195 AromaticContact CZ-CD2 3.74Å; F123-W195 HydrophobicContact CZ-CD2 3.74Å; F123-W195 AromaticContact CZ-CE3 3.89Å; F123-W195 HydrophobicContact CZ-CE3 3.89Å; F123-W195 AromaticContact CZ-CG 3.84Å; F123-W195 HydrophobicContact CZ-CG 3.84Å; N136-W195 HydrophobicContact CB-CE3 4.17Å; N136-W195 HydrophobicContact CB-CZ3 4.21Å; G140-W195 CarbonylContact O-C 3.55Å; G140-W195 WeakPolarHBondContact O-CA 3.43Å; R141-W195 HydrophobicContact CB-CG 4.16Å; C179-W195 HydrophobicContact CB-CB 4.37Å; C179-W195 PolarHBondContact N-O 2.89Å; G180-W195 PolarHBondContact O-N 3.46Å; V182-W195 HydrophobicContact CG2-CZ2 4.23Å; W195-H229 AromaticContact CD2-CE1 3.3Å; W195-H229 AromaticContact CD2-NE2 3.4Å; W195-H229 AromaticContact CE2-CE1 3.54Å; W195-H229 AromaticContact CE3-CE1 3.35Å; W195-H229 AromaticContact CE3-NE2 3.17Å; W195-H229 AromaticContact CG-CE1 3.93Å; W195-H229 AromaticContact CG-NE2 3.88Å; W195-H229 AromaticContact CH2-CE1 3.85Å; W195-H229 AromaticContact CZ2-CE1 3.81Å; W195-H229 AromaticContact CZ3-CE1 3.62Å; W195-H229 AromaticContact CZ3-NE2 3.72Å
196	T	98.6	Very high	97.3	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	153.4	176.5	72.4	0	0	0	0	110.4	G139 G140 E177 I208 Y226	G139-T196 CarbonylContact C-O 3.54Å; G139-T196 WeakPolarHBondContact CA-O 3.34Å; G140-T196 PolarHBondContact N-O 3.2Å; G140-T196 VanDerWaalsContact N-O 3.09Å; G140-T196 PolarHBondContact O-N 2.82Å; E177-T196 CarbonylContact O-C 3.58Å; E177-T196 WeakPolarHBondContact O-CA 3.47Å; E177-T196 WeakPolarHBondContact O-CB 3.28Å; T196-I208 HydrophobicContact CG2-CD1 3.79Å; T196-I208 HydrophobicContact CG2-CG2 4.37Å; T196-Y226 HydrophobicContact CG2-CE2 4.41Å; T196-Y226 WeakPolarHBondContact OG1-CE2 3.42Å; T196-Y226 PolarHBondContact OG1-OH 2.55Å
197	R	97.4	Very high	97.4	Very high	84 Å²	84	46.7 Å²	46.7	32%	0.317	24%	0.235	S	C	.	.	S	Bend	trans	-78.3	-24.9	-168.5	69.9	-171.1	-49.5	-161.6	-2.2	116.4	R135 R138 G139 E177	R135-R197 WeakPolarHBondContact O-CA 3.5Å; R135-R197 VanDerWaalsContact O-CB 3.28Å; R135-R197 WeakPolarHBondContact O-CB 3.24Å; R138-R197 CarbonylContact C-O 3.49Å; G139-R197 WeakPolarHBondContact CA-O 3.48Å; G139-R197 PolarHBondContact N-O 3.35Å; E177-R197 HydrophobicContact CB-CG 4.49Å; E177-R197 PolarHBondContact O-N 3.45Å; E177-R197 VanDerWaalsContact OE2-CD 3.32Å; E177-R197 WeakPolarHBondContact OE2-CD 3.4Å; E177-R197 WeakPolarHBondContact OE2-CG 3.31Å
198	E	97.1	Very high	97.6	Very high	47 Å²	47	42 Å²	42	22%	0.22	21%	0.206	C	C	.	.			trans	-138.2	108.6	-174.3	-172.8	54	-104.3	0	0	109.9	R138 E200 N201	R138-E198 IonicContact CZ-OE2 2.64Å; R138-E198 IonicContact NE-OE2 3.48Å; R138-E198 PolarHBondContact NE-OE2 3.2Å; R138-E198 IonicContact NH2-OE2 3.64Å; R138-E198 PolarHBondContact NH2-OE2 3.35Å; E198-E200 VanDerWaalsContact C-N 3.27Å; E198-E200 PolarHBondContact O-N 2.83Å; E198-E200 PolarHBondContact OE1-N 2.76Å; E198-N201 HydrophobicContact CB-CB 4.29Å; E198-N201 HydrophobicContact CG-CB 4.19Å; E198-N201 PolarHBondContact O-N 3.25Å
199	A	96.7	Very high	97.8	Very high	3 Å²	3	32.2 Å²	32.2	3%	0.025	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-22.6	-177.8	0	0	0	0	0	112.6	R138 Y226 A228 K243 F244	R138-A199 WeakPolarHBondContact O-CB 3.47Å; R138-A199 PolarHBondContact O-N 3.43Å; A199-Y226 WeakPolarHBondContact CA-OH 3.33Å; A199-Y226 HydrophobicContact CB-CE1 3.91Å; A199-A228 HydrophobicContact CB-CB 4.17Å; A199-K243 VanDerWaalsContact O-CE 3.31Å; A199-K243 WeakPolarHBondContact O-CE 3.22Å; A199-F244 WeakPolarHBondContact O-CE2 3.44Å
200	E	96.6	Very high	98	Very high	126 Å²	126	38.6 Å²	38.6	59%	0.589	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.5	179.6	-57.8	-52.2	140.2	0	0	113.2	E198 Q202 K243	E198-E200 VanDerWaalsContact C-N 3.27Å; E198-E200 PolarHBondContact O-N 2.83Å; E198-E200 PolarHBondContact OE1-N 2.76Å; E200-Q202 PolarHBondContact O-N 3.11Å; E200-K243 WeakPolarHBondContact OE1-CE 3.46Å; E200-K243 IonicContact OE1-NZ 2.7Å; E200-K243 PolarHBondContact OE1-NZ 3.44Å; E200-K243 WeakPolarHBondContact OE2-CE 3.16Å; E200-K243 IonicContact OE2-NZ 3.86Å; E200-K243 PolarHBondContact OE2-NZ 3.07Å
201	N	96.1	Very high	98	Very high	51 Å²	51	39.7 Å²	39.7	27%	0.273	19%	0.19	S	C	.	.			trans	-75.5	71.9	172.1	-176.5	2.3	0	0	0	110.7	E198 A203 G204 V205	E198-N201 HydrophobicContact CB-CB 4.29Å; E198-N201 HydrophobicContact CG-CB 4.19Å; E198-N201 PolarHBondContact O-N 3.25Å; N201-A203 VanDerWaalsContact C-N 3.28Å; N201-A203 PolarHBondContact O-N 3.16Å; N201-G204 PolarHBondContact O-N 3.24Å; N201-G204 PolarHBondContact OD1-N 2.92Å; N201-V205 WeakPolarHBondContact O-CB 3.32Å; N201-V205 VanDerWaalsContact O-CG2 3.3Å; N201-V205 WeakPolarHBondContact O-CG2 3.41Å; N201-V205 PolarHBondContact O-N 3.43Å
202	Q	97.2	Very high	98	Very high	115 Å²	115	36.4 Å²	36.4	54%	0.537	18%	0.176	S	C	.	.	H	α-helix	trans	-53.8	-43.3	-174.9	176.5	174.3	-36.7	0	0	112.7	E200 L206 F244	E200-Q202 PolarHBondContact O-N 3.11Å; Q202-L206 HydrophobicContact CG-CD1 3.63Å; Q202-L206 HydrophobicContact CG-CG 4.23Å; Q202-L206 VanDerWaalsContact O-CB 3.31Å; Q202-L206 WeakPolarHBondContact O-CB 3.41Å; Q202-L206 VanDerWaalsContact O-CG 3.29Å; Q202-L206 WeakPolarHBondContact O-CG 3.21Å; Q202-L206 PolarHBondContact O-N 3.25Å; Q202-F244 HydrophobicContact CB-CE1 4.11Å; Q202-F244 HydrophobicContact CB-CZ 3.81Å; Q202-F244 HydrophobicContact CG-CD1 4.36Å; Q202-F244 HydrophobicContact CG-CE1 3.6Å; Q202-F244 HydrophobicContact CG-CZ 3.83Å
203	A	97.6	Very high	98	Very high	66 Å²	66	37.5 Å²	37.5	55%	0.545	18%	0.18	S	C	.	.	H	α-helix	trans	-61.1	-51.5	-179	0	0	0	0	0	111.4	N201 H207	N201-A203 VanDerWaalsContact C-N 3.28Å; N201-A203 PolarHBondContact O-N 3.16Å; A203-H207 WeakPolarHBondContact O-CB 3.4Å; A203-H207 PolarHBondContact O-N 2.83Å
204	G	97.9	Very high	98	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.5	-43	178.7	0	0	0	0	0	112.7	H174 N201 L206 H207 I208	H174-G204 WeakPolarHBondContact ND1-CA 3.45Å; N201-G204 PolarHBondContact O-N 3.24Å; N201-G204 PolarHBondContact OD1-N 2.92Å; G204-L206 PolarHBondContact O-N 2.85Å; G204-H207 PolarHBondContact O-N 3.23Å; G204-I208 WeakPolarHBondContact O-CB 3.17Å; G204-I208 WeakPolarHBondContact O-CD1 3.23Å; G204-I208 VanDerWaalsContact O-CG1 3.26Å; G204-I208 WeakPolarHBondContact O-CG1 3.27Å; G204-I208 PolarHBondContact O-N 3.24Å
205	V	98.4	Very high	97.9	Very high	2 Å²	2	50 Å²	50	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-46.7	178.6	170.7	0	0	0	0	111.3	W142 N201 I208 G209 Y226 F244	W142-V205 HydrophobicContact CZ2-CG1 3.91Å; W142-V205 WeakPolarHBondContact CZ2-O 3.33Å; W142-V205 PolarHBondContact NE1-O 3.28Å; N201-V205 WeakPolarHBondContact O-CB 3.32Å; N201-V205 VanDerWaalsContact O-CG2 3.3Å; N201-V205 WeakPolarHBondContact O-CG2 3.41Å; N201-V205 PolarHBondContact O-N 3.43Å; V205-I208 PolarHBondContact O-N 3.13Å; V205-G209 PolarHBondContact O-N 3.18Å; V205-Y226 HydrophobicContact CG1-CD1 3.85Å; V205-Y226 HydrophobicContact CG1-CD2 3.45Å; V205-Y226 VanDerWaalsContact CG1-CD2 3.45Å; V205-Y226 HydrophobicContact CG1-CE1 3.98Å; V205-Y226 HydrophobicContact CG1-CE2 3.59Å; V205-Y226 HydrophobicContact CG1-CG 3.57Å; V205-Y226 HydrophobicContact CG2-CE1 4.37Å; V205-Y226 HydrophobicContact CG2-CE2 4.15Å; V205-F244 HydrophobicContact CB-CD2 4.35Å; V205-F244 HydrophobicContact CB-CE2 4.35Å; V205-F244 HydrophobicContact CG1-CD2 3.56Å; V205-F244 HydrophobicContact CG1-CE2 4Å; V205-F244 HydrophobicContact CG1-CG 4.46Å
206	L	98.5	Very high	97.9	Very high	41 Å²	41	49 Å²	49	22%	0.215	23%	0.23	C	C	.	.	H	α-helix	trans	-69.2	-34.3	178.6	-72.5	174.4	0	0	0	112.9	Q202 G204 R210 F244 V246	Q202-L206 HydrophobicContact CG-CD1 3.63Å; Q202-L206 HydrophobicContact CG-CG 4.23Å; Q202-L206 VanDerWaalsContact O-CB 3.31Å; Q202-L206 WeakPolarHBondContact O-CB 3.41Å; Q202-L206 VanDerWaalsContact O-CG 3.29Å; Q202-L206 WeakPolarHBondContact O-CG 3.21Å; Q202-L206 PolarHBondContact O-N 3.25Å; G204-L206 PolarHBondContact O-N 2.85Å; L206-R210 WeakPolarHBondContact O-CG 3.19Å; L206-R210 PolarHBondContact O-N 3.21Å; L206-R210 VanDerWaalsContact O-N 3.14Å; L206-R210 PolarHBondContact O-NE 2.88Å; L206-R210 VanDerWaalsContact O-NE 3.16Å; L206-F244 HydrophobicContact CD2-CB 3.87Å; L206-F244 HydrophobicContact CD2-CD1 4.33Å; L206-F244 HydrophobicContact CD2-CG 4.21Å; L206-V246 HydrophobicContact CD2-CG1 3.94Å
207	H	98.6	Very high	97.8	Very high	36 Å²	36	51.8 Å²	51.8	17%	0.167	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-53.5	173.2	177.9	101.8	0	0	0	110.5	H174 A203 G204 G209 R210 V211	H174-H207 AromaticContact CD2-CD2 3.42Å; H174-H207 PolarHBondContact CD2-CD2 3.18Å; H174-H207 VanDerWaalsContact CD2-CD2 3.42Å; H174-H207 AromaticContact CD2-CG 3.36Å; H174-H207 AromaticContact CD2-ND1 3.93Å; H174-H207 AromaticContact NE2-CG 3.99Å; A203-H207 WeakPolarHBondContact O-CB 3.4Å; A203-H207 PolarHBondContact O-N 2.83Å; G204-H207 PolarHBondContact O-N 3.23Å; H207-G209 VanDerWaalsContact C-N 3.26Å; H207-G209 PolarHBondContact O-N 2.87Å; H207-R210 PolarHBondContact O-N 2.99Å; H207-R210 VanDerWaalsContact O-N 3.16Å; H207-V211 PolarHBondContact O-N 2.83Å
208	I	98.8	Very high	97.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-54.5	-45.2	178	-69.9	164.1	0	0	0	110.6	F171 H174 E177 V178 V194 T196 G204 V205 R210 Y212	F171-I208 HydrophobicContact CB-CG1 4Å; F171-I208 HydrophobicContact CD1-CB 4.22Å; F171-I208 HydrophobicContact CD1-CG1 4.2Å; F171-I208 HydrophobicContact CD1-CG2 3.9Å; F171-I208 HydrophobicContact CE1-CG2 3.91Å; F171-I208 HydrophobicContact CG-CG1 4.12Å; F171-I208 HydrophobicContact CG-CG2 4.35Å; F171-I208 HydrophobicContact CZ-CG2 4.36Å; H174-I208 HydrophobicContact CB-CD1 4.11Å; H174-I208 HydrophobicContact CB-CG1 3.95Å; E177-I208 HydrophobicContact CB-CD1 4.02Å; V178-I208 HydrophobicContact CG2-CD1 3.91Å; V178-I208 HydrophobicContact CG2-CG1 4.43Å; V178-I208 HydrophobicContact CG2-CG2 4.46Å; V194-I208 HydrophobicContact CG1-CG2 4.49Å; T196-I208 HydrophobicContact CG2-CD1 3.79Å; T196-I208 HydrophobicContact CG2-CG2 4.37Å; G204-I208 WeakPolarHBondContact O-CB 3.17Å; G204-I208 WeakPolarHBondContact O-CD1 3.23Å; G204-I208 VanDerWaalsContact O-CG1 3.26Å; G204-I208 WeakPolarHBondContact O-CG1 3.27Å; G204-I208 PolarHBondContact O-N 3.24Å; V205-I208 PolarHBondContact O-N 3.13Å; I208-R210 PolarHBondContact O-N 2.77Å; I208-Y212 WeakPolarHBondContact O-CB 3.34Å; I208-Y212 PolarHBondContact O-N 3.41Å
209	G	98.4	Very high	97.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-46.1	179.8	0	0	0	0	0	113.2	W142 V205 H207 Y212 K213	W142-G209 VanDerWaalsContact NE1-CA 3.28Å; V205-G209 PolarHBondContact O-N 3.18Å; H207-G209 VanDerWaalsContact C-N 3.26Å; H207-G209 PolarHBondContact O-N 2.87Å; G209-Y212 PolarHBondContact O-N 2.97Å; G209-K213 WeakPolarHBondContact O-CB 3.23Å; G209-K213 PolarHBondContact O-N 2.83Å
210	R	98.4	Very high	97.4	Very high	148 Å²	148	55.4 Å²	55.4	56%	0.558	30%	0.297	S	S	*	.	H	α-helix	trans	-63.9	-51	179.8	-76.6	-179.3	-74.8	165	-3.4	111.6	L206 H207 I208 Y212 K213 E214 V246	L206-R210 WeakPolarHBondContact O-CG 3.19Å; L206-R210 PolarHBondContact O-N 3.21Å; L206-R210 VanDerWaalsContact O-N 3.14Å; L206-R210 PolarHBondContact O-NE 2.88Å; L206-R210 VanDerWaalsContact O-NE 3.16Å; H207-R210 PolarHBondContact O-N 2.99Å; H207-R210 VanDerWaalsContact O-N 3.16Å; I208-R210 PolarHBondContact O-N 2.77Å; R210-Y212 VanDerWaalsContact C-N 3.31Å; R210-Y212 PolarHBondContact O-N 2.82Å; R210-K213 PolarHBondContact O-N 2.92Å; R210-E214 WeakPolarHBondContact O-CB 3.36Å; R210-E214 PolarHBondContact O-N 3.18Å; R210-V246 HydrophobicContact CG-CB 4.21Å; R210-V246 HydrophobicContact CG-CG1 3.86Å
211	V	98.4	Very high	97.3	Very high	24 Å²	24	58.5 Å²	58.5	15%	0.145	31%	0.308	C	S	.	.	H	α-helix	trans	-59.6	-45.4	177.1	174.5	0	0	0	0	110	S170 F171 H207 K213 E214 R215	S170-V211 WeakPolarHBondContact O-CG1 3.49Å; F171-V211 HydrophobicContact CD1-CB 4.17Å; F171-V211 HydrophobicContact CD1-CG1 4.01Å; F171-V211 HydrophobicContact CE1-CG1 4.36Å; H207-V211 PolarHBondContact O-N 2.83Å; V211-K213 PolarHBondContact O-N 3.16Å; V211-E214 PolarHBondContact O-N 3.18Å; V211-R215 HydrophobicContact CG1-CG 3.99Å; V211-R215 WeakPolarHBondContact O-CB 3.37Å; V211-R215 WeakPolarHBondContact O-CG 3.35Å; V211-R215 PolarHBondContact O-N 2.81Å
212	Y	98.6	Very high	97.2	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-47.3	179.5	-174.4	-135.5	0	0	0	112.3	W142 V144 T162 I192 V194 I208 G209 R210 E214 R215 L216 I224	W142-Y212 HydrophobicContact CB-CD1 4.29Å; V144-Y212 HydrophobicContact CG2-CE1 3.88Å; T162-Y212 HydrophobicContact CG2-CE2 3.9Å; T162-Y212 WeakPolarHBondContact CG2-OH 3.27Å; T162-Y212 WeakPolarHBondContact OG1-CE2 3.41Å; T162-Y212 PolarHBondContact OG1-OH 2.85Å; I192-Y212 VanDerWaalsContact CG2-OH 3.28Å; I192-Y212 WeakPolarHBondContact CG2-OH 3.25Å; V194-Y212 HydrophobicContact CB-CE1 4.43Å; V194-Y212 HydrophobicContact CG2-CD1 4.12Å; V194-Y212 HydrophobicContact CG2-CD2 4.16Å; V194-Y212 HydrophobicContact CG2-CE1 3.7Å; V194-Y212 HydrophobicContact CG2-CE2 3.76Å; V194-Y212 HydrophobicContact CG2-CG 4.33Å; I208-Y212 WeakPolarHBondContact O-CB 3.34Å; I208-Y212 PolarHBondContact O-N 3.41Å; G209-Y212 PolarHBondContact O-N 2.97Å; R210-Y212 VanDerWaalsContact C-N 3.31Å; R210-Y212 PolarHBondContact O-N 2.82Å; Y212-E214 VanDerWaalsContact C-N 3.3Å; Y212-E214 PolarHBondContact O-N 2.73Å; Y212-R215 PolarHBondContact O-N 3.1Å; Y212-L216 HydrophobicContact CD1-CD1 4.34Å; Y212-L216 HydrophobicContact CD2-CD1 4.2Å; Y212-L216 HydrophobicContact CD2-CD2 4.42Å; Y212-L216 HydrophobicContact CD2-CG 4Å; Y212-L216 HydrophobicContact CE1-CD1 3.85Å; Y212-L216 HydrophobicContact CE2-CD1 3.69Å; Y212-L216 HydrophobicContact CE2-CD2 3.76Å; Y212-L216 HydrophobicContact CE2-CG 3.68Å; Y212-L216 HydrophobicContact CG-CD1 4.49Å; Y212-L216 VanDerWaalsContact CZ-CD1 3.5Å; Y212-L216 WeakPolarHBondContact O-CB 3.18Å; Y212-L216 VanDerWaalsContact O-CG 3.31Å; Y212-L216 WeakPolarHBondContact O-CG 3.31Å; Y212-L216 PolarHBondContact O-N 3.19Å; Y212-I224 HydrophobicContact CD1-CD1 4.22Å
213	K	98.3	Very high	97.2	Very high	23 Å²	23	59.3 Å²	59.3	10%	0.1	32%	0.318	C	S	.	.	H	α-helix	trans	-58.1	-43.1	176.8	177.1	174.9	166.9	171.5	0	111.9	G209 R210 V211 L218 P220 T222 I224 V246	G209-K213 WeakPolarHBondContact O-CB 3.23Å; G209-K213 PolarHBondContact O-N 2.83Å; R210-K213 PolarHBondContact O-N 2.92Å; V211-K213 PolarHBondContact O-N 3.16Å; K213-L218 HydrophobicContact CG-CB 4.15Å; K213-L218 HydrophobicContact CG-CD1 4.4Å; K213-L218 PolarHBondContact O-N 3.04Å; K213-P220 PolarHBondContact NZ-O 2.65Å; K213-T222 WeakPolarHBondContact CE-O 3.48Å; K213-T222 PolarHBondContact NZ-O 3.08Å; K213-I224 HydrophobicContact CB-CD1 3.98Å; K213-V246 HydrophobicContact CD-CG2 4.37Å; K213-V246 WeakPolarHBondContact CD-OXT 3.5Å; K213-V246 PolarHBondContact NZ-O 3.38Å; K213-V246 PolarHBondContact NZ-OXT 3.14Å
214	E	97.9	Very high	97.2	Very high	150 Å²	150	56.4 Å²	56.4	70%	0.701	29%	0.293	S	S	*	.	H	α-helix	trans	-65	-49.5	177.3	-179.2	175.9	-168.4	0	0	111.8	R210 V211 Y212 L216 G217	R210-E214 WeakPolarHBondContact O-CB 3.36Å; R210-E214 PolarHBondContact O-N 3.18Å; V211-E214 PolarHBondContact O-N 3.18Å; Y212-E214 VanDerWaalsContact C-N 3.3Å; Y212-E214 PolarHBondContact O-N 2.73Å; E214-L216 VanDerWaalsContact C-N 3.31Å; E214-L216 PolarHBondContact O-N 3.34Å; E214-G217 WeakPolarHBondContact O-CA 3.34Å; E214-G217 PolarHBondContact O-N 2.92Å
215	R	98	Very high	97.2	Very high	111 Å²	111	56.7 Å²	56.7	42%	0.419	30%	0.295	S	S	.	.	H	α-helix	trans	-60.7	-38.2	-179.6	-69.3	-62.4	-62.5	-113.4	-4.8	112.9	E161 S170 V211 Y212 G217	E161-R215 WeakPolarHBondContact CG-O 3.44Å; E161-R215 IonicContact OE1-CZ 2.94Å; E161-R215 IonicContact OE1-NE 3.17Å; E161-R215 PolarHBondContact OE1-NE 3.12Å; E161-R215 IonicContact OE1-NH2 3.68Å; E161-R215 PolarHBondContact OE1-NH2 3.48Å; E161-R215 VanDerWaalsContact OE1-NH2 3.17Å; S170-R215 PolarHBondContact OG-NH1 3.43Å; V211-R215 HydrophobicContact CG1-CG 3.99Å; V211-R215 WeakPolarHBondContact O-CB 3.37Å; V211-R215 WeakPolarHBondContact O-CG 3.35Å; V211-R215 PolarHBondContact O-N 2.81Å; Y212-R215 PolarHBondContact O-N 3.1Å; R215-G217 PolarHBondContact O-N 3.28Å
216	L	97.8	Very high	97.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-12.6	174.6	-70.7	-171.9	0	0	0	113.9	V144 R157 L158 E161 Y212 E214 L218	V144-L216 HydrophobicContact CG2-CD1 3.8Å; R157-L216 PolarHBondContact NH1-O 3.5Å; R157-L216 VanDerWaalsContact NH1-O 3.09Å; R157-L216 PolarHBondContact NH2-O 2.83Å; L158-L216 HydrophobicContact CB-CD2 4.43Å; L158-L216 HydrophobicContact CD2-CB 3.91Å; L158-L216 HydrophobicContact CD2-CD1 4.28Å; L158-L216 HydrophobicContact CD2-CD2 3.87Å; L158-L216 HydrophobicContact CD2-CG 4.22Å; E161-L216 HydrophobicContact CB-CD2 3.95Å; E161-L216 HydrophobicContact CG-CD2 3.98Å; Y212-L216 HydrophobicContact CD1-CD1 4.34Å; Y212-L216 HydrophobicContact CD2-CD1 4.2Å; Y212-L216 HydrophobicContact CD2-CD2 4.42Å; Y212-L216 HydrophobicContact CD2-CG 4Å; Y212-L216 HydrophobicContact CE1-CD1 3.85Å; Y212-L216 HydrophobicContact CE2-CD1 3.69Å; Y212-L216 HydrophobicContact CE2-CD2 3.76Å; Y212-L216 HydrophobicContact CE2-CG 3.68Å; Y212-L216 HydrophobicContact CG-CD1 4.49Å; Y212-L216 VanDerWaalsContact CZ-CD1 3.5Å; Y212-L216 WeakPolarHBondContact O-CB 3.18Å; Y212-L216 VanDerWaalsContact O-CG 3.31Å; Y212-L216 WeakPolarHBondContact O-CG 3.31Å; Y212-L216 PolarHBondContact O-N 3.19Å; E214-L216 VanDerWaalsContact C-N 3.31Å; E214-L216 PolarHBondContact O-N 3.34Å; L216-L218 VanDerWaalsContact C-N 3.28Å; L216-L218 HydrophobicContact CB-CD1 4.29Å; L216-L218 HydrophobicContact CB-CD2 4.13Å; L216-L218 HydrophobicContact CB-CG 3.74Å; L216-L218 HydrophobicContact CD1-CD1 4.05Å; L216-L218 HydrophobicContact CD1-CG 4.33Å; L216-L218 PolarHBondContact O-N 3.39Å
217	G	97.1	Very high	97.1	Very high	60 Å²	60	55.2 Å²	55.2	62%	0.619	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	29.8	-175.7	0	0	0	0	0	112.5	E214 R215	E214-G217 WeakPolarHBondContact O-CA 3.34Å; E214-G217 PolarHBondContact O-N 2.92Å; R215-G217 PolarHBondContact O-N 3.28Å
218	L	95.9	Very high	97	Very high	34 Å²	34	53.9 Å²	53.9	18%	0.178	28%	0.283	C	S	.	.			trans	-70.1	144	-180	-58.6	-178.2	0	0	0	110.2	V144 L158 K213 L216 T222 I224	V144-L218 HydrophobicContact CG2-CD1 4.39Å; L158-L218 HydrophobicContact CD2-CD2 4.22Å; K213-L218 HydrophobicContact CG-CB 4.15Å; K213-L218 HydrophobicContact CG-CD1 4.4Å; K213-L218 PolarHBondContact O-N 3.04Å; L216-L218 VanDerWaalsContact C-N 3.28Å; L216-L218 HydrophobicContact CB-CD1 4.29Å; L216-L218 HydrophobicContact CB-CD2 4.13Å; L216-L218 HydrophobicContact CB-CG 3.74Å; L216-L218 HydrophobicContact CD1-CD1 4.05Å; L216-L218 HydrophobicContact CD1-CG 4.33Å; L216-L218 PolarHBondContact O-N 3.39Å; L218-T222 HydrophobicContact CB-CG2 4.43Å; L218-T222 HydrophobicContact CD1-CG2 4.28Å; L218-I224 HydrophobicContact CD1-CG2 3.77Å
219	S	95.1	Very high	96.8	Very high	59 Å²	59	54.3 Å²	54.3	41%	0.413	29%	0.285	S	S	.	.			trans	-53	142.6	174.6	-178.6	0	0	0	0	110.8	K221 T222	S219-K221 PolarHBondContact O-N 3.11Å; S219-K221 PolarHBondContact OG-N 2.93Å; S219-T222 VanDerWaalsContact O-CB 3.31Å; S219-T222 WeakPolarHBondContact O-CB 3.48Å; S219-T222 PolarHBondContact O-N 3.27Å
220	P	91.1	Very high	96.4	Very high	118 Å²	118	57 Å²	57	77%	0.766	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.4	173.8	-28.2	35.4	0	0	0	113.5	K213 T222	K213-P220 PolarHBondContact NZ-O 2.65Å; P220-T222 VanDerWaalsContact C-N 3.33Å
221	K	94.3	Very high	95.9	Very high	190 Å²	190	53.3 Å²	53.3	83%	0.826	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-21.1	177.3	-62.9	-178.7	-178.8	177.4	0	113.6	S219 I223	S219-K221 PolarHBondContact O-N 3.11Å; S219-K221 PolarHBondContact OG-N 2.93Å; K221-I223 PolarHBondContact O-N 2.84Å
222	T	94.9	Very high	95.3	Very high	60 Å²	60	54 Å²	54	37%	0.368	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-74	118	179	-60.5	0	0	0	0	109	K213 L218 S219 P220 I224	K213-T222 WeakPolarHBondContact CE-O 3.48Å; K213-T222 PolarHBondContact NZ-O 3.08Å; L218-T222 HydrophobicContact CB-CG2 4.43Å; L218-T222 HydrophobicContact CD1-CG2 4.28Å; S219-T222 VanDerWaalsContact O-CB 3.31Å; S219-T222 WeakPolarHBondContact O-CB 3.48Å; S219-T222 PolarHBondContact O-N 3.27Å; P220-T222 VanDerWaalsContact C-N 3.33Å; T222-I224 HydrophobicContact CG2-CG2 4.42Å
223	I	96.4	Very high	94.4	Very high	124 Å²	124	55.9 Å²	55.9	64%	0.636	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-95.5	125.4	175.1	-60.2	173.2	0	0	0	108.2	K221 V245 V246	K221-I223 PolarHBondContact O-N 2.84Å; I223-V245 HydrophobicContact CG2-CB 3.74Å; I223-V245 HydrophobicContact CG2-CG1 4.05Å; I223-V246 WeakPolarHBondContact CA-O 3.36Å
224	I	97.6	Very high	93.4	Very high	4 Å²	4	60.4 Å²	60.4	2%	0.021	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-103.6	149.9	169	64	169.7	0	0	0	109.1	W142 V144 Y212 K213 L218 T222 V245 V246	W142-I224 HydrophobicContact CD2-CD1 4.41Å; W142-I224 HydrophobicContact CE3-CB 4.46Å; W142-I224 HydrophobicContact CE3-CD1 3.92Å; W142-I224 HydrophobicContact CE3-CG1 3.81Å; W142-I224 HydrophobicContact CZ3-CG1 4.07Å; W142-I224 WeakPolarHBondContact CZ3-O 3.29Å; V144-I224 HydrophobicContact CG2-CG2 4.04Å; Y212-I224 HydrophobicContact CD1-CD1 4.22Å; K213-I224 HydrophobicContact CB-CD1 3.98Å; L218-I224 HydrophobicContact CD1-CG2 3.77Å; T222-I224 HydrophobicContact CG2-CG2 4.42Å; I224-V245 WeakPolarHBondContact O-CA 3.38Å; I224-V246 HydrophobicContact CD1-CG2 3.86Å; I224-V246 HydrophobicContact CG1-CG2 3.5Å; I224-V246 VanDerWaalsContact CG1-CG2 3.5Å; I224-V246 PolarHBondContact N-O 3.36Å; I224-V246 PolarHBondContact O-N 3.25Å
225	G	97.8	Very high	92.3	Very high	6 Å²	6	57.1 Å²	57.1	6%	0.062	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.1	-174	0	0	0	0	0	112.2	W142 L143	W142-G225 VanDerWaalsContact CE3-C 3.43Å; L143-G225 PolarHBondContact N-O 2.74Å
226	Y	98.3	Very high	90.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.9	171.1	-172.5	-92.9	0	0	0	110.5	G140 R141 W142 T196 A199 V205 N242 K243 F244	G140-Y226 VanDerWaalsContact C-CZ 3.45Å; G140-Y226 VanDerWaalsContact C-OH 3.32Å; G140-Y226 VanDerWaalsContact CA-CZ 3.48Å; G140-Y226 WeakPolarHBondContact CA-OH 3.27Å; G140-Y226 PolarHBondContact N-OH 3.43Å; R141-Y226 VanDerWaalsContact C-CD2 3.4Å; R141-Y226 CarbonylContact O-C 3.6Å; R141-Y226 VanDerWaalsContact O-CA 3.27Å; R141-Y226 WeakPolarHBondContact O-CA 3.44Å; R141-Y226 WeakPolarHBondContact O-CD2 3.49Å; W142-Y226 AromaticContact CD1-CD2 3.7Å; W142-Y226 AromaticContact CD2-CD2 3.89Å; W142-Y226 HydrophobicContact CD2-CD2 3.89Å; W142-Y226 HydrophobicContact CD2-CG 4.38Å; W142-Y226 AromaticContact CE2-CD2 3.75Å; W142-Y226 AromaticContact CG-CD2 3.85Å; W142-Y226 HydrophobicContact CG-CD2 3.85Å; W142-Y226 HydrophobicContact CZ2-CD2 4.39Å; W142-Y226 HydrophobicContact CZ2-CG 4.44Å; W142-Y226 VanDerWaalsContact CZ3-N 3.34Å; W142-Y226 AromaticContact NE1-CD2 3.64Å; T196-Y226 HydrophobicContact CG2-CE2 4.41Å; T196-Y226 WeakPolarHBondContact OG1-CE2 3.42Å; T196-Y226 PolarHBondContact OG1-OH 2.55Å; A199-Y226 WeakPolarHBondContact CA-OH 3.33Å; A199-Y226 HydrophobicContact CB-CE1 3.91Å; V205-Y226 HydrophobicContact CG1-CD1 3.85Å; V205-Y226 HydrophobicContact CG1-CD2 3.45Å; V205-Y226 VanDerWaalsContact CG1-CD2 3.45Å; V205-Y226 HydrophobicContact CG1-CE1 3.98Å; V205-Y226 HydrophobicContact CG1-CE2 3.59Å; V205-Y226 HydrophobicContact CG1-CG 3.57Å; V205-Y226 HydrophobicContact CG2-CE1 4.37Å; V205-Y226 HydrophobicContact CG2-CE2 4.15Å; Y226-N242 CarbonylContact O-C 3.59Å; Y226-N242 VanDerWaalsContact O-CA 3.26Å; Y226-N242 WeakPolarHBondContact O-CA 3.48Å; Y226-K243 HydrophobicContact CD1-CB 4.37Å; Y226-K243 PolarHBondContact O-N 3.48Å; Y226-F244 AromaticContact CD1-CD2 3.78Å; Y226-F244 HydrophobicContact CD1-CD2 3.78Å; Y226-F244 HydrophobicContact CD1-CE2 4.36Å; Y226-F244 HydrophobicContact CE1-CD2 4.45Å; Y226-F244 HydrophobicContact CG-CD2 4.2Å; Y226-F244 PolarHBondContact N-O 3.33Å
227	Q	97	Very high	87.8	Confident	13 Å²	13	65.2 Å²	65.2	6%	0.061	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.8	-178.3	-64.5	173.9	-8.2	0	0	109.8	G140 R141 A240 N242	G140-Q227 CarbonylContact C-O 3.51Å; G140-Q227 WeakPolarHBondContact CA-O 3.36Å; R141-Q227 HydrophobicContact CG-CB 4.47Å; R141-Q227 PolarHBondContact N-O 3.41Å; R141-Q227 PolarHBondContact O-N 3.02Å; Q227-A240 HydrophobicContact CB-CB 4.36Å; Q227-A240 HydrophobicContact CG-CB 4.16Å; Q227-N242 WeakPolarHBondContact CG-OD1 3.31Å; Q227-N242 PolarHBondContact NE2-OD1 3.44Å
228	A	96.1	Very high	86	Confident	8 Å²	8	65.8 Å²	65.8	7%	0.066	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	144.2	171.9	0	0	0	0	0	110.4	A199 D231 T232	A199-A228 HydrophobicContact CB-CB 4.17Å; A228-D231 HydrophobicContact CB-CB 4.45Å; A228-D231 PolarHBondContact O-N 3.32Å; A228-T232 PolarHBondContact O-N 3.38Å; A228-T232 PolarHBondContact O-OG1 3.41Å
229	H	94.5	Very high	84.7	Confident	8 Å²	8	71 Å²	71	4%	0.037	41%	0.414	C	S	.	.	H	α-helix	trans	-65.6	-40	-179.8	-71.3	-46.5	0	0	0	111.9	W131 N136 G139 G140 W195 D231 T232 A233	W131-H229 HydrophobicContact CB-CB 4.36Å; N136-H229 PolarHBondContact O-CD2 3.49Å; G139-H229 PolarHBondContact O-N 2.84Å; G140-H229 VanDerWaalsContact CA-CD2 3.47Å; G140-H229 WeakPolarHBondContact CA-CD2 3.26Å; G140-H229 WeakPolarHBondContact CA-NE2 3.44Å; G140-H229 PolarHBondContact N-CD2 2.82Å; G140-H229 PolarHBondContact N-NE2 2.97Å; G140-H229 PolarHBondContact O-NE2 2.93Å; W195-H229 AromaticContact CD2-CE1 3.3Å; W195-H229 AromaticContact CD2-NE2 3.4Å; W195-H229 AromaticContact CE2-CE1 3.54Å; W195-H229 AromaticContact CE3-CE1 3.35Å; W195-H229 AromaticContact CE3-NE2 3.17Å; W195-H229 AromaticContact CG-CE1 3.93Å; W195-H229 AromaticContact CG-NE2 3.88Å; W195-H229 AromaticContact CH2-CE1 3.85Å; W195-H229 AromaticContact CZ2-CE1 3.81Å; W195-H229 AromaticContact CZ3-CE1 3.62Å; W195-H229 AromaticContact CZ3-NE2 3.72Å; H229-D231 VanDerWaalsContact C-N 3.31Å; H229-D231 PolarHBondContact O-N 3.28Å; H229-T232 PolarHBondContact O-N 3.38Å; H229-T232 VanDerWaalsContact O-N 3.1Å; H229-A233 WeakPolarHBondContact O-CB 3.32Å; H229-A233 PolarHBondContact O-N 3.14Å
230	A	91	Very high	84	Confident	58 Å²	58	68.8 Å²	68.8	48%	0.479	40%	0.399	S	S	.	.	H	α-helix	trans	-57.3	-40.8	176.4	0	0	0	0	0	113.2	T232 T234	A230-T232 VanDerWaalsContact C-N 3.32Å; A230-T232 PolarHBondContact O-N 3.24Å; A230-T234 WeakPolarHBondContact O-CG2 3.48Å; A230-T234 PolarHBondContact O-N 3.34Å; A230-T234 PolarHBondContact O-OG1 3.22Å
231	D	88	Confident	83.8	Confident	70 Å²	70	71 Å²	71	37%	0.374	40%	0.397	S	S	.	.	H	α-helix	trans	-72.9	-27.4	179	-65.9	-18	0	0	0	112.7	A228 H229 T234 K235	A228-D231 HydrophobicContact CB-CB 4.45Å; A228-D231 PolarHBondContact O-N 3.32Å; H229-D231 VanDerWaalsContact C-N 3.31Å; H229-D231 PolarHBondContact O-N 3.28Å; D231-T234 PolarHBondContact O-OG1 3.31Å; D231-K235 WeakPolarHBondContact O-CD 3.28Å; D231-K235 WeakPolarHBondContact O-CG 3.35Å
232	T	84.8	Confident	83.8	Confident	38 Å²	38	65.3 Å²	65.3	23%	0.233	38%	0.375	C	S	.	.	H	α-helix	trans	-80.6	-40	-179.8	-55.1	0	0	0	0	110.8	A228 H229 A230 T234 K235	A228-T232 PolarHBondContact O-N 3.38Å; A228-T232 PolarHBondContact O-OG1 3.41Å; H229-T232 PolarHBondContact O-N 3.38Å; H229-T232 VanDerWaalsContact O-N 3.1Å; A230-T232 VanDerWaalsContact C-N 3.32Å; A230-T232 PolarHBondContact O-N 3.24Å; T232-T234 VanDerWaalsContact C-N 3.33Å; T232-T234 PolarHBondContact O-N 3.12Å; T232-K235 PolarHBondContact O-N 3.44Å
233	A	81.4	Confident	83.8	Confident	40 Å²	40	66.1 Å²	66.1	33%	0.331	37%	0.374	S	S	.	.	H	α-helix	trans	-70.2	-29	-176.3	0	0	0	0	0	114	W131 H229 K235	W131-A233 HydrophobicContact CD2-CB 3.8Å; W131-A233 HydrophobicContact CE3-CB 3.23Å; W131-A233 HydrophobicContact CH2-CB 3.54Å; W131-A233 HydrophobicContact CZ2-CB 4.07Å; W131-A233 HydrophobicContact CZ3-CB 3.09Å; H229-A233 WeakPolarHBondContact O-CB 3.32Å; H229-A233 PolarHBondContact O-N 3.14Å; A233-K235 VanDerWaalsContact C-N 3.31Å; A233-K235 PolarHBondContact O-N 3.32Å
234	T	77.4	Confident	83.9	Confident	118 Å²	118	61.6 Å²	61.6	72%	0.724	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-7	-179.1	49.7	0	0	0	0	113.6	A230 D231 T232	A230-T234 WeakPolarHBondContact O-CG2 3.48Å; A230-T234 PolarHBondContact O-N 3.34Å; A230-T234 PolarHBondContact O-OG1 3.22Å; D231-T234 PolarHBondContact O-OG1 3.31Å; T232-T234 VanDerWaalsContact C-N 3.33Å; T232-T234 PolarHBondContact O-N 3.12Å
235	K	74.1	Confident	83.8	Confident	81 Å²	81	65.3 Å²	65.3	35%	0.352	37%	0.372	S	S	.	.			trans	-107.5	119.4	-175.3	-70.9	-178	175.8	-146.8	0	112.1	D231 T232 A233 L239	D231-K235 WeakPolarHBondContact O-CD 3.28Å; D231-K235 WeakPolarHBondContact O-CG 3.35Å; T232-K235 PolarHBondContact O-N 3.44Å; A233-K235 VanDerWaalsContact C-N 3.31Å; A233-K235 PolarHBondContact O-N 3.32Å; K235-L239 PolarHBondContact NZ-O 3.21Å
236	S	52.3	Low	83.8	Confident	114 Å²	114	67 Å²	67	80%	0.797	38%	0.381	S	S	*	.	S	Bend	trans	-90.8	-29.1	176	56.2	0	0	0	0	114.2
237	N	48.3	Very low	83	Confident	166 Å²	166	70.4 Å²	70.4	89%	0.888	40%	0.4	S	S	*	.	S	Bend	trans	-136.9	3	-168.2	-84.1	-13.5	0	0	0	116.2
238	S	59.2	Low	82.3	Confident	72 Å²	72	73.4 Å²	73.4	50%	0.503	42%	0.418	S	S	.	.	S	Bend	trans	-128.4	150.6	177.1	67.6	0	0	0	0	112.1	A240	S238-A240 PolarHBondContact O-N 3.29Å
239	L	70	Confident	81.5	Confident	144 Å²	144	77 Å²	77	75%	0.754	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-59.3	133.7	173.2	-76.1	157.6	0	0	0	109.6	K235 K241	K235-L239 PolarHBondContact NZ-O 3.21Å; L239-K241 PolarHBondContact O-N 3.32Å
240	A	78.8	Confident	80.8	Confident	12 Å²	12	81.1 Å²	81.1	10%	0.099	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-58.4	138.5	171.5	0	0	0	0	0	109.5	Q227 S238	Q227-A240 HydrophobicContact CB-CB 4.36Å; Q227-A240 HydrophobicContact CG-CB 4.16Å; S238-A240 PolarHBondContact O-N 3.29Å
241	K	87.1	Confident	80.1	Confident	166 Å²	166	82.5 Å²	82.5	72%	0.722	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-71.7	137.6	178	-171.3	178.7	178	-176.3	0	107.4	L239 K243	L239-K241 PolarHBondContact O-N 3.32Å; K241-K243 PolarHBondContact O-N 3.12Å
242	N	94.4	Very high	79.6	Confident	69 Å²	69	83.3 Å²	83.3	37%	0.369	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-73.4	127.6	173.5	-63.6	-26.3	0	0	0	108.7	Y226 Q227 V245	Y226-N242 CarbonylContact O-C 3.59Å; Y226-N242 VanDerWaalsContact O-CA 3.26Å; Y226-N242 WeakPolarHBondContact O-CA 3.48Å; Q227-N242 WeakPolarHBondContact CG-OD1 3.31Å; Q227-N242 PolarHBondContact NE2-OD1 3.44Å; N242-V245 HydrophobicContact CB-CG1 4.04Å
243	K	95.5	Very high	79.2	Confident	78 Å²	78	86.6 Å²	86.6	34%	0.339	48%	0.482	S	S	.	.	S	Bend	trans	-76.3	-39.5	171.8	-172.6	-177.4	174.3	92.8	0	110.4	A199 E200 Y226 K241	A199-K243 VanDerWaalsContact O-CE 3.31Å; A199-K243 WeakPolarHBondContact O-CE 3.22Å; E200-K243 WeakPolarHBondContact OE1-CE 3.46Å; E200-K243 IonicContact OE1-NZ 2.7Å; E200-K243 PolarHBondContact OE1-NZ 3.44Å; E200-K243 WeakPolarHBondContact OE2-CE 3.16Å; E200-K243 IonicContact OE2-NZ 3.86Å; E200-K243 PolarHBondContact OE2-NZ 3.07Å; Y226-K243 HydrophobicContact CD1-CB 4.37Å; Y226-K243 PolarHBondContact O-N 3.48Å; K241-K243 PolarHBondContact O-N 3.12Å
244	F	97.4	Very high	79.1	Confident	29 Å²	29	90.2 Å²	90.2	13%	0.127	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	160.3	175.2	-51.1	-68.9	0	0	0	111.1	W142 A199 Q202 V205 L206 Y226	W142-F244 HydrophobicContact CH2-CB 3.97Å; W142-F244 HydrophobicContact CZ2-CB 4.35Å; A199-F244 WeakPolarHBondContact O-CE2 3.44Å; Q202-F244 HydrophobicContact CB-CE1 4.11Å; Q202-F244 HydrophobicContact CB-CZ 3.81Å; Q202-F244 HydrophobicContact CG-CD1 4.36Å; Q202-F244 HydrophobicContact CG-CE1 3.6Å; Q202-F244 HydrophobicContact CG-CZ 3.83Å; V205-F244 HydrophobicContact CB-CD2 4.35Å; V205-F244 HydrophobicContact CB-CE2 4.35Å; V205-F244 HydrophobicContact CG1-CD2 3.56Å; V205-F244 HydrophobicContact CG1-CE2 4Å; V205-F244 HydrophobicContact CG1-CG 4.46Å; L206-F244 HydrophobicContact CD2-CB 3.87Å; L206-F244 HydrophobicContact CD2-CD1 4.33Å; L206-F244 HydrophobicContact CD2-CG 4.21Å; Y226-F244 AromaticContact CD1-CD2 3.78Å; Y226-F244 HydrophobicContact CD1-CD2 3.78Å; Y226-F244 HydrophobicContact CD1-CE2 4.36Å; Y226-F244 HydrophobicContact CE1-CD2 4.45Å; Y226-F244 HydrophobicContact CG-CD2 4.2Å; Y226-F244 PolarHBondContact N-O 3.33Å
245	V	97.4	Very high	79.2	Confident	82 Å²	82	87.8 Å²	87.8	50%	0.497	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	147.1	174.2	-66	0	0	0	0	109.5	I223 I224 N242	I223-V245 HydrophobicContact CG2-CB 3.74Å; I223-V245 HydrophobicContact CG2-CG1 4.05Å; I224-V245 WeakPolarHBondContact O-CA 3.38Å; N242-V245 HydrophobicContact CB-CG1 4.04Å
246	V	95.8	Very high	79.7	Confident	41 Å²	41	88.5 Å²	88.5	25%	0.248	49%	0.486	C	S	.	.			trans	-138.8	0	172.7	-64.9	0	0	0	0	112.1	W142 L206 R210 K213 I223 I224	W142-V246 HydrophobicContact CE3-CG2 4.25Å; W142-V246 HydrophobicContact CH2-CB 4.2Å; W142-V246 HydrophobicContact CH2-CG1 3.71Å; W142-V246 HydrophobicContact CH2-CG2 3.72Å; W142-V246 HydrophobicContact CZ2-CG1 4.14Å; W142-V246 HydrophobicContact CZ2-CG2 4.29Å; W142-V246 HydrophobicContact CZ3-CB 4.49Å; W142-V246 HydrophobicContact CZ3-CG1 4.47Å; W142-V246 HydrophobicContact CZ3-CG2 3.69Å; L206-V246 HydrophobicContact CD2-CG1 3.94Å; R210-V246 HydrophobicContact CG-CB 4.21Å; R210-V246 HydrophobicContact CG-CG1 3.86Å; K213-V246 HydrophobicContact CD-CG2 4.37Å; K213-V246 WeakPolarHBondContact CD-OXT 3.5Å; K213-V246 PolarHBondContact NZ-O 3.38Å; K213-V246 PolarHBondContact NZ-OXT 3.14Å; I223-V246 WeakPolarHBondContact CA-O 3.36Å; I224-V246 HydrophobicContact CD1-CG2 3.86Å; I224-V246 HydrophobicContact CG1-CG2 3.5Å; I224-V246 VanDerWaalsContact CG1-CG2 3.5Å; I224-V246 PolarHBondContact N-O 3.36Å; I224-V246 PolarHBondContact O-N 3.25Å

Retrieved 246 of 246 residues in 808.3 ms (Link to these results)

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