A0A093HE10_STRCA Loading...

Tribbles homolog 2

Interacts with MAPK kinases and regulates activation of MAP kinases. Does not display kinase activity.

AlphaFold DB , UniProt , Accession A0A093HE10, Species STRCA (Struthio camelus australis), Gene n/a, Length 343 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	43.5	Very low	37	Very low	133 Å²	133	122.6 Å²	122.6	66%	0.655	65%	0.649	S	S	*	*				0	72.4	0	-66.5	-166.6	-172.3	0	0	112	I3 I61 E123	M1-I3 PolarHBondContact O-N 2.91Å; M1-I61 HydrophobicContact SD-CD1 4.13Å; M1-E123 VanDerWaalsContact C-OE1 3.32Å; M1-E123 VanDerWaalsContact CA-CD 3.49Å; M1-E123 WeakPolarHBondContact CA-OE1 3.4Å; M1-E123 WeakPolarHBondContact CA-OE2 3.43Å; M1-E123 PolarHBondContact N-OE1 2.86Å; M1-E123 PolarHBondContact N-OE2 3.32Å
2	N	38.9	Very low	36.3	Very low	130 Å²	130	119.2 Å²	119.2	70%	0.695	65%	0.65	S	S	*	*			trans	-70.9	101.8	155.6	-75.1	-41.6	0	0	0	108	Q4 E123	N2-Q4 PolarHBondContact O-N 3.17Å; N2-E123 PolarHBondContact N-OE1 3.11Å
3	I	39.2	Very low	35.8	Very low	66 Å²	66	128 Å²	128	34%	0.338	67%	0.668	S	S	.	*			trans	-81.6	109.6	-178.7	-65.4	157.5	0	0	0	108.7	M1 I120	M1-I3 PolarHBondContact O-N 2.91Å; I3-I120 HydrophobicContact CG2-CG2 3.46Å; I3-I120 VanDerWaalsContact CG2-CG2 3.46Å
4	Q	40.4	Very low	35.2	Very low	149 Å²	149	135.7 Å²	135.7	70%	0.696	69%	0.687	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.2	114.9	170.9	-68.5	-167.4	-1.8	0	0	109.3	N2 S6 L121	N2-Q4 PolarHBondContact O-N 3.17Å; Q4-S6 PolarHBondContact O-N 2.93Å; Q4-L121 PolarHBondContact N-O 3.49Å; Q4-L121 PolarHBondContact O-N 3.3Å
5	R	38.3	Very low	34.6	Very low	160 Å²	160	131.7 Å²	131.7	60%	0.604	69%	0.692	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.1	122.6	160.6	-72.6	-174.1	178.7	166.7	3.5	107.6	T7	R5-T7 PolarHBondContact O-N 3.48Å
6	S	39.3	Very low	34.1	Very low	54 Å²	54	139.1 Å²	139.1	38%	0.378	71%	0.708	S	S	.	*	P	Polyproline II helix	trans	-56.1	137.5	162.3	39.9	0	0	0	0	109.1	Q4 I119	Q4-S6 PolarHBondContact O-N 2.93Å; S6-I119 PolarHBondContact OG-O 3.09Å
7	T	31.1	Very low	33.8	Very low	119 Å²	119	138.3 Å²	138.3	73%	0.73	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-60.4	152.1	165.9	41.3	0	0	0	0	109.3	R5 I9	R5-T7 PolarHBondContact O-N 3.48Å; T7-I9 PolarHBondContact O-N 3.42Å; T7-I9 VanDerWaalsContact O-N 3.09Å
8	P	32.2	Very low	33.4	Very low	115 Å²	115	144.1 Å²	144.1	75%	0.747	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-54.5	121.8	178.3	21.9	-33.3	0	0	0	110	T10	P8-T10 PolarHBondContact O-N 3.38Å
9	I	39.8	Very low	33	Very low	130 Å²	130	144.4 Å²	144.4	67%	0.667	73%	0.729	S	S	*	*			trans	-73.4	95.1	-173.4	-58.1	179.1	0	0	0	108.7	T7 I11	T7-I9 PolarHBondContact O-N 3.42Å; T7-I9 VanDerWaalsContact O-N 3.09Å; I9-I11 PolarHBondContact O-N 3.42Å
10	T	27.8	Very low	32.7	Very low	121 Å²	121	146.7 Å²	146.7	74%	0.742	74%	0.735	S	S	*	*			trans	-64.7	112.7	175.7	-56	0	0	0	0	110	P8 A12	P8-T10 PolarHBondContact O-N 3.38Å; T10-A12 PolarHBondContact O-N 3.19Å
11	I	36.9	Very low	32.4	Very low	172 Å²	172	144.1 Å²	144.1	88%	0.882	73%	0.726	S	S	*	*			trans	-69.3	92.8	-177.9	-57.1	175.2	0	0	0	109.9	I9	I9-I11 PolarHBondContact O-N 3.42Å
12	A	28.8	Very low	31.6	Very low	81 Å²	81	145.2 Å²	145.2	67%	0.669	73%	0.73	S	S	*	*			trans	-132.8	92.4	-172.9	0	0	0	0	0	113.5	T10	T10-A12 PolarHBondContact O-N 3.19Å
13	R	29.1	Very low	30.9	Very low	234 Å²	234	144.2 Å²	144.2	88%	0.883	73%	0.725	S	S	*	*			trans	4.3	126	154.9	-65.7	176.8	-178.9	175.7	-0.3	119.8
14	Y	27.2	Very low	30.4	Very low	236 Å²	236	149.7 Å²	149.7	93%	0.925	75%	0.746	S	S	*	*			trans	54.4	115.9	147.8	-75	-79.3	0	0	0	120.5
15	G	26.2	Very low	29.8	Very low	75 Å²	75	150.7 Å²	150.7	77%	0.773	75%	0.751	S	S	*	*			trans	172.7	123	156.9	0	0	0	0	0	114
16	R	27.6	Very low	29.4	Very low	251 Å²	251	150.2 Å²	150.2	95%	0.947	76%	0.756	S	S	*	*			trans	-69.4	135.9	175.4	-75.3	179	172.5	171.5	-4.2	111.5
17	P	28.8	Very low	28.8	Very low	125 Å²	125	154.2 Å²	154.2	81%	0.812	77%	0.772	S	S	*	*			trans	-78.1	171.1	157.6	34.1	-33.7	0	0	0	111.6
18	R	26.5	Very low	28.6	Very low	242 Å²	242	152.6 Å²	152.6	91%	0.913	77%	0.765	S	S	*	*			trans	-133.5	135.1	175.1	-175.7	177.9	-178.7	176.4	0.6	109.9
19	N	25.1	Very low	28.4	Very low	150 Å²	150	152 Å²	152	80%	0.802	76%	0.764	S	S	*	*			trans	-56	153.6	-172.4	-45.2	8.4	0	0	0	114.3
20	K	27.9	Very low	27.8	Very low	191 Å²	191	151.7 Å²	151.7	83%	0.83	76%	0.762	S	S	*	*			trans	167.7	146.2	136.9	-88.4	-141.7	174.4	-173.5	0	108.9
21	T	25.4	Very low	27.8	Very low	92 Å²	92	156.6 Å²	156.6	56%	0.564	77%	0.767	S	S	*	*			cis	-171.3	146.3	-7.6	15.8	0	0	0	0	109.8
22	Q	26.8	Very low	27.2	Very low	157 Å²	157	152.5 Å²	152.5	73%	0.734	75%	0.754	S	S	*	*			trans	61	166.5	141.7	-61.3	-175.5	-95.6	0	0	120.2
23	D	25.5	Very low	27.2	Very low	109 Å²	109	156.3 Å²	156.3	58%	0.583	76%	0.761	S	S	*	*			cis	-168.9	146	-33.5	-91.2	-19.4	0	0	0	108.4
24	F	27.6	Very low	27.1	Very low	181 Å²	181	153.5 Å²	153.5	79%	0.794	76%	0.759	S	S	*	*			trans	61.2	-177.7	150.4	-74.5	-142.2	0	0	0	115.1
25	E	28.6	Very low	27.8	Very low	169 Å²	169	147.5 Å²	147.5	79%	0.79	75%	0.748	S	S	*	*			cis	-160.8	154.8	-10.4	-127	168.3	-162.9	0	0	105.3
26	E	28.5	Very low	28	Very low	151 Å²	151	149.6 Å²	149.6	71%	0.706	75%	0.751	S	S	*	*			cis	-168.3	165.5	-39.4	-134.3	-66.3	72.6	0	0	107.6
27	L	28.1	Very low	28.1	Very low	138 Å²	138	146 Å²	146	72%	0.723	75%	0.745	S	S	*	*			trans	67.2	159.8	163	-61.2	170.4	0	0	0	117.8
28	S	26.8	Very low	28	Very low	84 Å²	84	145.8 Å²	145.8	59%	0.587	75%	0.747	S	S	*	*			cis	-172.5	165.1	-26.6	58.9	0	0	0	0	110.9
29	S	27.4	Very low	28.1	Very low	102 Å²	102	142.9 Å²	142.9	71%	0.713	74%	0.741	S	S	*	*			trans	67.2	155.1	140.9	-71.2	0	0	0	0	119.5
30	I	27.8	Very low	28.4	Very low	124 Å²	124	141.6 Å²	141.6	64%	0.636	74%	0.743	S	S	*	*			cis	-163	142.6	-4.3	-120.3	168.4	0	0	0	111.1
31	R	26.9	Very low	29	Very low	224 Å²	224	137.9 Å²	137.9	85%	0.845	74%	0.739	S	S	*	*			trans	58.3	166.6	151.4	-70.6	179.4	-163.1	175.2	3.4	120.5
32	S	25.7	Very low	29.2	Very low	87 Å²	87	140.9 Å²	140.9	61%	0.608	75%	0.752	S	S	*	*			cis	-178.4	177.7	-33.5	58.9	0	0	0	0	110
33	I	28.1	Very low	29.7	Very low	160 Å²	160	141.6 Å²	141.6	82%	0.821	76%	0.759	S	S	*	*			trans	99.9	105.1	158.9	-62.3	150.5	0	0	0	117.9
34	E	27.2	Very low	29.9	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	77%	0.768	S	S	*	*			trans	-83.7	-176.7	148.2	-67.9	-163.9	134.8	0	0	110.1
35	P	42	Very low	30.2	Very low	110 Å²	110	136.3 Å²	136.3	71%	0.714	77%	0.766	S	S	*	*			cis	-142.1	-174.8	7.7	44.2	-25.7	0	0	0	116.1
36	S	29.6	Very low	30.6	Very low	119 Å²	119	134.3 Å²	134.3	83%	0.832	77%	0.767	S	S	*	*				-175	151.5	127.1	34.2	0	0	0	0	112.8
37	Q	29.3	Very low	31.1	Very low	174 Å²	174	132.1 Å²	132.1	81%	0.813	77%	0.769	S	S	*	*			trans	-106	154.9	175.9	-64.5	175.3	-13.8	0	0	110.9
38	S	28.2	Very low	31.7	Very low	121 Å²	121	130.8 Å²	130.8	85%	0.846	77%	0.768	S	S	*	*			trans	-150.1	149	153	64.9	0	0	0	0	111.5
39	F	27.4	Very low	32.5	Very low	182 Å²	182	132.6 Å²	132.6	80%	0.798	78%	0.778	S	S	*	*			trans	-113.7	136.6	-179.7	-77.5	-100.9	0	0	0	110.5
40	S	32.2	Very low	32.9	Very low	122 Å²	122	136.8 Å²	136.8	85%	0.853	79%	0.786	S	S	*	*			trans	-170	152.1	140.5	-86.2	0	0	0	0	111.6
41	P	39.7	Very low	33.4	Very low	113 Å²	113	136.2 Å²	136.2	73%	0.734	79%	0.789	S	S	*	*			trans	-94.9	158.8	-171	37.2	-36	0	0	0	113.8
42	N	30.2	Very low	33.9	Very low	156 Å²	156	131 Å²	131	83%	0.834	78%	0.783	S	S	*	*			trans	-163	165.8	142.6	-110.3	-57.3	0	0	0	111.8
43	L	36.5	Very low	34.1	Very low	171 Å²	171	133.7 Å²	133.7	90%	0.895	79%	0.791	S	S	*	*			trans	-71.5	140.1	-169.7	-67	87	0	0	0	113.3
44	G	29.4	Very low	34.6	Very low	74 Å²	74	133.1 Å²	133.1	76%	0.763	79%	0.789	S	S	*	*			trans	-123.6	153.9	169.3	0	0	0	0	0	111.7
45	S	35.4	Very low	35.1	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-54.4	154.5	-178.6	47.6	0	0	0	0	114.9	S47	S45-S47 PolarHBondContact O-N 3.37Å
46	P	36.8	Very low	35.2	Very low	126 Å²	126	129.9 Å²	129.9	82%	0.818	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-59.9	133.1	172.9	27.2	-35.2	0	0	0	111.2
47	S	37.7	Very low	36	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-62	154.3	176.1	-54.6	0	0	0	0	112	S45	S45-S47 PolarHBondContact O-N 3.37Å
48	P	41.2	Very low	37.4	Very low	109 Å²	109	125.1 Å²	125.1	71%	0.708	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-54.5	157.9	158.4	-19.8	32.8	0	0	0	110.8	E50	P48-E50 PolarHBondContact O-N 3.24Å
49	P	43	Very low	39.9	Very low	123 Å²	123	121.3 Å²	121.3	80%	0.799	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-55.8	138	173.7	25.5	-34.7	0	0	0	110.3	T51	P49-T51 PolarHBondContact O-N 2.9Å; P49-T51 VanDerWaalsContact O-N 3.15Å
50	E	36.7	Very low	42.7	Very low	190 Å²	190	115.9 Å²	115.9	89%	0.888	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-57.3	119	-176.8	-63.9	179.8	146.7	0	0	110.4	P48	P48-E50 PolarHBondContact O-N 3.24Å
51	T	38	Very low	45.5	Very low	112 Å²	112	110.1 Å²	110.1	69%	0.687	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-61.7	128.1	166.7	48.2	0	0	0	0	108	P49 N53	P49-T51 PolarHBondContact O-N 2.9Å; P49-T51 VanDerWaalsContact O-N 3.15Å; T51-N53 PolarHBondContact O-N 2.71Å
52	P	37.2	Very low	47.8	Very low	113 Å²	113	106.4 Å²	106.4	73%	0.734	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-57.3	137.6	179.7	25	-34.4	0	0	0	109.8	L54	P52-L54 WeakPolarHBondContact O-CD1 3.38Å; P52-L54 PolarHBondContact O-N 2.7Å
53	N	30.9	Very low	50.8	Low	144 Å²	144	101 Å²	101	77%	0.77	62%	0.624	S	S	*	*			trans	-46.9	110.6	-170.4	-80.6	-50.7	0	0	0	113	T51 S55	T51-N53 PolarHBondContact O-N 2.71Å; N53-S55 PolarHBondContact O-N 3.32Å
54	L	37.2	Very low	53.6	Low	149 Å²	149	93.2 Å²	93.2	78%	0.78	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	56.4	169.4	-81.7	98.1	0	0	0	111.4	P52 H56	P52-L54 WeakPolarHBondContact O-CD1 3.38Å; P52-L54 PolarHBondContact O-N 2.7Å; L54-H56 VanDerWaalsContact C-N 3.31Å
55	S	39.3	Very low	56.7	Low	98 Å²	98	92.1 Å²	92.1	69%	0.685	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-16.4	159.6	50.6	0	0	0	0	111.9	N53 C57	N53-S55 PolarHBondContact O-N 3.32Å; S55-C57 VanDerWaalsContact C-N 3.33Å; S55-C57 PolarHBondContact O-N 2.61Å
56	H	43	Very low	59.4	Low	120 Å²	120	87.5 Å²	87.5	56%	0.556	53%	0.526	S	S	*	.	S	Bend	trans	-70.1	88.6	164.6	-66.3	-91.5	0	0	0	109.5	L54 V58	L54-H56 VanDerWaalsContact C-N 3.31Å; H56-V58 PolarHBondContact O-N 3.46Å
57	C	46.8	Very low	62	Low	109 Å²	109	83.9 Å²	83.9	74%	0.736	50%	0.499	S	S	*	.			trans	-77	71.1	-178	-159.5	0	0	0	0	111.4	S55 S59	S55-C57 VanDerWaalsContact C-N 3.33Å; S55-C57 PolarHBondContact O-N 2.61Å; C57-S59 PolarHBondContact O-N 2.87Å; C57-S59 PolarHBondContact O-OG 3.03Å
58	V	58.1	Low	64.3	Low	84 Å²	84	82.6 Å²	82.6	51%	0.509	48%	0.482	S	S	.	.			trans	-55.3	105	-178.3	177.2	0	0	0	0	110.1	H56 L65	H56-V58 PolarHBondContact O-N 3.46Å; V58-L65 HydrophobicContact CG1-CD1 3.41Å; V58-L65 VanDerWaalsContact CG1-CD1 3.41Å; V58-L65 HydrophobicContact CG1-CD2 4.07Å; V58-L65 HydrophobicContact CG1-CG 3.67Å
59	S	80.4	Confident	66.5	Low	40 Å²	40	80.9 Å²	80.9	28%	0.28	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.9	-169	-68.9	0	0	0	0	110.7	C57 I61 L66	C57-S59 PolarHBondContact O-N 2.87Å; C57-S59 PolarHBondContact O-OG 3.03Å; S59-I61 PolarHBondContact O-N 3.4Å; S59-L66 PolarHBondContact N-O 3.3Å; S59-L66 WeakPolarHBondContact O-CB 3.49Å; S59-L66 PolarHBondContact O-N 3.41Å
60	C	87.9	Confident	68.4	Low	68 Å²	68	79.8 Å²	79.8	46%	0.459	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	111.1	177.5	-173.7	0	0	0	0	110.6	Y64	C60-Y64 WeakPolarHBondContact CA-O 3.48Å
61	I	90.4	Very high	70.4	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.01	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	92.1	178.1	-56.6	-58.8	0	0	0	108.7	M1 S59 K63 Y64 L66 I120 Y127 F129	M1-I61 HydrophobicContact SD-CD1 4.13Å; S59-I61 PolarHBondContact O-N 3.4Å; I61-K63 PolarHBondContact O-N 3.09Å; I61-Y64 PolarHBondContact N-O 3.43Å; I61-Y64 PolarHBondContact O-N 3.32Å; I61-Y64 VanDerWaalsContact O-N 3.07Å; I61-L66 HydrophobicContact CG1-CD1 3.69Å; I61-L66 HydrophobicContact CG1-CG 3.93Å; I61-I120 HydrophobicContact CG2-CB 4.08Å; I61-I120 HydrophobicContact CG2-CD1 4.13Å; I61-I120 HydrophobicContact CG2-CG2 3.8Å; I61-I120 WeakPolarHBondContact O-CD1 3.37Å; I61-Y127 HydrophobicContact CD1-CD1 4.35Å; I61-Y127 HydrophobicContact CD1-CE1 3.87Å; I61-Y127 HydrophobicContact CD1-CE2 4.12Å; I61-Y127 HydrophobicContact CG1-CD1 4Å; I61-Y127 HydrophobicContact CG1-CE1 3.94Å; I61-Y127 HydrophobicContact CG1-CG 4.4Å; I61-Y127 HydrophobicContact CG2-CD1 4.19Å; I61-Y127 HydrophobicContact CG2-CD2 3.88Å; I61-Y127 HydrophobicContact CG2-CE2 4.42Å; I61-Y127 HydrophobicContact CG2-CG 3.76Å; I61-F129 HydrophobicContact CB-CZ 4.44Å; I61-F129 HydrophobicContact CG2-CZ 4.25Å
62	G	88.6	Confident	72.2	Confident	34 Å²	34	73.9 Å²	73.9	35%	0.351	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	-82.5	175.2	0	0	0	0	0	113.8
63	K	92.3	Very high	74.3	Confident	44 Å²	44	73.9 Å²	73.9	19%	0.191	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	5.9	178.6	65.6	179.1	-157.5	-172	0	112.9	I61 H80 L81 E118	I61-K63 PolarHBondContact O-N 3.09Å; K63-H80 WeakPolarHBondContact CD-NE2 3.36Å; K63-H80 WeakPolarHBondContact CE-NE2 3.45Å; K63-H80 PolarHBondContact O-CD2 2.85Å; K63-L81 WeakPolarHBondContact O-CB 3.28Å; K63-L81 WeakPolarHBondContact O-CG 3.21Å; K63-L81 PolarHBondContact O-N 2.9Å; K63-E118 VanDerWaalsContact CE-OE1 3.23Å; K63-E118 WeakPolarHBondContact CE-OE1 3.41Å; K63-E118 WeakPolarHBondContact CE-OE2 3.1Å; K63-E118 IonicContact NZ-OE1 2.63Å; K63-E118 PolarHBondContact NZ-OE1 3.45Å; K63-E118 IonicContact NZ-OE2 2.78Å; K63-E118 PolarHBondContact NZ-OE2 3.39Å
64	Y	95	Very high	76.9	Confident	6 Å²	6	72.1 Å²	72.1	2%	0.024	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142	-178.1	-59.4	-82.5	0	0	0	110.6	C60 I61 V79 H80 L87 E118 I120 F129	C60-Y64 WeakPolarHBondContact CA-O 3.48Å; I61-Y64 PolarHBondContact N-O 3.43Å; I61-Y64 PolarHBondContact O-N 3.32Å; I61-Y64 VanDerWaalsContact O-N 3.07Å; Y64-V79 CarbonylContact C-O 3.58Å; Y64-V79 WeakPolarHBondContact CA-O 3.07Å; Y64-H80 HydrophobicContact CD1-CB 3.89Å; Y64-H80 AromaticContact CD1-CD2 3.98Å; Y64-H80 HydrophobicContact CE1-CB 3.82Å; Y64-H80 AromaticContact CE1-CD2 3.7Å; Y64-L87 HydrophobicContact CD1-CD1 4.1Å; Y64-L87 HydrophobicContact CE1-CD1 3.79Å; Y64-L87 HydrophobicContact CE1-CD2 3.8Å; Y64-L87 HydrophobicContact CE1-CG 4.42Å; Y64-E118 HydrophobicContact CE2-CB 4.33Å; Y64-I120 HydrophobicContact CD2-CD1 3.8Å; Y64-I120 HydrophobicContact CE2-CD1 4Å; Y64-F129 AromaticContact CD1-CD1 3.96Å; Y64-F129 HydrophobicContact CD1-CD1 3.96Å; Y64-F129 AromaticContact CD1-CE1 3.98Å; Y64-F129 HydrophobicContact CD1-CE1 3.98Å; Y64-F129 AromaticContact CD2-CD1 3.96Å; Y64-F129 HydrophobicContact CD2-CD1 3.96Å; Y64-F129 HydrophobicContact CD2-CD2 4.04Å; Y64-F129 AromaticContact CD2-CE1 3.62Å; Y64-F129 HydrophobicContact CD2-CE1 3.62Å; Y64-F129 AromaticContact CD2-CE2 3.71Å; Y64-F129 HydrophobicContact CD2-CE2 3.71Å; Y64-F129 HydrophobicContact CD2-CG 4.16Å; Y64-F129 AromaticContact CD2-CZ 3.48Å; Y64-F129 HydrophobicContact CD2-CZ 3.48Å; Y64-F129 VanDerWaalsContact CD2-CZ 3.48Å; Y64-F129 HydrophobicContact CE1-CD1 4.18Å; Y64-F129 HydrophobicContact CE1-CG 4.46Å; Y64-F129 HydrophobicContact CE2-CD1 4.18Å; Y64-F129 AromaticContact CE2-CD2 3.89Å; Y64-F129 HydrophobicContact CE2-CD2 3.89Å; Y64-F129 HydrophobicContact CE2-CE1 4.27Å; Y64-F129 HydrophobicContact CE2-CE2 4.01Å; Y64-F129 AromaticContact CE2-CG 3.99Å; Y64-F129 HydrophobicContact CE2-CG 3.99Å; Y64-F129 HydrophobicContact CE2-CZ 4.2Å; Y64-F129 AromaticContact CG-CD1 3.84Å; Y64-F129 HydrophobicContact CG-CD1 3.84Å; Y64-F129 AromaticContact CG-CE1 3.43Å; Y64-F129 HydrophobicContact CG-CE1 3.43Å; Y64-F129 VanDerWaalsContact CG-CE1 3.43Å; Y64-F129 HydrophobicContact CG-CE2 4.39Å; Y64-F129 HydrophobicContact CG-CG 4.47Å; Y64-F129 AromaticContact CG-CZ 3.75Å; Y64-F129 HydrophobicContact CG-CZ 3.75Å
65	L	94.4	Very high	79.5	Confident	51 Å²	51	66 Å²	66	27%	0.267	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.6	170.9	-161.3	65.8	0	0	0	108.3	V58 L67 A78 V79 L81	V58-L65 HydrophobicContact CG1-CD1 3.41Å; V58-L65 VanDerWaalsContact CG1-CD1 3.41Å; V58-L65 HydrophobicContact CG1-CD2 4.07Å; V58-L65 HydrophobicContact CG1-CG 3.67Å; L65-L67 HydrophobicContact CD2-CD2 3.93Å; L65-L67 HydrophobicContact CG-CD2 4.06Å; L65-A78 CarbonylContact O-C 3.58Å; L65-A78 VanDerWaalsContact O-CA 3.27Å; L65-A78 WeakPolarHBondContact O-CA 3.37Å; L65-V79 PolarHBondContact N-O 3.06Å; L65-V79 PolarHBondContact O-N 3.34Å; L65-L81 HydrophobicContact CB-CD2 3.94Å; L65-L81 HydrophobicContact CD1-CD2 4.45Å
66	L	93	Very high	82.1	Confident	10 Å²	10	63.3 Å²	63.3	5%	0.052	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.9	169	-57.9	-172.2	0	0	0	109.4	S59 I61 F76 A78 C89 Y127 F129	S59-L66 PolarHBondContact N-O 3.3Å; S59-L66 WeakPolarHBondContact O-CB 3.49Å; S59-L66 PolarHBondContact O-N 3.41Å; I61-L66 HydrophobicContact CG1-CD1 3.69Å; I61-L66 HydrophobicContact CG1-CG 3.93Å; L66-F76 HydrophobicContact CD2-CB 4.48Å; L66-A78 HydrophobicContact CD2-CB 3.84Å; L66-C89 HydrophobicContact CD2-CB 3.63Å; L66-Y127 HydrophobicContact CD1-CD1 4.14Å; L66-Y127 HydrophobicContact CD1-CE1 4.12Å; L66-F129 HydrophobicContact CD2-CE1 4.1Å; L66-F129 HydrophobicContact CD2-CZ 4.43Å
67	L	90.7	Very high	84.6	Confident	50 Å²	50	60.7 Å²	60.7	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-139	-178.2	-58.1	-176.4	0	0	0	109.8	L65 R77 V79	L65-L67 HydrophobicContact CD2-CD2 3.93Å; L65-L67 HydrophobicContact CG-CD2 4.06Å; L67-R77 WeakPolarHBondContact CB-O 3.18Å; L67-R77 HydrophobicContact CD1-CG 4.5Å; L67-R77 PolarHBondContact N-O 3.2Å; L67-V79 HydrophobicContact CD1-CG2 3.64Å; L67-V79 HydrophobicContact CG-CG2 4.47Å
68	E	85.5	Confident	86.9	Confident	79 Å²	79	55.5 Å²	55.5	37%	0.369	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	148.3	177.1	62.8	-112.6	130.3	0	0	112.9	R77	E68-R77 PolarHBondContact O-N 3.33Å; E68-R77 IonicContact OE1-CZ 3.59Å; E68-R77 IonicContact OE1-NH1 2.74Å; E68-R77 PolarHBondContact OE1-NH1 3.12Å
69	P	88.2	Confident	88.6	Confident	72 Å²	72	52.9 Å²	52.9	47%	0.468	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	143.7	163.9	28	-33.2	0	0	0	110.4	G72 V75 F76	P69-G72 VanDerWaalsContact CB-O 3.25Å; P69-G72 WeakPolarHBondContact CB-O 3.39Å; P69-V75 CarbonylContact C-O 3.55Å; P69-V75 WeakPolarHBondContact CA-O 3.32Å; P69-F76 HydrophobicContact CB-CD1 4.19Å; P69-F76 HydrophobicContact CB-CE1 4.11Å
70	L	83.7	Confident	89.3	Confident	100 Å²	100	52.4 Å²	52.4	52%	0.524	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-37.2	172.3	-65.8	172.4	0	0	0	111.1	V75 R77 V88	L70-V75 HydrophobicContact CB-CG1 4.34Å; L70-V75 PolarHBondContact N-O 2.89Å; L70-R77 HydrophobicContact CD1-CB 4.11Å; L70-R77 HydrophobicContact CD2-CB 4.15Å; L70-R77 HydrophobicContact CG-CB 4.09Å; L70-V88 HydrophobicContact CD1-CG1 4.42Å; L70-V88 HydrophobicContact CD1-CG2 4.07Å
71	E	76.9	Confident	89.5	Confident	115 Å²	115	53.3 Å²	53.3	54%	0.537	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	122.4	-178.1	-170.8	164.8	-142.9	0	0	109.8	V75	E71-V75 HydrophobicContact CB-CB 4.08Å; E71-V75 HydrophobicContact CB-CG2 4.2Å; E71-V75 PolarHBondContact N-O 2.88Å; E71-V75 PolarHBondContact O-N 2.98Å; E71-V75 VanDerWaalsContact O-N 3.1Å
72	G	77.8	Confident	89.6	Confident	64 Å²	64	61.1 Å²	61.1	66%	0.66	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	-149.8	-172.9	0	0	0	0	0	113.7	P69	P69-G72 VanDerWaalsContact CB-O 3.25Å; P69-G72 WeakPolarHBondContact CB-O 3.39Å
73	D	79.4	Confident	89.8	Confident	112 Å²	112	62.6 Å²	62.6	60%	0.599	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	19	168.5	66.9	-51	0	0	0	111.9	F76	D73-F76 VanDerWaalsContact O-CE2 3.24Å; D73-F76 WeakPolarHBondContact O-CE2 3.23Å; D73-F76 WeakPolarHBondContact O-CZ 3.31Å
74	H	86.7	Confident	89.9	Confident	108 Å²	108	64.2 Å²	64.2	50%	0.5	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-19.9	-173.3	-63.1	-0.1	0	0	0	113.7	K90 V91	H74-K90 CarbonylContact O-C 3.55Å; H74-K90 WeakPolarHBondContact O-CA 3.3Å; H74-V91 PolarHBondContact O-N 2.96Å
75	V	92.1	Very high	89.9	Confident	21 Å²	21	68.8 Å²	68.8	13%	0.127	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.5	177.1	-169.2	0	0	0	0	109.9	P69 L70 E71 V88 K90	P69-V75 CarbonylContact C-O 3.55Å; P69-V75 WeakPolarHBondContact CA-O 3.32Å; L70-V75 HydrophobicContact CB-CG1 4.34Å; L70-V75 PolarHBondContact N-O 2.89Å; E71-V75 HydrophobicContact CB-CB 4.08Å; E71-V75 HydrophobicContact CB-CG2 4.2Å; E71-V75 PolarHBondContact N-O 2.88Å; E71-V75 PolarHBondContact O-N 2.98Å; E71-V75 VanDerWaalsContact O-N 3.1Å; V75-V88 HydrophobicContact CG1-CG1 3.53Å; V75-K90 HydrophobicContact CG1-CG 4.48Å; V75-K90 HydrophobicContact CG2-CG 4.3Å
76	F	93.9	Very high	89.9	Confident	40 Å²	40	69 Å²	69	18%	0.175	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.7	-175.5	-62.9	-95.5	0	0	0	111.9	L66 P69 D73 C89 V91	L66-F76 HydrophobicContact CD2-CB 4.48Å; P69-F76 HydrophobicContact CB-CD1 4.19Å; P69-F76 HydrophobicContact CB-CE1 4.11Å; D73-F76 VanDerWaalsContact O-CE2 3.24Å; D73-F76 WeakPolarHBondContact O-CE2 3.23Å; D73-F76 WeakPolarHBondContact O-CZ 3.31Å; F76-C89 PolarHBondContact N-O 3.37Å; F76-C89 PolarHBondContact O-N 2.81Å; F76-V91 HydrophobicContact CD2-CG2 3.72Å; F76-V91 HydrophobicContact CE2-CG2 3.73Å
77	R	94.3	Very high	90	Very high	66 Å²	66	68.8 Å²	68.8	25%	0.249	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	135.7	161.5	-178.2	165.7	162.1	-104.6	-3.3	108.7	L67 E68 L70 E86	L67-R77 WeakPolarHBondContact CB-O 3.18Å; L67-R77 HydrophobicContact CD1-CG 4.5Å; L67-R77 PolarHBondContact N-O 3.2Å; E68-R77 PolarHBondContact O-N 3.33Å; E68-R77 IonicContact OE1-CZ 3.59Å; E68-R77 IonicContact OE1-NH1 2.74Å; E68-R77 PolarHBondContact OE1-NH1 3.12Å; L70-R77 HydrophobicContact CD1-CB 4.11Å; L70-R77 HydrophobicContact CD2-CB 4.15Å; L70-R77 HydrophobicContact CG-CB 4.09Å; R77-E86 IonicContact CZ-OE1 2.73Å; R77-E86 IonicContact CZ-OE2 2.7Å; R77-E86 IonicContact NE-OE1 3.88Å; R77-E86 IonicContact NE-OE2 2.96Å; R77-E86 PolarHBondContact NE-OE2 2.8Å; R77-E86 VanDerWaalsContact NH2-CD 3.25Å; R77-E86 IonicContact NH2-OE1 3.89Å; R77-E86 PolarHBondContact NH2-OE1 2.93Å; R77-E86 IonicContact NH2-OE2 2.91Å; R77-E86 PolarHBondContact NH2-OE2 3.4Å
78	A	95.1	Very high	90.3	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	150.8	-178.7	0	0	0	0	0	111.3	L65 L66 E86 L87 C89 F129	L65-A78 CarbonylContact O-C 3.58Å; L65-A78 VanDerWaalsContact O-CA 3.27Å; L65-A78 WeakPolarHBondContact O-CA 3.37Å; L66-A78 HydrophobicContact CD2-CB 3.84Å; A78-E86 WeakPolarHBondContact O-CA 3.2Å; A78-L87 HydrophobicContact CB-CB 4.31Å; A78-L87 PolarHBondContact N-O 3.34Å; A78-L87 PolarHBondContact O-N 2.95Å; A78-C89 HydrophobicContact CB-CB 4.09Å; A78-F129 HydrophobicContact CB-CD1 4.19Å; A78-F129 HydrophobicContact CB-CE1 3.96Å
79	V	95.4	Very high	90.8	Very high	28 Å²	28	63.6 Å²	63.6	17%	0.17	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.1	174.6	177.9	0	0	0	0	110.2	Y64 L65 L67 L81 E85 E86	Y64-V79 CarbonylContact C-O 3.58Å; Y64-V79 WeakPolarHBondContact CA-O 3.07Å; L65-V79 PolarHBondContact N-O 3.06Å; L65-V79 PolarHBondContact O-N 3.34Å; L67-V79 HydrophobicContact CD1-CG2 3.64Å; L67-V79 HydrophobicContact CG-CG2 4.47Å; V79-L81 PolarHBondContact O-N 2.97Å; V79-E85 CarbonylContact C-O 3.59Å; V79-E85 WeakPolarHBondContact CA-O 3.28Å; V79-E86 HydrophobicContact CG2-CG 4.38Å
80	H	95	Very high	91.1	Very high	30 Å²	30	61.1 Å²	61.1	14%	0.139	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.5	174.4	-177.9	-119.7	0	0	0	110.9	K63 Y64 H82 S83 A84 E85 L87	K63-H80 WeakPolarHBondContact CD-NE2 3.36Å; K63-H80 WeakPolarHBondContact CE-NE2 3.45Å; K63-H80 PolarHBondContact O-CD2 2.85Å; Y64-H80 HydrophobicContact CD1-CB 3.89Å; Y64-H80 AromaticContact CD1-CD2 3.98Å; Y64-H80 HydrophobicContact CE1-CB 3.82Å; Y64-H80 AromaticContact CE1-CD2 3.7Å; H80-H82 PolarHBondContact O-N 3.03Å; H80-S83 PolarHBondContact ND1-OG 3.19Å; H80-S83 PolarHBondContact O-N 3.05Å; H80-A84 WeakPolarHBondContact O-CA 3.49Å; H80-A84 PolarHBondContact O-N 3.11Å; H80-E85 HydrophobicContact CB-CB 4.36Å; H80-E85 PolarHBondContact N-O 3.19Å; H80-L87 HydrophobicContact CB-CD1 3.99Å
81	L	92.1	Very high	91.6	Very high	88 Å²	88	57.4 Å²	57.4	46%	0.461	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.7	-166.4	-71.4	171.8	0	0	0	115.5	K63 L65 V79	K63-L81 WeakPolarHBondContact O-CB 3.28Å; K63-L81 WeakPolarHBondContact O-CG 3.21Å; K63-L81 PolarHBondContact O-N 2.9Å; L65-L81 HydrophobicContact CB-CD2 3.94Å; L65-L81 HydrophobicContact CD1-CD2 4.45Å; V79-L81 PolarHBondContact O-N 2.97Å
82	H	91	Very high	92.4	Very high	166 Å²	166	52.8 Å²	52.8	77%	0.769	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-25.1	-175.4	-65.7	80	0	0	0	114.5	H80	H80-H82 PolarHBondContact O-N 3.03Å
83	S	94.4	Very high	93.2	Very high	64 Å²	64	53 Å²	53	45%	0.448	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-10.3	177.5	54.9	0	0	0	0	113.5	H80 E85	H80-S83 PolarHBondContact ND1-OG 3.19Å; H80-S83 PolarHBondContact O-N 3.05Å; S83-E85 PolarHBondContact O-N 3.25Å; S83-E85 VanDerWaalsContact O-N 3.12Å; S83-E85 WeakPolarHBondContact OG-CB 3.38Å; S83-E85 PolarHBondContact OG-OE2 2.9Å
84	A	93.4	Very high	93.9	Very high	78 Å²	78	50.6 Å²	50.6	65%	0.645	27%	0.265	S	S	*	.			trans	55.4	16.9	-167.6	0	0	0	0	0	114.2	H80	H80-A84 WeakPolarHBondContact O-CA 3.49Å; H80-A84 PolarHBondContact O-N 3.11Å
85	E	94.4	Very high	94.2	Very high	102 Å²	102	48.8 Å²	48.8	48%	0.477	28%	0.275	S	S	.	.			trans	-67.7	140.9	176.2	-178.2	178.9	-174.6	0	0	110.9	V79 H80 S83 L87	V79-E85 CarbonylContact C-O 3.59Å; V79-E85 WeakPolarHBondContact CA-O 3.28Å; H80-E85 HydrophobicContact CB-CB 4.36Å; H80-E85 PolarHBondContact N-O 3.19Å; S83-E85 PolarHBondContact O-N 3.25Å; S83-E85 VanDerWaalsContact O-N 3.12Å; S83-E85 WeakPolarHBondContact OG-CB 3.38Å; S83-E85 PolarHBondContact OG-OE2 2.9Å; E85-L87 HydrophobicContact CB-CD1 4.41Å; E85-L87 HydrophobicContact CG-CD1 4.15Å; E85-L87 WeakPolarHBondContact O-CD1 3.38Å
86	E	95.1	Very high	94.2	Very high	57 Å²	57	50 Å²	50	27%	0.266	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	135.4	178.1	-63.1	-159.9	-167.5	0	0	112.2	R77 A78 V79 R132	R77-E86 IonicContact CZ-OE1 2.73Å; R77-E86 IonicContact CZ-OE2 2.7Å; R77-E86 IonicContact NE-OE1 3.88Å; R77-E86 IonicContact NE-OE2 2.96Å; R77-E86 PolarHBondContact NE-OE2 2.8Å; R77-E86 VanDerWaalsContact NH2-CD 3.25Å; R77-E86 IonicContact NH2-OE1 3.89Å; R77-E86 PolarHBondContact NH2-OE1 2.93Å; R77-E86 IonicContact NH2-OE2 2.91Å; R77-E86 PolarHBondContact NH2-OE2 3.4Å; A78-E86 WeakPolarHBondContact O-CA 3.2Å; V79-E86 HydrophobicContact CG2-CG 4.38Å; E86-R132 HydrophobicContact CB-CB 4.25Å; E86-R132 VanDerWaalsContact CD-NH1 3.31Å; E86-R132 WeakPolarHBondContact O-CB 3.47Å; E86-R132 IonicContact OE1-NH1 3.76Å; E86-R132 WeakPolarHBondContact OE2-CD 3.2Å; E86-R132 IonicContact OE2-CZ 3.35Å; E86-R132 IonicContact OE2-NE 2.77Å; E86-R132 IonicContact OE2-NH1 3.7Å; E86-R132 PolarHBondContact OE2-NH1 3.36Å
87	L	95.6	Very high	94.2	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	164.1	-178.6	-64.9	95.6	0	0	0	110.3	Y64 A78 H80 E85 T117 F129 F130	Y64-L87 HydrophobicContact CD1-CD1 4.1Å; Y64-L87 HydrophobicContact CE1-CD1 3.79Å; Y64-L87 HydrophobicContact CE1-CD2 3.8Å; Y64-L87 HydrophobicContact CE1-CG 4.42Å; A78-L87 HydrophobicContact CB-CB 4.31Å; A78-L87 PolarHBondContact N-O 3.34Å; A78-L87 PolarHBondContact O-N 2.95Å; H80-L87 HydrophobicContact CB-CD1 3.99Å; E85-L87 HydrophobicContact CB-CD1 4.41Å; E85-L87 HydrophobicContact CG-CD1 4.15Å; E85-L87 WeakPolarHBondContact O-CD1 3.38Å; L87-T117 HydrophobicContact CD2-CG2 4.19Å; L87-F129 HydrophobicContact CD2-CB 4.02Å; L87-F130 CarbonylContact C-O 3.59Å; L87-F130 VanDerWaalsContact CA-O 3.28Å; L87-F130 WeakPolarHBondContact CA-O 3.35Å; L87-F130 VanDerWaalsContact CB-O 3.27Å; L87-F130 WeakPolarHBondContact CB-O 3.44Å
88	V	95.8	Very high	94.1	Very high	21 Å²	21	52.2 Å²	52.2	13%	0.127	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	135.1	162.3	178.1	0	0	0	0	108.1	L70 V75 F129 F130	L70-V88 HydrophobicContact CD1-CG1 4.42Å; L70-V88 HydrophobicContact CD1-CG2 4.07Å; V75-V88 HydrophobicContact CG1-CG1 3.53Å; V88-F129 CarbonylContact O-C 3.56Å; V88-F129 WeakPolarHBondContact O-CA 3.34Å; V88-F130 PolarHBondContact N-O 3.12Å; V88-F130 PolarHBondContact O-N 2.82Å
89	C	95.8	Very high	94	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.2	172.1	179.6	0	0	0	0	109.6	L66 F76 A78 V128 F129	L66-C89 HydrophobicContact CD2-CB 3.63Å; F76-C89 PolarHBondContact N-O 3.37Å; F76-C89 PolarHBondContact O-N 2.81Å; A78-C89 HydrophobicContact CB-CB 4.09Å; C89-V128 CarbonylContact C-O 3.52Å; C89-V128 WeakPolarHBondContact CA-O 3.44Å; C89-F129 HydrophobicContact CB-CD1 3.89Å; C89-F129 HydrophobicContact CB-CE1 3.7Å; C89-F129 HydrophobicContact CB-CZ 4.35Å
90	K	94.9	Very high	93.9	Very high	19 Å²	19	61.2 Å²	61.2	8%	0.083	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139.8	164.6	-68.9	-160.7	177.6	-172.5	0	110	H74 V75 F92 V128 F130 E194 E197	H74-K90 CarbonylContact O-C 3.55Å; H74-K90 WeakPolarHBondContact O-CA 3.3Å; V75-K90 HydrophobicContact CG1-CG 4.48Å; V75-K90 HydrophobicContact CG2-CG 4.3Å; K90-F92 HydrophobicContact CB-CD2 4.26Å; K90-F92 HydrophobicContact CB-CE2 3.5Å; K90-F92 VanDerWaalsContact CB-CE2 3.5Å; K90-F92 HydrophobicContact CB-CZ 3.92Å; K90-F92 HydrophobicContact CD-CE2 4.32Å; K90-F92 HydrophobicContact CD-CZ 3.9Å; K90-V128 PolarHBondContact N-O 3.5Å; K90-V128 PolarHBondContact O-N 2.82Å; K90-F130 HydrophobicContact CB-CE2 4.23Å; K90-F130 HydrophobicContact CD-CE2 4.31Å; K90-F130 HydrophobicContact CG-CE2 4.05Å; K90-E194 WeakPolarHBondContact CE-OE1 3.43Å; K90-E194 IonicContact NZ-OE1 2.62Å; K90-E194 PolarHBondContact NZ-OE1 3.45Å; K90-E194 IonicContact NZ-OE2 3.82Å; K90-E194 PolarHBondContact NZ-OE2 2.76Å; K90-E197 IonicContact NZ-OE1 3.66Å; K90-E197 PolarHBondContact NZ-OE1 2.92Å; K90-E197 IonicContact NZ-OE2 2.7Å
91	V	94.2	Very high	93.9	Very high	23 Å²	23	59.9 Å²	59.9	14%	0.139	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	112.3	-178.3	-173.9	0	0	0	0	109.2	H74 F76 K125 Y127	H74-V91 PolarHBondContact O-N 2.96Å; F76-V91 HydrophobicContact CD2-CG2 3.72Å; F76-V91 HydrophobicContact CE2-CG2 3.73Å; V91-K125 HydrophobicContact CG1-CB 3.91Å; V91-K125 HydrophobicContact CG1-CD 4.26Å; V91-K125 HydrophobicContact CG1-CG 4.09Å; V91-Y127 HydrophobicContact CG1-CD1 4.25Å; V91-Y127 HydrophobicContact CG1-CE1 4.03Å; V91-Y127 HydrophobicContact CG2-CD1 3.81Å; V91-Y127 HydrophobicContact CG2-CE1 4.03Å
92	F	93.9	Very high	94	Very high	17 Å²	17	57 Å²	57	8%	0.075	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	160.1	179.9	-62.4	-86.7	0	0	0	111.1	K90 L100 L101 K125 A126 V128 E197	K90-F92 HydrophobicContact CB-CD2 4.26Å; K90-F92 HydrophobicContact CB-CE2 3.5Å; K90-F92 VanDerWaalsContact CB-CE2 3.5Å; K90-F92 HydrophobicContact CB-CZ 3.92Å; K90-F92 HydrophobicContact CD-CE2 4.32Å; K90-F92 HydrophobicContact CD-CZ 3.9Å; F92-L100 HydrophobicContact CD1-CD1 3.72Å; F92-L100 HydrophobicContact CE1-CD1 4.14Å; F92-L101 HydrophobicContact CE2-CD2 4.22Å; F92-L101 HydrophobicContact CZ-CD2 4.13Å; F92-K125 CarbonylContact O-C 3.59Å; F92-K125 VanDerWaalsContact O-CA 3.28Å; F92-K125 WeakPolarHBondContact O-CA 3.39Å; F92-K125 WeakPolarHBondContact O-CD 3.4Å; F92-A126 HydrophobicContact CB-CB 4.49Å; F92-A126 PolarHBondContact N-O 3.43Å; F92-A126 PolarHBondContact O-N 3.37Å; F92-V128 HydrophobicContact CD2-CB 4.21Å; F92-V128 HydrophobicContact CD2-CG2 3.55Å; F92-V128 HydrophobicContact CE2-CB 3.94Å; F92-V128 HydrophobicContact CE2-CG2 3.71Å; F92-E197 HydrophobicContact CE1-CG 4.24Å; F92-E197 WeakPolarHBondContact CE1-OE2 3.22Å; F92-E197 HydrophobicContact CZ-CG 4.3Å
93	D	94.3	Very high	94.1	Very high	69 Å²	69	49.3 Å²	49.3	37%	0.369	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	137.7	166.9	-159.6	-84.5	0	0	0	111.6	G95 C96 Y97 K125	D93-G95 PolarHBondContact O-N 3.33Å; D93-G95 PolarHBondContact OD1-N 3.12Å; D93-C96 PolarHBondContact O-N 3.33Å; D93-Y97 PolarHBondContact O-N 3.22Å; D93-K125 IonicContact OD2-NZ 3.64Å; D93-K125 PolarHBondContact OD2-NZ 2.98Å
94	I	93.7	Very high	94	Very high	62 Å²	62	47.9 Å²	47.9	32%	0.318	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.1	-178.3	-159.1	164.1	0	0	0	112.6	Y97 L121 G122 T124	I94-Y97 HydrophobicContact CG1-CD1 4.45Å; I94-Y97 HydrophobicContact CG1-CE1 4.23Å; I94-Y97 WeakPolarHBondContact O-CD1 3.36Å; I94-L121 HydrophobicContact CD1-CB 4.44Å; I94-G122 WeakPolarHBondContact CD1-O 3.32Å; I94-T124 WeakPolarHBondContact CG2-O 3.33Å; I94-T124 PolarHBondContact N-O 2.72Å; I94-T124 VanDerWaalsContact N-O 3.11Å
95	G	93.1	Very high	93.9	Very high	70 Å²	70	49.6 Å²	49.6	72%	0.722	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-28.9	174.7	0	0	0	0	0	115	D93	D93-G95 PolarHBondContact O-N 3.33Å; D93-G95 PolarHBondContact OD1-N 3.12Å
96	C	92	Very high	93.7	Very high	45 Å²	45	48.3 Å²	48.3	30%	0.304	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-13	-171	66.7	0	0	0	0	115.6	D93 Q98 E99 L100	D93-C96 PolarHBondContact O-N 3.33Å; C96-Q98 PolarHBondContact O-N 2.86Å; C96-E99 PolarHBondContact O-N 3.26Å; C96-L100 PolarHBondContact O-N 3.06Å
97	Y	94	Very high	93.5	Very high	27 Å²	27	46.6 Å²	46.6	11%	0.106	26%	0.263	C	S	.	.	H	α-helix	trans	-55.8	-29.4	-174.3	85.2	-78.1	0	0	0	114.2	D93 I94 L101 I119 L121 A126	D93-Y97 PolarHBondContact O-N 3.22Å; I94-Y97 HydrophobicContact CG1-CD1 4.45Å; I94-Y97 HydrophobicContact CG1-CE1 4.23Å; I94-Y97 WeakPolarHBondContact O-CD1 3.36Å; Y97-L101 HydrophobicContact CD2-CD1 4.05Å; Y97-L101 VanDerWaalsContact O-CB 3.28Å; Y97-L101 WeakPolarHBondContact O-CB 3.41Å; Y97-L101 WeakPolarHBondContact O-CG 3.45Å; Y97-L101 PolarHBondContact O-N 2.87Å; Y97-I119 HydrophobicContact CE2-CG2 4.45Å; Y97-L121 HydrophobicContact CE1-CD2 4.15Å; Y97-L121 HydrophobicContact CE2-CD2 4.1Å; Y97-A126 HydrophobicContact CD1-CB 3.9Å; Y97-A126 HydrophobicContact CD2-CB 3.84Å; Y97-A126 HydrophobicContact CE1-CB 4.46Å; Y97-A126 HydrophobicContact CE2-CB 4.42Å; Y97-A126 HydrophobicContact CG-CB 3.57Å
98	Q	93.6	Very high	93.3	Very high	127 Å²	127	50.6 Å²	50.6	59%	0.593	29%	0.289	S	S	*	.	H	α-helix	trans	-69.3	-32.4	178.5	-62.7	-167.6	-1.5	0	0	112.9	C96 A102	C96-Q98 PolarHBondContact O-N 2.86Å; Q98-A102 WeakPolarHBondContact O-CB 3.37Å; Q98-A102 PolarHBondContact O-N 3.36Å; Q98-A102 VanDerWaalsContact O-N 3.12Å
99	E	92.3	Very high	93.2	Very high	157 Å²	157	53.5 Å²	53.5	73%	0.734	32%	0.315	S	S	*	.	H	α-helix	trans	-78.6	-45.4	179.4	-58.5	-169.7	148.9	0	0	110.2	C96 L101 A102	C96-E99 PolarHBondContact O-N 3.26Å; E99-L101 VanDerWaalsContact C-N 3.29Å; E99-L101 PolarHBondContact O-N 2.87Å; E99-A102 WeakPolarHBondContact O-CB 3.26Å; E99-A102 PolarHBondContact O-N 3.07Å
100	L	92.6	Very high	93.2	Very high	60 Å²	60	54.9 Å²	54.9	31%	0.314	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-32.4	176.9	-64.3	173.1	0	0	0	113.3	F92 C96	F92-L100 HydrophobicContact CD1-CD1 3.72Å; F92-L100 HydrophobicContact CE1-CD1 4.14Å; C96-L100 PolarHBondContact O-N 3.06Å
101	L	94.9	Very high	93.3	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-1.8	178.1	-57.8	176.1	0	0	0	113.6	F92 Y97 E99 P103 C104 F105 I116 I119 V128	F92-L101 HydrophobicContact CE2-CD2 4.22Å; F92-L101 HydrophobicContact CZ-CD2 4.13Å; Y97-L101 HydrophobicContact CD2-CD1 4.05Å; Y97-L101 VanDerWaalsContact O-CB 3.28Å; Y97-L101 WeakPolarHBondContact O-CB 3.41Å; Y97-L101 WeakPolarHBondContact O-CG 3.45Å; Y97-L101 PolarHBondContact O-N 2.87Å; E99-L101 VanDerWaalsContact C-N 3.29Å; E99-L101 PolarHBondContact O-N 2.87Å; L101-P103 VanDerWaalsContact C-CD 3.42Å; L101-P103 VanDerWaalsContact C-N 3.31Å; L101-C104 VanDerWaalsContact O-CB 3.31Å; L101-C104 WeakPolarHBondContact O-CB 3.43Å; L101-C104 PolarHBondContact O-N 2.78Å; L101-F105 HydrophobicContact CB-CD2 4.3Å; L101-F105 HydrophobicContact CB-CE2 3.63Å; L101-F105 HydrophobicContact CB-CZ 4.17Å; L101-F105 WeakPolarHBondContact O-CD2 3.36Å; L101-F105 PolarHBondContact O-N 2.98Å; L101-I116 HydrophobicContact CD1-CD1 4.3Å; L101-I116 HydrophobicContact CD2-CD1 4.27Å; L101-I119 HydrophobicContact CD1-CD1 4.05Å; L101-V128 HydrophobicContact CD1-CG1 4.36Å; L101-V128 HydrophobicContact CD1-CG2 3.82Å
102	A	94.3	Very high	93.4	Very high	28 Å²	28	59.2 Å²	59.2	23%	0.231	34%	0.338	C	S	.	.	H	α-helix	trans	-53	-41.2	177.4	0	0	0	0	0	113.2	Q98 E99 C104 F105 C106 I201	Q98-A102 WeakPolarHBondContact O-CB 3.37Å; Q98-A102 PolarHBondContact O-N 3.36Å; Q98-A102 VanDerWaalsContact O-N 3.12Å; E99-A102 WeakPolarHBondContact O-CB 3.26Å; E99-A102 PolarHBondContact O-N 3.07Å; A102-C104 VanDerWaalsContact C-N 3.28Å; A102-C104 PolarHBondContact O-N 3.44Å; A102-F105 PolarHBondContact O-N 2.85Å; A102-F105 VanDerWaalsContact O-N 3.09Å; A102-C106 PolarHBondContact O-N 2.89Å; A102-C106 PolarHBondContact O-SG 2.85Å; A102-C106 VanDerWaalsContact O-SG 3.41Å; A102-I201 HydrophobicContact CB-CD1 3.81Å
103	P	94.1	Very high	93.6	Very high	4 Å²	4	58.7 Å²	58.7	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-57	-38	174.3	-28	38.2	0	0	0	113.7	L101 F105 C106 L107 L171 L196 A199 I201	L101-P103 VanDerWaalsContact C-CD 3.42Å; L101-P103 VanDerWaalsContact C-N 3.31Å; P103-F105 VanDerWaalsContact C-N 3.31Å; P103-F105 PolarHBondContact O-N 2.84Å; P103-C106 PolarHBondContact O-N 2.87Å; P103-L107 PolarHBondContact O-N 3.45Å; P103-L171 HydrophobicContact CB-CD1 3.85Å; P103-L171 HydrophobicContact CB-CD2 4.27Å; P103-L196 HydrophobicContact CB-CB 3.85Å; P103-L196 HydrophobicContact CB-CD1 4.45Å; P103-A199 HydrophobicContact CB-CB 4.13Å; P103-A199 HydrophobicContact CG-CB 4.14Å; P103-I201 HydrophobicContact CG-CD1 4.2Å; P103-I201 HydrophobicContact CG-CG1 4.11Å
104	C	92.4	Very high	93.6	Very high	34 Å²	34	56 Å²	56	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-67.7	-28.4	178	-59.1	0	0	0	0	112.9	L101 A102 I116	L101-C104 VanDerWaalsContact O-CB 3.31Å; L101-C104 WeakPolarHBondContact O-CB 3.43Å; L101-C104 PolarHBondContact O-N 2.78Å; A102-C104 VanDerWaalsContact C-N 3.28Å; A102-C104 PolarHBondContact O-N 3.44Å; C104-I116 HydrophobicContact CB-CD1 3.98Å
105	F	91.2	Very high	93.6	Very high	114 Å²	114	56.5 Å²	56.5	50%	0.5	32%	0.323	S	S	.	.	H	α-helix	trans	-90	-19.1	177.9	-56.7	-54.7	0	0	0	113.5	L101 A102 P103 I116 I119	L101-F105 HydrophobicContact CB-CD2 4.3Å; L101-F105 HydrophobicContact CB-CE2 3.63Å; L101-F105 HydrophobicContact CB-CZ 4.17Å; L101-F105 WeakPolarHBondContact O-CD2 3.36Å; L101-F105 PolarHBondContact O-N 2.98Å; A102-F105 PolarHBondContact O-N 2.85Å; A102-F105 VanDerWaalsContact O-N 3.09Å; P103-F105 VanDerWaalsContact C-N 3.31Å; P103-F105 PolarHBondContact O-N 2.84Å; F105-I116 HydrophobicContact CE1-CD1 4.29Å; F105-I116 HydrophobicContact CZ-CD1 4.32Å; F105-I119 HydrophobicContact CE1-CD1 4.46Å; F105-I119 HydrophobicContact CZ-CD1 3.83Å
106	C	89.3	Confident	93.7	Very high	75 Å²	75	55.2 Å²	55.2	51%	0.507	30%	0.299	S	S	.	.	H	α-helix	trans	-82.6	-26	175.9	-72	0	0	0	0	113.5	A102 P103	A102-C106 PolarHBondContact O-N 2.89Å; A102-C106 PolarHBondContact O-SG 2.85Å; A102-C106 VanDerWaalsContact O-SG 3.41Å; P103-C106 PolarHBondContact O-N 2.87Å
107	L	91.4	Very high	93.8	Very high	21 Å²	21	56.4 Å²	56.4	11%	0.11	31%	0.305	C	S	.	.	S	Bend	trans	-86.2	145	178.5	-71.7	-175.4	0	0	0	113.5	P103 I113 L171 L196	P103-L107 PolarHBondContact O-N 3.45Å; L107-I113 HydrophobicContact CD1-CD1 3.89Å; L107-L171 HydrophobicContact CD1-CD1 3.65Å; L107-L171 HydrophobicContact CD2-CD1 4.16Å; L107-L171 HydrophobicContact CD2-CG 4.15Å; L107-L171 HydrophobicContact CG-CD1 3.81Å; L107-L171 HydrophobicContact CG-CG 4.3Å; L107-L196 HydrophobicContact CD1-CD1 3.78Å
108	P	92.3	Very high	93.9	Very high	89 Å²	89	57.4 Å²	57.4	58%	0.578	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-62.3	149.9	157.8	-16.6	30.6	0	0	0	110.9	H165	P108-H165 PolarHBondContact O-CE1 3.28Å; P108-H165 PolarHBondContact O-NE2 3.08Å
109	A	93.1	Very high	94	Very high	81 Å²	81	52.5 Å²	52.5	67%	0.669	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-61.1	136.2	177.7	0	0	0	0	0	112.1
110	H	96.2	Very high	94.1	Very high	30 Å²	30	45.1 Å²	45.1	14%	0.139	25%	0.254	C	S	.	.			trans	-133.6	140.3	180	-173.8	-119.8	0	0	0	112.4	N112 I113 S161 H165	H110-N112 PolarHBondContact ND1-N 2.9Å; H110-N112 PolarHBondContact O-N 2.97Å; H110-N112 VanDerWaalsContact O-N 3.11Å; H110-I113 HydrophobicContact CB-CB 4.33Å; H110-I113 HydrophobicContact CB-CD1 3.97Å; H110-I113 HydrophobicContact CB-CG1 4.1Å; H110-I113 PolarHBondContact O-N 2.89Å; H110-S161 PolarHBondContact CE1-O 2.83Å; H110-S161 VanDerWaalsContact CE1-O 3.3Å; H110-S161 PolarHBondContact CE1-OG 3.17Å; H110-H165 AromaticContact CD2-ND1 3.83Å; H110-H165 AromaticContact CG-CG 3.82Å; H110-H165 AromaticContact CG-ND1 3.8Å
111	K	96.1	Very high	94.3	Very high	128 Å²	128	43.9 Å²	43.9	56%	0.557	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.5	-174	76.1	-162.5	177.1	-169.4	0	114	K184	K111-K184 PolarHBondContact O-NZ 2.63Å
112	N	97.6	Very high	94.1	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	18.8	-178.8	-59	114.7	0	0	0	113.3	H110 Q158 A162 V191 K192 L193	H110-N112 PolarHBondContact ND1-N 2.9Å; H110-N112 PolarHBondContact O-N 2.97Å; H110-N112 VanDerWaalsContact O-N 3.11Å; N112-Q158 PolarHBondContact ND2-OE1 3.08Å; N112-Q158 VanDerWaalsContact ND2-OE1 3.08Å; N112-A162 HydrophobicContact CB-CB 4.03Å; N112-A162 WeakPolarHBondContact O-CB 3.37Å; N112-V191 PolarHBondContact ND2-O 2.99Å; N112-K192 CarbonylContact O-C 3.57Å; N112-K192 WeakPolarHBondContact O-CA 3.39Å; N112-L193 PolarHBondContact O-N 2.8Å
113	I	96.9	Very high	93.8	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.036	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-121.3	136.7	169.7	-61.2	176.9	0	0	0	107.9	L107 H110 Q115 A162 C166 L196	L107-I113 HydrophobicContact CD1-CD1 3.89Å; H110-I113 HydrophobicContact CB-CB 4.33Å; H110-I113 HydrophobicContact CB-CD1 3.97Å; H110-I113 HydrophobicContact CB-CG1 4.1Å; H110-I113 PolarHBondContact O-N 2.89Å; I113-Q115 PolarHBondContact O-N 2.84Å; I113-Q115 PolarHBondContact O-NE2 2.84Å; I113-A162 HydrophobicContact CG1-CB 4.14Å; I113-C166 VanDerWaalsContact CD1-SG 3.54Å; I113-L196 HydrophobicContact CG2-CD1 3.99Å; I113-L196 HydrophobicContact CG2-CG 4.43Å
114	N	95	Very high	93.7	Very high	13 Å²	13	52.7 Å²	52.7	7%	0.07	29%	0.294	C	S	.	.			trans	-61.9	131.2	177.8	-161.7	19.9	0	0	0	110.7	F130 K192 L193 E194	N114-F130 HydrophobicContact CB-CD1 4.41Å; N114-F130 VanDerWaalsContact CG-CD1 3.48Å; N114-F130 WeakPolarHBondContact ND2-CD1 3.48Å; N114-K192 HydrophobicContact CB-CD 3.91Å; N114-K192 HydrophobicContact CB-CG 4.45Å; N114-K192 WeakPolarHBondContact OD1-CD 3.34Å; N114-K192 WeakPolarHBondContact OD1-CE 3.45Å; N114-K192 PolarHBondContact OD1-NZ 3.28Å; N114-L193 WeakPolarHBondContact CB-O 3.37Å; N114-L193 PolarHBondContact N-O 3.23Å; N114-E194 WeakPolarHBondContact CB-O 3.5Å; N114-E194 PolarHBondContact ND2-O 2.7Å
115	Q	93.5	Very high	93.8	Very high	71 Å²	71	54.4 Å²	54.4	33%	0.332	30%	0.298	S	S	.	.			trans	-106.8	135.9	-175.7	-59.4	-58.7	-62.8	0	0	109.6	I113 T117 F130	I113-Q115 PolarHBondContact O-N 2.84Å; I113-Q115 PolarHBondContact O-NE2 2.84Å; Q115-T117 PolarHBondContact O-N 3.36Å; Q115-F130 WeakPolarHBondContact O-CD1 3.46Å
116	I	95.4	Very high	94	Very high	44 Å²	44	49 Å²	49	23%	0.226	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	119.8	175.4	-60.6	168.9	0	0	0	108.5	L101 C104 F105 I119 V128 F130	L101-I116 HydrophobicContact CD1-CD1 4.3Å; L101-I116 HydrophobicContact CD2-CD1 4.27Å; C104-I116 HydrophobicContact CB-CD1 3.98Å; F105-I116 HydrophobicContact CE1-CD1 4.29Å; F105-I116 HydrophobicContact CZ-CD1 4.32Å; I116-I119 HydrophobicContact CD1-CD1 4.44Å; I116-I119 HydrophobicContact CG2-CD1 4.13Å; I116-I119 HydrophobicContact CG2-CG1 3.64Å; I116-V128 HydrophobicContact CB-CG1 4.48Å; I116-V128 HydrophobicContact CD1-CG1 4.23Å; I116-V128 HydrophobicContact CG1-CG1 3.99Å; I116-V128 HydrophobicContact CG2-CG1 3.77Å; I116-F130 HydrophobicContact CB-CE1 4.42Å; I116-F130 HydrophobicContact CG1-CD1 4.39Å; I116-F130 HydrophobicContact CG1-CE1 3.59Å; I116-F130 HydrophobicContact CG1-CZ 3.97Å
117	T	94.4	Very high	94.3	Very high	70 Å²	70	46.8 Å²	46.8	43%	0.429	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-44.9	178.7	-51.2	0	0	0	0	111.7	L87 Q115 F129	L87-T117 HydrophobicContact CD2-CG2 4.19Å; Q115-T117 PolarHBondContact O-N 3.36Å; T117-F129 WeakPolarHBondContact CB-O 3.49Å; T117-F129 PolarHBondContact N-O 2.9Å
118	E	94.9	Very high	94.6	Very high	48 Å²	48	45.8 Å²	45.8	22%	0.224	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	152.4	177.9	-167.5	156.7	118.5	0	0	110.2	K63 Y64 I120 F129	K63-E118 VanDerWaalsContact CE-OE1 3.23Å; K63-E118 WeakPolarHBondContact CE-OE1 3.41Å; K63-E118 WeakPolarHBondContact CE-OE2 3.1Å; K63-E118 IonicContact NZ-OE1 2.63Å; K63-E118 PolarHBondContact NZ-OE1 3.45Å; K63-E118 IonicContact NZ-OE2 2.78Å; K63-E118 PolarHBondContact NZ-OE2 3.39Å; Y64-E118 HydrophobicContact CE2-CB 4.33Å; E118-I120 HydrophobicContact CG-CG1 4.22Å; E118-F129 HydrophobicContact CB-CB 4.49Å; E118-F129 HydrophobicContact CB-CD2 4.39Å; E118-F129 PolarHBondContact O-N 3.12Å
119	I	95.6	Very high	94.8	Very high	24 Å²	24	41.5 Å²	41.5	12%	0.123	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128.8	167.6	-55.2	-177.1	0	0	0	108	S6 Y97 L101 F105 I116 L121 Y127 V128	S6-I119 PolarHBondContact OG-O 3.09Å; Y97-I119 HydrophobicContact CE2-CG2 4.45Å; L101-I119 HydrophobicContact CD1-CD1 4.05Å; F105-I119 HydrophobicContact CE1-CD1 4.46Å; F105-I119 HydrophobicContact CZ-CD1 3.83Å; I116-I119 HydrophobicContact CD1-CD1 4.44Å; I116-I119 HydrophobicContact CG2-CD1 4.13Å; I116-I119 HydrophobicContact CG2-CG1 3.64Å; I119-L121 HydrophobicContact CG2-CD2 3.99Å; I119-Y127 CarbonylContact C-O 3.6Å; I119-Y127 WeakPolarHBondContact CA-O 3.42Å; I119-V128 HydrophobicContact CG1-CG1 4.29Å; I119-V128 HydrophobicContact CG1-CG2 4.27Å; I119-V128 HydrophobicContact CG2-CG2 4.28Å
120	I	95.4	Very high	94.9	Very high	1 Å²	1	38 Å²	38	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.1	174.8	-60.2	-179	0	0	0	108.4	I3 I61 Y64 E118 Y127 F129	I3-I120 HydrophobicContact CG2-CG2 3.46Å; I3-I120 VanDerWaalsContact CG2-CG2 3.46Å; I61-I120 HydrophobicContact CG2-CB 4.08Å; I61-I120 HydrophobicContact CG2-CD1 4.13Å; I61-I120 HydrophobicContact CG2-CG2 3.8Å; I61-I120 WeakPolarHBondContact O-CD1 3.37Å; Y64-I120 HydrophobicContact CD2-CD1 3.8Å; Y64-I120 HydrophobicContact CE2-CD1 4Å; E118-I120 HydrophobicContact CG-CG1 4.22Å; I120-Y127 PolarHBondContact N-O 2.91Å; I120-Y127 PolarHBondContact O-N 3.29Å; I120-F129 HydrophobicContact CB-CE2 4.34Å; I120-F129 HydrophobicContact CD1-CE2 3.85Å; I120-F129 HydrophobicContact CD1-CZ 4.45Å; I120-F129 HydrophobicContact CG1-CE2 4.04Å
121	L	95.1	Very high	94.9	Very high	35 Å²	35	40.6 Å²	40.6	18%	0.183	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.2	179.5	-57.6	-178.7	0	0	0	110.2	Q4 I94 Y97 I119 A126	Q4-L121 PolarHBondContact N-O 3.49Å; Q4-L121 PolarHBondContact O-N 3.3Å; I94-L121 HydrophobicContact CD1-CB 4.44Å; Y97-L121 HydrophobicContact CE1-CD2 4.15Å; Y97-L121 HydrophobicContact CE2-CD2 4.1Å; I119-L121 HydrophobicContact CG2-CD2 3.99Å; L121-A126 HydrophobicContact CD2-CB 3.65Å
122	G	91	Very high	94.8	Very high	15 Å²	15	39.4 Å²	39.4	16%	0.155	20%	0.196	C	C	.	.			trans	-95.4	-160.6	168.2	0	0	0	0	0	111.8	I94 K125	I94-G122 WeakPolarHBondContact CD1-O 3.32Å; G122-K125 PolarHBondContact N-O 3.06Å
123	E	89.3	Confident	94.7	Very high	109 Å²	109	40.8 Å²	40.8	51%	0.509	21%	0.206	S	C	.	.	S	Bend	trans	-77.8	-33.4	-179.8	-73.2	151.7	-171.8	0	0	112.8	M1 N2	M1-E123 VanDerWaalsContact C-OE1 3.32Å; M1-E123 VanDerWaalsContact CA-CD 3.49Å; M1-E123 WeakPolarHBondContact CA-OE1 3.4Å; M1-E123 WeakPolarHBondContact CA-OE2 3.43Å; M1-E123 PolarHBondContact N-OE1 2.86Å; M1-E123 PolarHBondContact N-OE2 3.32Å; N2-E123 PolarHBondContact N-OE1 3.11Å
124	T	91.6	Very high	94.6	Very high	93 Å²	93	44 Å²	44	57%	0.571	22%	0.218	S	C	*	.	S	Bend	trans	-133.2	-9.2	-177.6	54.5	0	0	0	0	114.1	I94	I94-T124 WeakPolarHBondContact CG2-O 3.33Å; I94-T124 PolarHBondContact N-O 2.72Å; I94-T124 VanDerWaalsContact N-O 3.11Å
125	K	94.8	Very high	94.6	Very high	71 Å²	71	44.9 Å²	44.9	31%	0.309	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.6	-174.7	-61	-61.6	174.3	-167.7	0	112.2	V91 F92 D93 G122 Y127	V91-K125 HydrophobicContact CG1-CB 3.91Å; V91-K125 HydrophobicContact CG1-CD 4.26Å; V91-K125 HydrophobicContact CG1-CG 4.09Å; F92-K125 CarbonylContact O-C 3.59Å; F92-K125 VanDerWaalsContact O-CA 3.28Å; F92-K125 WeakPolarHBondContact O-CA 3.39Å; F92-K125 WeakPolarHBondContact O-CD 3.4Å; D93-K125 IonicContact OD2-NZ 3.64Å; D93-K125 PolarHBondContact OD2-NZ 2.98Å; G122-K125 PolarHBondContact N-O 3.06Å; K125-Y127 HydrophobicContact CB-CE2 4.02Å
126	A	95.6	Very high	94.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.1	170.7	0	0	0	0	0	109.6	F92 Y97 L121	F92-A126 HydrophobicContact CB-CB 4.49Å; F92-A126 PolarHBondContact N-O 3.43Å; F92-A126 PolarHBondContact O-N 3.37Å; Y97-A126 HydrophobicContact CD1-CB 3.9Å; Y97-A126 HydrophobicContact CD2-CB 3.84Å; Y97-A126 HydrophobicContact CE1-CB 4.46Å; Y97-A126 HydrophobicContact CE2-CB 4.42Å; Y97-A126 HydrophobicContact CG-CB 3.57Å; L121-A126 HydrophobicContact CD2-CB 3.65Å
127	Y	95.9	Very high	94.9	Very high	28 Å²	28	40.7 Å²	40.7	11%	0.11	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	115.8	-177.1	-59	-94.4	0	0	0	108.9	I61 L66 V91 I119 I120 K125	I61-Y127 HydrophobicContact CD1-CD1 4.35Å; I61-Y127 HydrophobicContact CD1-CE1 3.87Å; I61-Y127 HydrophobicContact CD1-CE2 4.12Å; I61-Y127 HydrophobicContact CG1-CD1 4Å; I61-Y127 HydrophobicContact CG1-CE1 3.94Å; I61-Y127 HydrophobicContact CG1-CG 4.4Å; I61-Y127 HydrophobicContact CG2-CD1 4.19Å; I61-Y127 HydrophobicContact CG2-CD2 3.88Å; I61-Y127 HydrophobicContact CG2-CE2 4.42Å; I61-Y127 HydrophobicContact CG2-CG 3.76Å; L66-Y127 HydrophobicContact CD1-CD1 4.14Å; L66-Y127 HydrophobicContact CD1-CE1 4.12Å; V91-Y127 HydrophobicContact CG1-CD1 4.25Å; V91-Y127 HydrophobicContact CG1-CE1 4.03Å; V91-Y127 HydrophobicContact CG2-CD1 3.81Å; V91-Y127 HydrophobicContact CG2-CE1 4.03Å; I119-Y127 CarbonylContact C-O 3.6Å; I119-Y127 WeakPolarHBondContact CA-O 3.42Å; I120-Y127 PolarHBondContact N-O 2.91Å; I120-Y127 PolarHBondContact O-N 3.29Å; K125-Y127 HydrophobicContact CB-CE2 4.02Å
128	V	96.4	Very high	94.9	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	116.6	-169.5	-176.1	0	0	0	0	109	C89 K90 F92 L101 I116 I119 F130	C89-V128 CarbonylContact C-O 3.52Å; C89-V128 WeakPolarHBondContact CA-O 3.44Å; K90-V128 PolarHBondContact N-O 3.5Å; K90-V128 PolarHBondContact O-N 2.82Å; F92-V128 HydrophobicContact CD2-CB 4.21Å; F92-V128 HydrophobicContact CD2-CG2 3.55Å; F92-V128 HydrophobicContact CE2-CB 3.94Å; F92-V128 HydrophobicContact CE2-CG2 3.71Å; L101-V128 HydrophobicContact CD1-CG1 4.36Å; L101-V128 HydrophobicContact CD1-CG2 3.82Å; I116-V128 HydrophobicContact CB-CG1 4.48Å; I116-V128 HydrophobicContact CD1-CG1 4.23Å; I116-V128 HydrophobicContact CG1-CG1 3.99Å; I116-V128 HydrophobicContact CG2-CG1 3.77Å; I119-V128 HydrophobicContact CG1-CG1 4.29Å; I119-V128 HydrophobicContact CG1-CG2 4.27Å; I119-V128 HydrophobicContact CG2-CG2 4.28Å; V128-F130 HydrophobicContact CB-CE2 4.15Å; V128-F130 HydrophobicContact CG1-CD2 4.39Å; V128-F130 HydrophobicContact CG1-CE1 4.45Å; V128-F130 HydrophobicContact CG1-CE2 3.55Å; V128-F130 HydrophobicContact CG1-CZ 3.59Å
129	F	96.4	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140.1	-172.1	-64.2	-89.9	0	0	0	111.7	I61 Y64 L66 A78 L87 V88 C89 T117 E118 I120	I61-F129 HydrophobicContact CB-CZ 4.44Å; I61-F129 HydrophobicContact CG2-CZ 4.25Å; Y64-F129 AromaticContact CD1-CD1 3.96Å; Y64-F129 HydrophobicContact CD1-CD1 3.96Å; Y64-F129 AromaticContact CD1-CE1 3.98Å; Y64-F129 HydrophobicContact CD1-CE1 3.98Å; Y64-F129 AromaticContact CD2-CD1 3.96Å; Y64-F129 HydrophobicContact CD2-CD1 3.96Å; Y64-F129 HydrophobicContact CD2-CD2 4.04Å; Y64-F129 AromaticContact CD2-CE1 3.62Å; Y64-F129 HydrophobicContact CD2-CE1 3.62Å; Y64-F129 AromaticContact CD2-CE2 3.71Å; Y64-F129 HydrophobicContact CD2-CE2 3.71Å; Y64-F129 HydrophobicContact CD2-CG 4.16Å; Y64-F129 AromaticContact CD2-CZ 3.48Å; Y64-F129 HydrophobicContact CD2-CZ 3.48Å; Y64-F129 VanDerWaalsContact CD2-CZ 3.48Å; Y64-F129 HydrophobicContact CE1-CD1 4.18Å; Y64-F129 HydrophobicContact CE1-CG 4.46Å; Y64-F129 HydrophobicContact CE2-CD1 4.18Å; Y64-F129 AromaticContact CE2-CD2 3.89Å; Y64-F129 HydrophobicContact CE2-CD2 3.89Å; Y64-F129 HydrophobicContact CE2-CE1 4.27Å; Y64-F129 HydrophobicContact CE2-CE2 4.01Å; Y64-F129 AromaticContact CE2-CG 3.99Å; Y64-F129 HydrophobicContact CE2-CG 3.99Å; Y64-F129 HydrophobicContact CE2-CZ 4.2Å; Y64-F129 AromaticContact CG-CD1 3.84Å; Y64-F129 HydrophobicContact CG-CD1 3.84Å; Y64-F129 AromaticContact CG-CE1 3.43Å; Y64-F129 HydrophobicContact CG-CE1 3.43Å; Y64-F129 VanDerWaalsContact CG-CE1 3.43Å; Y64-F129 HydrophobicContact CG-CE2 4.39Å; Y64-F129 HydrophobicContact CG-CG 4.47Å; Y64-F129 AromaticContact CG-CZ 3.75Å; Y64-F129 HydrophobicContact CG-CZ 3.75Å; L66-F129 HydrophobicContact CD2-CE1 4.1Å; L66-F129 HydrophobicContact CD2-CZ 4.43Å; A78-F129 HydrophobicContact CB-CD1 4.19Å; A78-F129 HydrophobicContact CB-CE1 3.96Å; L87-F129 HydrophobicContact CD2-CB 4.02Å; V88-F129 CarbonylContact O-C 3.56Å; V88-F129 WeakPolarHBondContact O-CA 3.34Å; C89-F129 HydrophobicContact CB-CD1 3.89Å; C89-F129 HydrophobicContact CB-CE1 3.7Å; C89-F129 HydrophobicContact CB-CZ 4.35Å; T117-F129 WeakPolarHBondContact CB-O 3.49Å; T117-F129 PolarHBondContact N-O 2.9Å; E118-F129 HydrophobicContact CB-CB 4.49Å; E118-F129 HydrophobicContact CB-CD2 4.39Å; E118-F129 PolarHBondContact O-N 3.12Å; I120-F129 HydrophobicContact CB-CE2 4.34Å; I120-F129 HydrophobicContact CD1-CE2 3.85Å; I120-F129 HydrophobicContact CD1-CZ 4.45Å; I120-F129 HydrophobicContact CG1-CE2 4.04Å
130	F	96.1	Very high	95.1	Very high	7 Å²	7	38 Å²	38	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	154.7	179.9	-58.3	-91.5	0	0	0	110.9	L87 V88 K90 N114 Q115 I116 V128 R132	L87-F130 CarbonylContact C-O 3.59Å; L87-F130 VanDerWaalsContact CA-O 3.28Å; L87-F130 WeakPolarHBondContact CA-O 3.35Å; L87-F130 VanDerWaalsContact CB-O 3.27Å; L87-F130 WeakPolarHBondContact CB-O 3.44Å; V88-F130 PolarHBondContact N-O 3.12Å; V88-F130 PolarHBondContact O-N 2.82Å; K90-F130 HydrophobicContact CB-CE2 4.23Å; K90-F130 HydrophobicContact CD-CE2 4.31Å; K90-F130 HydrophobicContact CG-CE2 4.05Å; N114-F130 HydrophobicContact CB-CD1 4.41Å; N114-F130 VanDerWaalsContact CG-CD1 3.48Å; N114-F130 WeakPolarHBondContact ND2-CD1 3.48Å; Q115-F130 WeakPolarHBondContact O-CD1 3.46Å; I116-F130 HydrophobicContact CB-CE1 4.42Å; I116-F130 HydrophobicContact CG1-CD1 4.39Å; I116-F130 HydrophobicContact CG1-CE1 3.59Å; I116-F130 HydrophobicContact CG1-CZ 3.97Å; V128-F130 HydrophobicContact CB-CE2 4.15Å; V128-F130 HydrophobicContact CG1-CD2 4.39Å; V128-F130 HydrophobicContact CG1-CE1 4.45Å; V128-F130 HydrophobicContact CG1-CE2 3.55Å; V128-F130 HydrophobicContact CG1-CZ 3.59Å; F130-R132 PolarHBondContact O-N 2.86Å
131	E	94.9	Very high	95.2	Very high	85 Å²	85	38 Å²	38	40%	0.397	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	138	170.2	-42.2	163.6	135.1	0	0	110.6	K184 K192	E131-K184 WeakPolarHBondContact OE2-CE 2.96Å; E131-K184 IonicContact OE2-NZ 2.61Å; E131-K184 PolarHBondContact OE2-NZ 2.67Å; E131-K192 PolarHBondContact O-NZ 3.18Å; E131-K192 IonicContact OE2-NZ 3.46Å; E131-K192 PolarHBondContact OE2-NZ 3.13Å
132	R	94.6	Very high	95.1	Very high	102 Å²	102	39.8 Å²	39.8	39%	0.385	20%	0.203	S	C	.	.			trans	-50.6	155.4	172.5	172	171.3	166.1	177	-10.6	112.9	E86 F130	E86-R132 HydrophobicContact CB-CB 4.25Å; E86-R132 VanDerWaalsContact CD-NH1 3.31Å; E86-R132 WeakPolarHBondContact O-CB 3.47Å; E86-R132 IonicContact OE1-NH1 3.76Å; E86-R132 WeakPolarHBondContact OE2-CD 3.2Å; E86-R132 IonicContact OE2-CZ 3.35Å; E86-R132 IonicContact OE2-NE 2.77Å; E86-R132 IonicContact OE2-NH1 3.7Å; E86-R132 PolarHBondContact OE2-NH1 3.36Å; F130-R132 PolarHBondContact O-N 2.86Å
133	S	95.1	Very high	95.4	Very high	34 Å²	34	44.3 Å²	44.3	24%	0.238	23%	0.228	C	C	.	.			trans	-122.2	170.9	175	67.9	0	0	0	0	113.1	F183	S133-F183 WeakPolarHBondContact CA-O 3.45Å
134	Y	95.6	Very high	95.6	Very high	74 Å²	74	41.6 Å²	41.6	29%	0.29	22%	0.22	S	C	.	.			trans	-122	36.1	-174	-64.6	-94.4	0	0	0	112.9	F183 D185 E186 R188	Y134-F183 PolarHBondContact N-O 3.48Å; Y134-F183 VanDerWaalsContact N-O 3.1Å; Y134-D185 WeakPolarHBondContact CB-O 3.32Å; Y134-E186 HydrophobicContact CD1-CB 3.63Å; Y134-E186 HydrophobicContact CD1-CG 3.92Å; Y134-E186 HydrophobicContact CE1-CB 3.72Å; Y134-E186 HydrophobicContact CE1-CG 4.17Å; Y134-E186 HydrophobicContact CG-CB 4.37Å; Y134-R188 PolarHBondContact O-NE 3.23Å; Y134-R188 VanDerWaalsContact O-NE 3.13Å; Y134-R188 PolarHBondContact O-NH2 3.06Å; Y134-R188 VanDerWaalsContact O-NH2 3.16Å
135	G	95.1	Very high	95.8	Very high	32 Å²	32	43.6 Å²	43.6	33%	0.33	22%	0.221	S	C	.	.			trans	90.2	-177.3	-173.9	0	0	0	0	0	113.2	I182 F183	G135-I182 WeakPolarHBondContact O-CA 3.44Å; G135-F183 WeakPolarHBondContact O-CD2 3.27Å; G135-F183 PolarHBondContact O-N 2.96Å
136	D	96.3	Very high	95.8	Very high	26 Å²	26	45.6 Å²	45.6	14%	0.139	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-115.9	162.5	-174.2	75.8	96.5	0	0	0	113.8	H138 S139 F140 F181 I182	D136-H138 PolarHBondContact O-N 2.87Å; D136-H138 VanDerWaalsContact OD1-CA 3.3Å; D136-H138 WeakPolarHBondContact OD1-CA 3.28Å; D136-H138 WeakPolarHBondContact OD1-CB 3.27Å; D136-H138 PolarHBondContact OD1-N 2.9Å; D136-S139 PolarHBondContact OD1-N 2.86Å; D136-S139 WeakPolarHBondContact OD2-CB 3.47Å; D136-S139 PolarHBondContact OD2-OG 3.46Å; D136-F140 WeakPolarHBondContact O-CB 3.09Å; D136-F140 PolarHBondContact O-N 2.93Å; D136-F181 WeakPolarHBondContact CA-O 3.49Å; D136-I182 HydrophobicContact CB-CG2 4.06Å
137	M	97.8	Very high	95.9	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.1	-28.4	-178	-173.3	63.7	62.3	0	0	113.6	F140 V141 L147 L155 I159 L178 F181 F183 V191 M247	M137-F140 HydrophobicContact SD-CD1 4Å; M137-V141 HydrophobicContact CG-CG2 4.21Å; M137-V141 WeakPolarHBondContact O-CB 3.22Å; M137-V141 WeakPolarHBondContact O-CG2 3.27Å; M137-V141 PolarHBondContact O-N 3.27Å; M137-V141 HydrophobicContact SD-CG2 4.03Å; M137-L147 HydrophobicContact SD-CD1 4.14Å; M137-L155 HydrophobicContact CE-CB 4.04Å; M137-L155 HydrophobicContact CE-CD1 4.04Å; M137-L155 HydrophobicContact CE-CD2 4.15Å; M137-L155 HydrophobicContact CE-CG 4.3Å; M137-I159 HydrophobicContact CE-CD1 4.44Å; M137-L178 HydrophobicContact CB-CB 4.31Å; M137-L178 WeakPolarHBondContact CB-O 3.46Å; M137-L178 HydrophobicContact CG-CB 4.34Å; M137-L178 HydrophobicContact CG-CD2 3.79Å; M137-F181 HydrophobicContact CB-CB 4.28Å; M137-F181 WeakPolarHBondContact CB-O 3.48Å; M137-F181 PolarHBondContact N-O 3.1Å; M137-F183 HydrophobicContact CE-CE1 3.63Å; M137-F183 HydrophobicContact CE-CE2 4.42Å; M137-F183 HydrophobicContact CE-CZ 3.4Å; M137-F183 HydrophobicContact SD-CZ 3.93Å; M137-V191 HydrophobicContact CE-CG1 3.63Å; M137-M247 HydrophobicContact SD-CE 4.14Å
138	H	96.3	Very high	96	Very high	13 Å²	13	52.4 Å²	52.4	6%	0.06	26%	0.26	C	S	.	.	H	α-helix	trans	-69.8	-49.7	178.6	-169.7	-95.7	0	0	0	110.3	D136 F140 V141 R142 L178 R179 Y252 V329 P330	D136-H138 PolarHBondContact O-N 2.87Å; D136-H138 VanDerWaalsContact OD1-CA 3.3Å; D136-H138 WeakPolarHBondContact OD1-CA 3.28Å; D136-H138 WeakPolarHBondContact OD1-CB 3.27Å; D136-H138 PolarHBondContact OD1-N 2.9Å; H138-F140 VanDerWaalsContact C-N 3.31Å; H138-F140 PolarHBondContact O-N 3.49Å; H138-V141 PolarHBondContact O-N 2.82Å; H138-R142 PolarHBondContact CE1-NH2 2.86Å; H138-R142 WeakPolarHBondContact O-CB 3.33Å; H138-R142 PolarHBondContact O-N 3.43Å; H138-L178 HydrophobicContact CB-CB 3.84Å; H138-R179 HydrophobicContact CB-CB 4.29Å; H138-Y252 AromaticContact NE2-CZ 3.39Å; H138-Y252 PolarHBondContact NE2-OH 2.93Å; H138-V329 VanDerWaalsContact CE1-CG1 3.48Å; H138-V329 WeakPolarHBondContact CE1-CG1 3.47Å; H138-V329 VanDerWaalsContact NE2-CG1 3.25Å; H138-V329 WeakPolarHBondContact NE2-CG1 3.39Å; H138-P330 PolarHBondContact CE1-O 3.09Å
139	S	96.2	Very high	96	Very high	52 Å²	52	53.8 Å²	53.8	36%	0.364	27%	0.267	S	S	.	.	H	α-helix	trans	-59.1	-41.7	173.6	-59.5	0	0	0	0	111.9	D136 R142 T143	D136-S139 PolarHBondContact OD1-N 2.86Å; D136-S139 WeakPolarHBondContact OD2-CB 3.47Å; D136-S139 PolarHBondContact OD2-OG 3.46Å; S139-R142 PolarHBondContact O-N 2.99Å; S139-T143 PolarHBondContact O-N 2.86Å; S139-T143 PolarHBondContact O-OG1 2.84Å
140	F	97.4	Very high	96	Very high	22 Å²	22	58.3 Å²	58.3	10%	0.096	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-49.4	177.4	-178.6	-119.3	0	0	0	112.8	D136 M137 H138 R142 T143 C144 L147 L155 F183 R188	D136-F140 WeakPolarHBondContact O-CB 3.09Å; D136-F140 PolarHBondContact O-N 2.93Å; M137-F140 HydrophobicContact SD-CD1 4Å; H138-F140 VanDerWaalsContact C-N 3.31Å; H138-F140 PolarHBondContact O-N 3.49Å; F140-R142 VanDerWaalsContact C-N 3.3Å; F140-R142 PolarHBondContact O-N 3.33Å; F140-T143 PolarHBondContact O-N 3.44Å; F140-C144 WeakPolarHBondContact O-CB 3.44Å; F140-C144 PolarHBondContact O-N 2.58Å; F140-C144 PolarHBondContact O-SG 2.92Å; F140-L147 HydrophobicContact CD1-CD1 4.39Å; F140-L147 HydrophobicContact CD1-CD2 3.87Å; F140-L147 HydrophobicContact CE1-CD1 4.16Å; F140-L147 HydrophobicContact CE1-CD2 3.47Å; F140-L147 VanDerWaalsContact CE1-CD2 3.47Å; F140-L147 HydrophobicContact CE1-CG 4.48Å; F140-L147 HydrophobicContact CZ-CD2 4.11Å; F140-L155 HydrophobicContact CE1-CD1 4.15Å; F140-F183 HydrophobicContact CB-CE2 3.65Å; F140-F183 HydrophobicContact CB-CZ 3.93Å; F140-F183 HydrophobicContact CD1-CE1 4.43Å; F140-F183 HydrophobicContact CD1-CE2 4.12Å; F140-F183 AromaticContact CD1-CZ 3.51Å; F140-F183 HydrophobicContact CD1-CZ 3.51Å; F140-F183 HydrophobicContact CE1-CZ 4.12Å; F140-F183 AromaticContact CG-CE2 3.93Å; F140-F183 HydrophobicContact CG-CE2 3.93Å; F140-F183 AromaticContact CG-CZ 3.79Å; F140-F183 HydrophobicContact CG-CZ 3.79Å; F140-R188 HydrophobicContact CE2-CB 4.43Å; F140-R188 HydrophobicContact CZ-CB 4.5Å
141	V	97.3	Very high	96	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-39.9	176	172.1	0	0	0	0	111	M137 H138 C144 K145 L147 L178 M247 V329	M137-V141 HydrophobicContact CG-CG2 4.21Å; M137-V141 WeakPolarHBondContact O-CB 3.22Å; M137-V141 WeakPolarHBondContact O-CG2 3.27Å; M137-V141 PolarHBondContact O-N 3.27Å; M137-V141 HydrophobicContact SD-CG2 4.03Å; H138-V141 PolarHBondContact O-N 2.82Å; V141-C144 PolarHBondContact O-N 3.08Å; V141-K145 CarbonylContact O-C 3.56Å; V141-K145 VanDerWaalsContact O-C 3.23Å; V141-K145 VanDerWaalsContact O-CA 3.27Å; V141-K145 WeakPolarHBondContact O-CA 2.89Å; V141-K145 PolarHBondContact O-N 2.79Å; V141-L147 HydrophobicContact CG2-CD1 4.09Å; V141-L147 HydrophobicContact CG2-CG 4.13Å; V141-L178 HydrophobicContact CG2-CD1 4.38Å; V141-M247 HydrophobicContact CG2-CB 4.43Å; V141-M247 HydrophobicContact CG2-CG 3.92Å; V141-V329 HydrophobicContact CG1-CG2 4.35Å
142	R	94.1	Very high	96.2	Very high	73 Å²	73	57.2 Å²	57.2	28%	0.275	28%	0.283	S	S	.	.	H	α-helix	trans	-60.1	-48.3	174.5	-167	-166.8	-66.8	157.8	6.1	111.3	H138 S139 F140 K145 V329 P330 D331	H138-R142 PolarHBondContact CE1-NH2 2.86Å; H138-R142 WeakPolarHBondContact O-CB 3.33Å; H138-R142 PolarHBondContact O-N 3.43Å; S139-R142 PolarHBondContact O-N 2.99Å; F140-R142 VanDerWaalsContact C-N 3.3Å; F140-R142 PolarHBondContact O-N 3.33Å; R142-K145 PolarHBondContact O-N 3.33Å; R142-V329 HydrophobicContact CB-CB 4.44Å; R142-V329 HydrophobicContact CG-CB 4.42Å; R142-P330 PolarHBondContact NE-O 2.77Å; R142-P330 PolarHBondContact NH2-O 3.37Å; R142-D331 VanDerWaalsContact CD-OD1 3.3Å; R142-D331 WeakPolarHBondContact CD-OD1 3.49Å; R142-D331 IonicContact CZ-OD1 3.4Å; R142-D331 IonicContact NE-OD1 2.77Å; R142-D331 PolarHBondContact NE-OD1 3.48Å; R142-D331 IonicContact NH1-OD1 3.84Å; R142-D331 PolarHBondContact NH1-OD1 2.88Å
143	T	95.8	Very high	96.3	Very high	110 Å²	110	52.6 Å²	52.6	68%	0.675	27%	0.266	S	S	*	.	H	α-helix	trans	-61.9	-45.3	177.8	-59.2	0	0	0	0	112.6	S139 F140 K145	S139-T143 PolarHBondContact O-N 2.86Å; S139-T143 PolarHBondContact O-OG1 2.84Å; F140-T143 PolarHBondContact O-N 3.44Å; T143-K145 PolarHBondContact O-N 3.14Å
144	C	95.4	Very high	96.5	Very high	52 Å²	52	56.6 Å²	56.6	35%	0.351	28%	0.279	S	S	.	.	H	α-helix	trans	-73.1	-11.3	177.6	-66.3	0	0	0	0	113.3	F140 V141 K146 L147	F140-C144 WeakPolarHBondContact O-CB 3.44Å; F140-C144 PolarHBondContact O-N 2.58Å; F140-C144 PolarHBondContact O-SG 2.92Å; V141-C144 PolarHBondContact O-N 3.08Å; C144-K146 PolarHBondContact O-N 2.96Å; C144-L147 HydrophobicContact CB-CD2 3.85Å
145	K	95.2	Very high	96.6	Very high	135 Å²	135	53.3 Å²	53.3	59%	0.587	27%	0.267	S	S	*	.	S	Bend	trans	61	-44.8	-161.2	-52.7	-173.3	-178.5	-173.2	0	113.8	V141 R142 T143 G250	V141-K145 CarbonylContact O-C 3.56Å; V141-K145 VanDerWaalsContact O-C 3.23Å; V141-K145 VanDerWaalsContact O-CA 3.27Å; V141-K145 WeakPolarHBondContact O-CA 2.89Å; V141-K145 PolarHBondContact O-N 2.79Å; R142-K145 PolarHBondContact O-N 3.33Å; T143-K145 PolarHBondContact O-N 3.14Å; K145-G250 WeakPolarHBondContact O-CA 3.34Å
146	K	94.9	Very high	96.8	Very high	112 Å²	112	51.8 Å²	51.8	49%	0.487	25%	0.251	S	S	.	.	S	Bend	trans	-158.7	157.1	169.2	62.9	-177.3	179	-177.7	0	110.2	C144	C144-K146 PolarHBondContact O-N 2.96Å
147	L	97.6	Very high	96.9	Very high	9 Å²	9	55.1 Å²	55.1	5%	0.047	26%	0.262	C	S	.	.			trans	-90.5	158.7	178.3	-54.2	-176.2	0	0	0	111.6	M137 F140 V141 C144 A152 L155 M247	M137-L147 HydrophobicContact SD-CD1 4.14Å; F140-L147 HydrophobicContact CD1-CD1 4.39Å; F140-L147 HydrophobicContact CD1-CD2 3.87Å; F140-L147 HydrophobicContact CE1-CD1 4.16Å; F140-L147 HydrophobicContact CE1-CD2 3.47Å; F140-L147 VanDerWaalsContact CE1-CD2 3.47Å; F140-L147 HydrophobicContact CE1-CG 4.48Å; F140-L147 HydrophobicContact CZ-CD2 4.11Å; V141-L147 HydrophobicContact CG2-CD1 4.09Å; V141-L147 HydrophobicContact CG2-CG 4.13Å; C144-L147 HydrophobicContact CB-CD2 3.85Å; L147-A152 HydrophobicContact CB-CB 4.07Å; L147-L155 HydrophobicContact CD1-CD1 3.97Å; L147-M247 HydrophobicContact CD1-CB 4.33Å; L147-M247 HydrophobicContact CD1-CE 3.86Å; L147-M247 HydrophobicContact CD1-CG 4.41Å; L147-M247 PolarHBondContact N-O 2.99Å
148	K	96.6	Very high	96.9	Very high	162 Å²	162	56.5 Å²	56.5	70%	0.704	27%	0.269	S	S	*	.			trans	-74.9	150.8	168.6	-65.3	174.7	-175.6	169.6	0	109.7	E150 E151 A152	K148-E150 VanDerWaalsContact C-N 3.29Å; K148-E150 PolarHBondContact O-N 2.88Å; K148-E151 HydrophobicContact CB-CB 4.42Å; K148-E151 PolarHBondContact N-OE2 2.95Å; K148-E151 PolarHBondContact O-N 2.74Å; K148-E151 VanDerWaalsContact O-N 3.16Å; K148-A152 VanDerWaalsContact O-CB 3.29Å; K148-A152 WeakPolarHBondContact O-CB 3.4Å; K148-A152 PolarHBondContact O-N 2.86Å
149	E	97.2	Very high	97.1	Very high	30 Å²	30	55.9 Å²	55.9	14%	0.14	27%	0.266	C	S	.	.	H	α-helix	trans	-57.4	-38.1	-179.2	-85.3	-171	-130.5	0	0	113.9	E151 A153 L248 L277 S278 A281 W307 F312	E149-E151 PolarHBondContact O-N 2.82Å; E149-A153 WeakPolarHBondContact O-CB 3.43Å; E149-A153 PolarHBondContact O-N 2.88Å; E149-L248 HydrophobicContact CB-CD2 4.35Å; E149-L248 HydrophobicContact CG-CD2 3.62Å; E149-L277 HydrophobicContact CG-CD2 4.25Å; E149-L277 WeakPolarHBondContact OE1-CA 3.44Å; E149-S278 PolarHBondContact OE1-N 2.76Å; E149-S278 VanDerWaalsContact OE2-CB 3.26Å; E149-S278 WeakPolarHBondContact OE2-CB 3.37Å; E149-S278 PolarHBondContact OE2-OG 3.19Å; E149-A281 WeakPolarHBondContact OE2-CB 3.17Å; E149-W307 HydrophobicContact CB-CZ2 4.26Å; E149-W307 HydrophobicContact CG-CZ2 4.2Å; E149-W307 PolarHBondContact OE2-NE1 3.34Å; E149-F312 HydrophobicContact CB-CD1 3.91Å; E149-F312 HydrophobicContact CB-CE1 3.71Å
150	E	96.1	Very high	97.2	Very high	94 Å²	94	53.4 Å²	53.4	44%	0.439	25%	0.248	S	C	.	.	H	α-helix	trans	-61.7	-43.6	177.7	-173.2	-167.1	161.3	0	0	112.9	K148 K154 F312	K148-E150 VanDerWaalsContact C-N 3.29Å; K148-E150 PolarHBondContact O-N 2.88Å; E150-K154 VanDerWaalsContact O-CG 3.32Å; E150-K154 WeakPolarHBondContact O-CG 3.34Å; E150-K154 PolarHBondContact O-N 2.77Å; E150-K154 IonicContact OE1-NZ 2.65Å; E150-K154 PolarHBondContact OE1-NZ 3.3Å; E150-F312 HydrophobicContact CB-CB 3.79Å; E150-F312 HydrophobicContact CB-CD1 4.33Å; E150-F312 HydrophobicContact CB-CD2 3.72Å; E150-F312 HydrophobicContact CB-CE2 4.4Å; E150-F312 HydrophobicContact CB-CG 3.67Å; E150-F312 HydrophobicContact CG-CB 4.09Å; E150-F312 HydrophobicContact CG-CD2 3.7Å; E150-F312 HydrophobicContact CG-CE2 4.45Å; E150-F312 HydrophobicContact CG-CG 4.07Å
151	E	96.9	Very high	97.2	Very high	70 Å²	70	53 Å²	53	33%	0.327	25%	0.249	S	C	.	.	H	α-helix	trans	-72.6	-47.9	-179.9	172.5	179.9	-139.9	0	0	110.4	K148 E149 A153 K154 L155	K148-E151 HydrophobicContact CB-CB 4.42Å; K148-E151 PolarHBondContact N-OE2 2.95Å; K148-E151 PolarHBondContact O-N 2.74Å; K148-E151 VanDerWaalsContact O-N 3.16Å; E149-E151 PolarHBondContact O-N 2.82Å; E151-A153 VanDerWaalsContact C-N 3.27Å; E151-A153 PolarHBondContact O-N 2.84Å; E151-K154 PolarHBondContact O-N 2.69Å; E151-L155 HydrophobicContact CG-CD1 3.94Å; E151-L155 WeakPolarHBondContact O-CB 3.28Å; E151-L155 WeakPolarHBondContact O-CG 3.24Å; E151-L155 PolarHBondContact O-N 3.28Å
152	A	98.1	Very high	97.3	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-37.4	173.9	0	0	0	0	0	112.1	L147 K148 F156 M247 L248 W307	L147-A152 HydrophobicContact CB-CB 4.07Å; K148-A152 VanDerWaalsContact O-CB 3.29Å; K148-A152 WeakPolarHBondContact O-CB 3.4Å; K148-A152 PolarHBondContact O-N 2.86Å; A152-F156 WeakPolarHBondContact O-CA 3.23Å; A152-F156 WeakPolarHBondContact O-CB 3.07Å; A152-F156 PolarHBondContact O-N 3.45Å; A152-M247 HydrophobicContact CB-CE 4.35Å; A152-L248 HydrophobicContact CB-CD2 3.43Å; A152-L248 VanDerWaalsContact CB-CD2 3.43Å; A152-L248 HydrophobicContact CB-CG 4.21Å; A152-W307 HydrophobicContact CB-CH2 4.22Å
153	A	98.3	Very high	97.5	Very high	5 Å²	5	49.6 Å²	49.6	4%	0.041	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-47.6	176.5	0	0	0	0	0	111.8	E149 E151 L155 F156 Y157 W307 F308 F312	E149-A153 WeakPolarHBondContact O-CB 3.43Å; E149-A153 PolarHBondContact O-N 2.88Å; E151-A153 VanDerWaalsContact C-N 3.27Å; E151-A153 PolarHBondContact O-N 2.84Å; A153-L155 VanDerWaalsContact C-N 3.28Å; A153-L155 PolarHBondContact O-N 3.4Å; A153-F156 PolarHBondContact O-N 3.35Å; A153-Y157 VanDerWaalsContact O-CB 3.31Å; A153-Y157 WeakPolarHBondContact O-CB 3.31Å; A153-Y157 PolarHBondContact O-N 2.7Å; A153-W307 VanDerWaalsContact CA-CH2 3.48Å; A153-W307 HydrophobicContact CB-CD2 4.46Å; A153-W307 HydrophobicContact CB-CE3 4.24Å; A153-W307 HydrophobicContact CB-CH2 3.75Å; A153-W307 HydrophobicContact CB-CZ2 3.94Å; A153-W307 HydrophobicContact CB-CZ3 3.9Å; A153-F308 HydrophobicContact CB-CD1 4.11Å; A153-F308 HydrophobicContact CB-CE1 4.48Å; A153-F308 WeakPolarHBondContact O-CE1 3Å; A153-F312 HydrophobicContact CB-CE2 3.98Å; A153-F312 HydrophobicContact CB-CZ 3.67Å
154	K	97.8	Very high	97.6	Very high	117 Å²	117	44.5 Å²	44.5	51%	0.509	21%	0.205	S	C	.	.	H	α-helix	trans	-62	-35.3	178	-68	166.4	-169.6	173.6	0	112.5	E150 E151 Q158	E150-K154 VanDerWaalsContact O-CG 3.32Å; E150-K154 WeakPolarHBondContact O-CG 3.34Å; E150-K154 PolarHBondContact O-N 2.77Å; E150-K154 IonicContact OE1-NZ 2.65Å; E150-K154 PolarHBondContact OE1-NZ 3.3Å; E151-K154 PolarHBondContact O-N 2.69Å; K154-Q158 WeakPolarHBondContact O-CG 3.42Å; K154-Q158 PolarHBondContact O-NE2 3.18Å
155	L	98.6	Very high	97.8	Very high	5 Å²	5	44 Å²	44	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-81	-45.3	178.8	-66.9	167.6	0	0	0	111.8	M137 F140 L147 E151 A153 Y157 Q158 I159 F183 V191 M247	M137-L155 HydrophobicContact CE-CB 4.04Å; M137-L155 HydrophobicContact CE-CD1 4.04Å; M137-L155 HydrophobicContact CE-CD2 4.15Å; M137-L155 HydrophobicContact CE-CG 4.3Å; F140-L155 HydrophobicContact CE1-CD1 4.15Å; L147-L155 HydrophobicContact CD1-CD1 3.97Å; E151-L155 HydrophobicContact CG-CD1 3.94Å; E151-L155 WeakPolarHBondContact O-CB 3.28Å; E151-L155 WeakPolarHBondContact O-CG 3.24Å; E151-L155 PolarHBondContact O-N 3.28Å; A153-L155 VanDerWaalsContact C-N 3.28Å; A153-L155 PolarHBondContact O-N 3.4Å; L155-Y157 PolarHBondContact O-N 3.39Å; L155-Q158 WeakPolarHBondContact O-CB 3.24Å; L155-Q158 PolarHBondContact O-N 3.43Å; L155-Q158 VanDerWaalsContact O-N 3.15Å; L155-I159 WeakPolarHBondContact O-CG1 3.46Å; L155-I159 PolarHBondContact O-N 2.65Å; L155-I159 VanDerWaalsContact O-N 3.08Å; L155-F183 HydrophobicContact CD2-CE1 4Å; L155-V191 HydrophobicContact CD2-CG1 4.01Å; L155-M247 HydrophobicContact CB-CE 3.9Å
156	F	98.8	Very high	97.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.3	-30.2	-179.5	-172.2	-108.6	0	0	0	112.9	A152 A153 Q158 I159 A160 L240 L244 M247 L284 I288 I302 W307 F308	A152-F156 WeakPolarHBondContact O-CA 3.23Å; A152-F156 WeakPolarHBondContact O-CB 3.07Å; A152-F156 PolarHBondContact O-N 3.45Å; A153-F156 PolarHBondContact O-N 3.35Å; F156-Q158 VanDerWaalsContact C-N 3.29Å; F156-Q158 PolarHBondContact O-N 3.15Å; F156-I159 HydrophobicContact CD2-CB 4.32Å; F156-I159 HydrophobicContact CD2-CD1 4.46Å; F156-I159 HydrophobicContact CD2-CG2 4.3Å; F156-I159 HydrophobicContact CE2-CG2 4.39Å; F156-I159 PolarHBondContact O-N 2.83Å; F156-A160 WeakPolarHBondContact O-CB 3.32Å; F156-A160 PolarHBondContact O-N 2.87Å; F156-L240 HydrophobicContact CE2-CB 4.25Å; F156-L240 HydrophobicContact CE2-CD2 4.04Å; F156-L240 VanDerWaalsContact CE2-O 3.3Å; F156-L240 WeakPolarHBondContact CE2-O 3.4Å; F156-L240 HydrophobicContact CZ-CB 4.06Å; F156-L240 HydrophobicContact CZ-CD2 4.4Å; F156-L240 WeakPolarHBondContact CZ-O 3.15Å; F156-L244 HydrophobicContact CB-CD1 4.33Å; F156-L244 HydrophobicContact CD1-CB 4.41Å; F156-L244 HydrophobicContact CD1-CD1 3.86Å; F156-L244 HydrophobicContact CD1-CD2 4.22Å; F156-L244 HydrophobicContact CD1-CG 4.38Å; F156-L244 HydrophobicContact CD2-CB 4.09Å; F156-L244 HydrophobicContact CD2-CD1 4.38Å; F156-L244 HydrophobicContact CE1-CB 4.11Å; F156-L244 HydrophobicContact CE1-CD1 4.28Å; F156-L244 HydrophobicContact CE1-CD2 3.87Å; F156-L244 HydrophobicContact CE1-CG 4.31Å; F156-L244 HydrophobicContact CE2-CB 3.76Å; F156-L244 HydrophobicContact CG-CB 4.41Å; F156-L244 HydrophobicContact CG-CD1 3.93Å; F156-L244 HydrophobicContact CZ-CB 3.78Å; F156-L244 HydrophobicContact CZ-CD2 4.28Å; F156-L244 HydrophobicContact CZ-CG 4.47Å; F156-M247 HydrophobicContact CB-CE 4.15Å; F156-M247 HydrophobicContact CB-SD 4.43Å; F156-M247 HydrophobicContact CD2-SD 4.21Å; F156-L284 HydrophobicContact CE1-CD2 4.37Å; F156-I288 HydrophobicContact CE1-CD1 4.22Å; F156-I288 HydrophobicContact CZ-CD1 4.2Å; F156-I302 HydrophobicContact CE1-CG2 3.97Å; F156-W307 HydrophobicContact CB-CZ3 4.41Å; F156-W307 HydrophobicContact CD1-CZ3 4.12Å; F156-F308 HydrophobicContact CD1-CE1 4.18Å; F156-F308 AromaticContact CD1-CZ 3.73Å; F156-F308 HydrophobicContact CD1-CZ 3.73Å; F156-F308 HydrophobicContact CE1-CZ 4.34Å
157	Y	98.6	Very high	98.1	Very high	96 Å²	96	32.5 Å²	32.5	38%	0.376	15%	0.148	S	C	.	.	H	α-helix	trans	-59.6	-41.4	170.1	-171.6	-86.3	0	0	0	111.6	A153 L155 S161 L303 F308	A153-Y157 VanDerWaalsContact O-CB 3.31Å; A153-Y157 WeakPolarHBondContact O-CB 3.31Å; A153-Y157 PolarHBondContact O-N 2.7Å; L155-Y157 PolarHBondContact O-N 3.39Å; Y157-S161 WeakPolarHBondContact O-CB 3.49Å; Y157-S161 PolarHBondContact O-N 3.25Å; Y157-L303 HydrophobicContact CD1-CD2 4.39Å; Y157-L303 HydrophobicContact CD2-CD2 3.83Å; Y157-L303 HydrophobicContact CE1-CD2 4.26Å; Y157-L303 HydrophobicContact CE2-CB 4.09Å; Y157-L303 HydrophobicContact CE2-CD2 3.71Å; Y157-L303 HydrophobicContact CG-CD2 4.18Å; Y157-F308 HydrophobicContact CD2-CB 4.19Å; Y157-F308 AromaticContact CD2-CD1 3.91Å; Y157-F308 HydrophobicContact CD2-CD1 3.91Å; Y157-F308 AromaticContact CD2-CD2 3.7Å; Y157-F308 HydrophobicContact CD2-CD2 3.7Å; Y157-F308 HydrophobicContact CD2-CE1 4.13Å; Y157-F308 AromaticContact CD2-CE2 3.89Å; Y157-F308 HydrophobicContact CD2-CE2 3.89Å; Y157-F308 AromaticContact CD2-CG 3.68Å; Y157-F308 HydrophobicContact CD2-CG 3.68Å; Y157-F308 HydrophobicContact CD2-CZ 4.1Å; Y157-F308 HydrophobicContact CE2-CD2 4.29Å; Y157-F308 HydrophobicContact CE2-CG 4.47Å; Y157-F308 HydrophobicContact CG-CD1 4.41Å; Y157-F308 HydrophobicContact CG-CE1 4.41Å
158	Q	98.7	Very high	98	Very high	29 Å²	29	38 Å²	38	14%	0.136	18%	0.177	C	C	.	.	H	α-helix	trans	-69.3	-36.1	177.6	-70.2	177.5	80.2	0	0	112.4	N112 K154 L155 F156 A162 T189 R190 V191	N112-Q158 PolarHBondContact ND2-OE1 3.08Å; N112-Q158 VanDerWaalsContact ND2-OE1 3.08Å; K154-Q158 WeakPolarHBondContact O-CG 3.42Å; K154-Q158 PolarHBondContact O-NE2 3.18Å; L155-Q158 WeakPolarHBondContact O-CB 3.24Å; L155-Q158 PolarHBondContact O-N 3.43Å; L155-Q158 VanDerWaalsContact O-N 3.15Å; F156-Q158 VanDerWaalsContact C-N 3.29Å; F156-Q158 PolarHBondContact O-N 3.15Å; Q158-A162 PolarHBondContact O-N 3.39Å; Q158-A162 VanDerWaalsContact O-N 3.13Å; Q158-T189 PolarHBondContact NE2-O 2.93Å; Q158-R190 VanDerWaalsContact OE1-CA 3.29Å; Q158-V191 HydrophobicContact CB-CG2 3.5Å
159	I	98.8	Very high	98	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-55.8	172.8	-67.3	172.4	0	0	0	110.1	M137 L155 F156 S161 A162 V163 F181 V191 L240 M243 M247	M137-I159 HydrophobicContact CE-CD1 4.44Å; L155-I159 WeakPolarHBondContact O-CG1 3.46Å; L155-I159 PolarHBondContact O-N 2.65Å; L155-I159 VanDerWaalsContact O-N 3.08Å; F156-I159 HydrophobicContact CD2-CB 4.32Å; F156-I159 HydrophobicContact CD2-CD1 4.46Å; F156-I159 HydrophobicContact CD2-CG2 4.3Å; F156-I159 HydrophobicContact CE2-CG2 4.39Å; F156-I159 PolarHBondContact O-N 2.83Å; I159-S161 VanDerWaalsContact C-N 3.28Å; I159-S161 PolarHBondContact O-N 3.19Å; I159-A162 WeakPolarHBondContact O-CB 3.46Å; I159-A162 PolarHBondContact O-N 3.13Å; I159-A162 VanDerWaalsContact O-N 3.1Å; I159-V163 PolarHBondContact O-N 3.1Å; I159-V163 VanDerWaalsContact O-N 3.17Å; I159-F181 HydrophobicContact CB-CD1 4.29Å; I159-F181 HydrophobicContact CB-CE1 4.15Å; I159-F181 HydrophobicContact CD1-CG 4.41Å; I159-F181 HydrophobicContact CG1-CB 4.45Å; I159-F181 HydrophobicContact CG1-CD1 3.73Å; I159-F181 HydrophobicContact CG1-CE1 4.11Å; I159-F181 HydrophobicContact CG1-CG 4Å; I159-F181 HydrophobicContact CG2-CD1 4.27Å; I159-F181 HydrophobicContact CG2-CD2 4.48Å; I159-F181 HydrophobicContact CG2-CE1 3.87Å; I159-F181 HydrophobicContact CG2-CE2 4.12Å; I159-F181 HydrophobicContact CG2-CZ 3.79Å; I159-V191 HydrophobicContact CG1-CG2 4.12Å; I159-L240 HydrophobicContact CG2-CD2 3.53Å; I159-M243 HydrophobicContact CD1-CE 4.04Å; I159-M243 HydrophobicContact CG2-CE 3.56Å; I159-M243 HydrophobicContact CG2-SD 4.48Å; I159-M247 HydrophobicContact CD1-CE 4.3Å; I159-M247 HydrophobicContact CD1-SD 4.01Å
160	A	98.7	Very high	97.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-38.1	178.4	0	0	0	0	0	111.9	F156 A162 V163 A164 I302 L303	F156-A160 WeakPolarHBondContact O-CB 3.32Å; F156-A160 PolarHBondContact O-N 2.87Å; A160-A162 VanDerWaalsContact C-N 3.3Å; A160-A162 PolarHBondContact O-N 3.12Å; A160-V163 PolarHBondContact O-N 2.98Å; A160-A164 WeakPolarHBondContact O-CB 3.34Å; A160-A164 PolarHBondContact O-N 3.14Å; A160-I302 HydrophobicContact CB-CG2 3.83Å; A160-L303 HydrophobicContact CB-CD2 3.72Å; A160-L303 HydrophobicContact CB-CG 4.4Å
161	S	98.6	Very high	98	Very high	15 Å²	15	26.9 Å²	26.9	11%	0.105	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-28.4	177.4	178.2	0	0	0	0	112.9	H110 Y157 I159 H165	H110-S161 PolarHBondContact CE1-O 2.83Å; H110-S161 VanDerWaalsContact CE1-O 3.3Å; H110-S161 PolarHBondContact CE1-OG 3.17Å; Y157-S161 WeakPolarHBondContact O-CB 3.49Å; Y157-S161 PolarHBondContact O-N 3.25Å; I159-S161 VanDerWaalsContact C-N 3.28Å; I159-S161 PolarHBondContact O-N 3.19Å; S161-H165 WeakPolarHBondContact O-CB 3.31Å; S161-H165 PolarHBondContact O-N 3.33Å
162	A	98.6	Very high	98	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-71.6	-44.4	170.1	0	0	0	0	0	111.5	N112 I113 Q158 I159 A160 H165 C166 F181 L193	N112-A162 HydrophobicContact CB-CB 4.03Å; N112-A162 WeakPolarHBondContact O-CB 3.37Å; I113-A162 HydrophobicContact CG1-CB 4.14Å; Q158-A162 PolarHBondContact O-N 3.39Å; Q158-A162 VanDerWaalsContact O-N 3.13Å; I159-A162 WeakPolarHBondContact O-CB 3.46Å; I159-A162 PolarHBondContact O-N 3.13Å; I159-A162 VanDerWaalsContact O-N 3.1Å; A160-A162 VanDerWaalsContact C-N 3.3Å; A160-A162 PolarHBondContact O-N 3.12Å; A162-H165 PolarHBondContact O-N 2.85Å; A162-C166 PolarHBondContact O-N 2.78Å; A162-C166 PolarHBondContact O-SG 2.75Å; A162-F181 HydrophobicContact CB-CE1 4.23Å; A162-L193 HydrophobicContact CB-CB 4.35Å
163	V	98.6	Very high	97.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.5	-40.7	-179.2	-178.4	0	0	0	0	112.1	I159 A160 C166 H167 L173 L176 F181 D236 L240	I159-V163 PolarHBondContact O-N 3.1Å; I159-V163 VanDerWaalsContact O-N 3.17Å; A160-V163 PolarHBondContact O-N 2.98Å; V163-C166 WeakPolarHBondContact O-CB 3.11Å; V163-C166 PolarHBondContact O-N 2.85Å; V163-H167 WeakPolarHBondContact O-CB 3.4Å; V163-H167 PolarHBondContact O-CD2 2.86Å; V163-H167 PolarHBondContact O-N 3.17Å; V163-L173 HydrophobicContact CG1-CD1 4.43Å; V163-L173 HydrophobicContact CG2-CD1 4Å; V163-L176 HydrophobicContact CG1-CD1 4.07Å; V163-L176 HydrophobicContact CG2-CD1 3.85Å; V163-L176 HydrophobicContact CG2-CD2 3.91Å; V163-F181 HydrophobicContact CG2-CZ 4.37Å; V163-D236 HydrophobicContact CG1-CB 4.48Å; V163-L240 HydrophobicContact CB-CD1 4.06Å; V163-L240 HydrophobicContact CG1-CD1 4.02Å; V163-L240 HydrophobicContact CG2-CD1 4.24Å; V163-L240 HydrophobicContact CG2-CD2 3.93Å; V163-L240 HydrophobicContact CG2-CG 4.35Å
164	A	98.5	Very high	97.6	Very high	3 Å²	3	26 Å²	26	3%	0.025	14%	0.135	C	C	.	.	H	α-helix	trans	-58.9	-47.4	174.2	0	0	0	0	0	111.6	A160 C166 H167 D168 L303	A160-A164 WeakPolarHBondContact O-CB 3.34Å; A160-A164 PolarHBondContact O-N 3.14Å; A164-C166 VanDerWaalsContact C-N 3.31Å; A164-C166 PolarHBondContact O-N 2.89Å; A164-H167 PolarHBondContact O-N 2.81Å; A164-H167 VanDerWaalsContact O-N 3.12Å; A164-D168 PolarHBondContact O-N 2.77Å; A164-L303 HydrophobicContact CB-CD1 3.91Å
165	H	98.4	Very high	97.2	Very high	43 Å²	43	21.2 Å²	21.2	20%	0.199	12%	0.115	C	C	.	.	H	α-helix	trans	-59.6	-39.6	175.6	-177.4	100	0	0	0	112.6	P108 H110 S161 A162 G169	P108-H165 PolarHBondContact O-CE1 3.28Å; P108-H165 PolarHBondContact O-NE2 3.08Å; H110-H165 AromaticContact CD2-ND1 3.83Å; H110-H165 AromaticContact CG-CG 3.82Å; H110-H165 AromaticContact CG-ND1 3.8Å; S161-H165 WeakPolarHBondContact O-CB 3.31Å; S161-H165 PolarHBondContact O-N 3.33Å; A162-H165 PolarHBondContact O-N 2.85Å; H165-G169 PolarHBondContact O-N 3.31Å
166	C	98	Very high	97.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.4	-44.9	173	-68.7	0	0	0	0	112.1	I113 A162 V163 A164 G169 G170 L171 L173	I113-C166 VanDerWaalsContact CD1-SG 3.54Å; A162-C166 PolarHBondContact O-N 2.78Å; A162-C166 PolarHBondContact O-SG 2.75Å; V163-C166 WeakPolarHBondContact O-CB 3.11Å; V163-C166 PolarHBondContact O-N 2.85Å; A164-C166 VanDerWaalsContact C-N 3.31Å; A164-C166 PolarHBondContact O-N 2.89Å; C166-G169 CarbonylContact O-C 3.59Å; C166-G169 PolarHBondContact O-N 3.29Å; C166-G170 PolarHBondContact O-N 3.1Å; C166-L171 HydrophobicContact CB-CB 4.22Å; C166-L171 WeakPolarHBondContact O-CB 3.28Å; C166-L171 PolarHBondContact O-N 2.72Å; C166-L173 HydrophobicContact CB-CD1 4.2Å; C166-L173 HydrophobicContact CB-CD2 3.93Å; C166-L173 HydrophobicContact CB-CG 4.21Å
167	H	97.9	Very high	96.9	Very high	5 Å²	5	22.2 Å²	22.2	2%	0.023	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-43.7	-179.5	-74.5	-171.9	0	0	0	112.2	V163 A164 G169 G170 L171 K233 D236 S299	V163-H167 WeakPolarHBondContact O-CB 3.4Å; V163-H167 PolarHBondContact O-CD2 2.86Å; V163-H167 PolarHBondContact O-N 3.17Å; A164-H167 PolarHBondContact O-N 2.81Å; A164-H167 VanDerWaalsContact O-N 3.12Å; H167-G169 VanDerWaalsContact C-N 3.32Å; H167-G170 PolarHBondContact O-N 3.38Å; H167-G170 VanDerWaalsContact O-N 3.12Å; H167-L171 PolarHBondContact CD2-O 3.29Å; H167-K233 HydrophobicContact CB-CD 4.13Å; H167-K233 PolarHBondContact CE1-O 2.84Å; H167-K233 VanDerWaalsContact O-CE 3.3Å; H167-K233 WeakPolarHBondContact O-CE 3.1Å; H167-K233 PolarHBondContact O-NZ 2.93Å; H167-D236 IonicContact CD2-OD2 3.29Å; H167-D236 IonicContact CE1-OD2 3.37Å; H167-D236 WeakPolarHBondContact NE2-CB 3.33Å; H167-D236 IonicContact NE2-OD2 2.7Å; H167-D236 PolarHBondContact NE2-OD2 3.4Å; H167-S299 PolarHBondContact ND1-OG 3.2Å
168	D	96.4	Very high	96.8	Very high	123 Å²	123	17.7 Å²	17.7	66%	0.658	10%	0.101	S	C	*	.	H	α-helix	trans	-65.9	-36.3	175.7	-75.2	-8.1	0	0	0	111.8	A164 G170	A164-D168 PolarHBondContact O-N 2.77Å; D168-G170 PolarHBondContact O-N 2.7Å
169	G	95.8	Very high	96.6	Very high	35 Å²	35	19.3 Å²	19.3	36%	0.361	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	4.2	171.8	0	0	0	0	0	115.2	H165 C166 H167	H165-G169 PolarHBondContact O-N 3.31Å; C166-G169 CarbonylContact O-C 3.59Å; C166-G169 PolarHBondContact O-N 3.29Å; H167-G169 VanDerWaalsContact C-N 3.32Å
170	G	96.5	Very high	96.5	Very high	19 Å²	19	20 Å²	20	20%	0.196	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	25.3	176.4	0	0	0	0	0	114.9	C166 H167 D168 L202	C166-G170 PolarHBondContact O-N 3.1Å; H167-G170 PolarHBondContact O-N 3.38Å; H167-G170 VanDerWaalsContact O-N 3.12Å; D168-G170 PolarHBondContact O-N 2.7Å; G170-L202 VanDerWaalsContact O-CB 3.26Å; G170-L202 WeakPolarHBondContact O-CB 3.41Å; G170-L202 WeakPolarHBondContact O-CG 3.42Å; G170-L202 PolarHBondContact O-N 3.22Å
171	L	96.9	Very high	96.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	152.9	170.6	-55.6	-170.9	0	0	0	112.4	P103 L107 C166 H167 L173 L196 A199 Y200 I201	P103-L171 HydrophobicContact CB-CD1 3.85Å; P103-L171 HydrophobicContact CB-CD2 4.27Å; L107-L171 HydrophobicContact CD1-CD1 3.65Å; L107-L171 HydrophobicContact CD2-CD1 4.16Å; L107-L171 HydrophobicContact CD2-CG 4.15Å; L107-L171 HydrophobicContact CG-CD1 3.81Å; L107-L171 HydrophobicContact CG-CG 4.3Å; C166-L171 HydrophobicContact CB-CB 4.22Å; C166-L171 WeakPolarHBondContact O-CB 3.28Å; C166-L171 PolarHBondContact O-N 2.72Å; H167-L171 PolarHBondContact CD2-O 3.29Å; L171-L173 HydrophobicContact CB-CD2 4.48Å; L171-L196 HydrophobicContact CD1-CD1 4.39Å; L171-L196 HydrophobicContact CD1-CD2 4.3Å; L171-A199 HydrophobicContact CD1-CB 4.17Å; L171-Y200 WeakPolarHBondContact CA-O 3.35Å; L171-I201 HydrophobicContact CD2-CB 4.17Å; L171-I201 HydrophobicContact CD2-CG1 3.73Å; L171-I201 HydrophobicContact CD2-CG2 4.31Å
172	V	97	Very high	96.4	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.2	156.8	175.9	0	0	0	0	107.5	R174 A199 Y200 L202 D207 L209 G232 K233	V172-R174 HydrophobicContact CG1-CG 3.82Å; V172-A199 CarbonylContact O-C 3.41Å; V172-A199 VanDerWaalsContact O-CA 3.28Å; V172-A199 WeakPolarHBondContact O-CA 3.03Å; V172-Y200 PolarHBondContact N-O 3.02Å; V172-Y200 PolarHBondContact O-N 3.1Å; V172-L202 HydrophobicContact CG2-CD1 4.12Å; V172-L202 HydrophobicContact CG2-CD2 3.94Å; V172-L202 HydrophobicContact CG2-CG 4.22Å; V172-D207 HydrophobicContact CG2-CB 4.39Å; V172-L209 HydrophobicContact CB-CD1 4.14Å; V172-L209 HydrophobicContact CG1-CD1 3.83Å; V172-L209 HydrophobicContact CG2-CD1 4.46Å; V172-G232 VanDerWaalsContact CG1-C 3.48Å; V172-G232 WeakPolarHBondContact CG1-O 3.39Å; V172-K233 HydrophobicContact CG2-CG 3.96Å
173	L	95.5	Very high	96.4	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.026	11%	0.108	C	C	.	.			trans	-89.7	-25.4	-171.1	-59.8	-175.5	0	0	0	113.9	V163 C166 L171 D175 L176 L193 L196 A199 D236	V163-L173 HydrophobicContact CG1-CD1 4.43Å; V163-L173 HydrophobicContact CG2-CD1 4Å; C166-L173 HydrophobicContact CB-CD1 4.2Å; C166-L173 HydrophobicContact CB-CD2 3.93Å; C166-L173 HydrophobicContact CB-CG 4.21Å; L171-L173 HydrophobicContact CB-CD2 4.48Å; L173-D175 PolarHBondContact O-N 3.18Å; L173-L176 HydrophobicContact CB-CD1 4.38Å; L173-L176 HydrophobicContact CB-CD2 4.48Å; L173-L176 HydrophobicContact CB-CG 4.05Å; L173-L176 HydrophobicContact CD1-CD1 4.33Å; L173-L176 HydrophobicContact CD1-CD2 3.91Å; L173-L176 HydrophobicContact CD1-CG 4.25Å; L173-L193 HydrophobicContact CD1-CD2 3.76Å; L173-L193 HydrophobicContact CD2-CD2 4.47Å; L173-L196 HydrophobicContact CD2-CD2 3.56Å; L173-A199 HydrophobicContact CD2-CB 3.81Å; L173-D236 PolarHBondContact N-OD1 3.33Å; L173-D236 PolarHBondContact N-OD2 3.39Å
174	R	93.4	Very high	96.3	Very high	50 Å²	50	22 Å²	22	19%	0.189	12%	0.117	C	C	.	.	S	Bend	trans	64.5	-38.1	170.9	-56.9	-172.2	-63.1	169	5.1	116.3	V172 D198 L209 D211 H213 D236	V172-R174 HydrophobicContact CG1-CG 3.82Å; R174-D198 VanDerWaalsContact CZ-O 3.25Å; R174-D198 PolarHBondContact NE-O 3.13Å; R174-D198 PolarHBondContact NH2-O 3.17Å; R174-L209 HydrophobicContact CG-CD1 3.99Å; R174-D211 VanDerWaalsContact CD-OD2 3.31Å; R174-D211 WeakPolarHBondContact CD-OD2 3.35Å; R174-D211 IonicContact CZ-OD2 2.71Å; R174-D211 IonicContact NE-OD2 3.35Å; R174-D211 IonicContact NH1-OD2 3.62Å; R174-D211 PolarHBondContact NH1-OD2 2.96Å; R174-H213 HydrophobicContact CB-CB 4.34Å; R174-H213 PolarHBondContact NH1-CD2 3.08Å; R174-H213 PolarHBondContact NH1-NE2 3.47Å; R174-D236 PolarHBondContact N-OD1 3.27Å
175	D	89.9	Confident	96.2	Very high	16 Å²	16	22.5 Å²	22.5	9%	0.086	12%	0.119	C	C	.	.			trans	-118.9	91.4	170	-178.6	56.5	0	0	0	110.1	L173 K177 K180 D198	L173-D175 PolarHBondContact O-N 3.18Å; D175-K177 IonicContact OD1-NZ 3.97Å; D175-K177 VanDerWaalsContact OD2-CD 3.32Å; D175-K177 WeakPolarHBondContact OD2-CD 3.34Å; D175-K177 WeakPolarHBondContact OD2-CE 3.44Å; D175-K177 IonicContact OD2-NZ 2.71Å; D175-K177 PolarHBondContact OD2-NZ 2.98Å; D175-K180 WeakPolarHBondContact O-CD 3.13Å; D175-K180 WeakPolarHBondContact O-CE 3.46Å; D175-K180 PolarHBondContact O-NZ 2.93Å; D175-K180 VanDerWaalsContact OD2-CD 3.27Å; D175-K180 WeakPolarHBondContact OD2-CD 3.28Å; D175-K180 IonicContact OD2-NZ 3.8Å; D175-D198 HydrophobicContact CB-CB 4.47Å
176	L	95	Very high	96.1	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	14%	0.143	C	C	.	.			trans	-106.9	110.9	173.2	-87.7	174.4	0	0	0	110.1	V163 L173 F181 Y218 D236 L240 M243	V163-L176 HydrophobicContact CG1-CD1 4.07Å; V163-L176 HydrophobicContact CG2-CD1 3.85Å; V163-L176 HydrophobicContact CG2-CD2 3.91Å; L173-L176 HydrophobicContact CB-CD1 4.38Å; L173-L176 HydrophobicContact CB-CD2 4.48Å; L173-L176 HydrophobicContact CB-CG 4.05Å; L173-L176 HydrophobicContact CD1-CD1 4.33Å; L173-L176 HydrophobicContact CD1-CD2 3.91Å; L173-L176 HydrophobicContact CD1-CG 4.25Å; L176-F181 HydrophobicContact CD2-CE2 3.65Å; L176-F181 HydrophobicContact CD2-CZ 3.77Å; L176-Y218 VanDerWaalsContact O-CD1 3.26Å; L176-Y218 WeakPolarHBondContact O-CD1 3.42Å; L176-D236 HydrophobicContact CD1-CB 3.65Å; L176-D236 WeakPolarHBondContact CD1-O 3.33Å; L176-L240 HydrophobicContact CD1-CG 4.39Å; L176-M243 HydrophobicContact CB-SD 4.41Å
177	K	94.9	Very high	96	Very high	25 Å²	25	34.8 Å²	34.8	11%	0.109	18%	0.177	C	C	.	.			trans	-142.9	154.1	-178.7	63	-166.3	176.6	-155.9	0	109.8	D175 R179 K180 Y218 E335	D175-K177 IonicContact OD1-NZ 3.97Å; D175-K177 VanDerWaalsContact OD2-CD 3.32Å; D175-K177 WeakPolarHBondContact OD2-CD 3.34Å; D175-K177 WeakPolarHBondContact OD2-CE 3.44Å; D175-K177 IonicContact OD2-NZ 2.71Å; D175-K177 PolarHBondContact OD2-NZ 2.98Å; K177-R179 HydrophobicContact CG-CB 4.32Å; K177-R179 PolarHBondContact O-N 3.28Å; K177-R179 VanDerWaalsContact O-N 3.16Å; K177-K180 HydrophobicContact CD-CD 4.43Å; K177-K180 HydrophobicContact CG-CB 4.47Å; K177-K180 HydrophobicContact CG-CD 4.17Å; K177-K180 HydrophobicContact CG-CG 4.13Å; K177-K180 PolarHBondContact O-N 2.63Å; K177-K180 VanDerWaalsContact O-N 3.13Å; K177-Y218 HydrophobicContact CB-CD2 4.12Å; K177-Y218 HydrophobicContact CB-CE1 4.29Å; K177-Y218 HydrophobicContact CB-CE2 3.8Å; K177-Y218 HydrophobicContact CB-CG 4.48Å; K177-E335 WeakPolarHBondContact CE-OE1 3.44Å; K177-E335 VanDerWaalsContact NZ-CD 3.25Å; K177-E335 IonicContact NZ-OE1 3.66Å; K177-E335 PolarHBondContact NZ-OE1 3.41Å; K177-E335 IonicContact NZ-OE2 2.72Å
178	L	96.7	Very high	96	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-54.9	-37.3	-177.9	-66.6	174.4	0	0	0	112.8	M137 H138 V141 K180 F181 Y218 M243 T246 M247	M137-L178 HydrophobicContact CB-CB 4.31Å; M137-L178 WeakPolarHBondContact CB-O 3.46Å; M137-L178 HydrophobicContact CG-CB 4.34Å; M137-L178 HydrophobicContact CG-CD2 3.79Å; H138-L178 HydrophobicContact CB-CB 3.84Å; V141-L178 HydrophobicContact CG2-CD1 4.38Å; L178-K180 PolarHBondContact O-N 2.98Å; L178-F181 PolarHBondContact O-N 3.39Å; L178-Y218 PolarHBondContact N-OH 2.78Å; L178-M243 HydrophobicContact CD2-CB 3.71Å; L178-M243 HydrophobicContact CD2-CE 3.92Å; L178-M243 HydrophobicContact CD2-CG 3.85Å; L178-M243 HydrophobicContact CG-CB 4.42Å; L178-M243 HydrophobicContact CG-CG 4.18Å; L178-T246 HydrophobicContact CD1-CG2 3.79Å; L178-M247 HydrophobicContact CD2-CG 3.84Å; L178-M247 HydrophobicContact CD2-SD 4.05Å
179	R	95.2	Very high	96	Very high	64 Å²	64	36.8 Å²	36.8	24%	0.242	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-55.8	-33.9	-179.9	-179.8	-177.1	-74.7	176.2	-15.2	113.6	H138 K177 F181 N333 E335	H138-R179 HydrophobicContact CB-CB 4.29Å; K177-R179 HydrophobicContact CG-CB 4.32Å; K177-R179 PolarHBondContact O-N 3.28Å; K177-R179 VanDerWaalsContact O-N 3.16Å; R179-F181 PolarHBondContact O-N 2.79Å; R179-N333 PolarHBondContact NH1-OD1 3.09Å; R179-N333 PolarHBondContact NH2-OD1 2.86Å; R179-E335 IonicContact CZ-OE1 3.36Å; R179-E335 IonicContact NH1-OE1 2.69Å; R179-E335 PolarHBondContact NH1-OE1 2.72Å; R179-E335 IonicContact NH1-OE2 3.16Å; R179-E335 PolarHBondContact NH1-OE2 3.27Å
180	K	95.8	Very high	96.1	Very high	13 Å²	13	41.5 Å²	41.5	6%	0.057	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-76.1	3	-179.7	-74.4	174.6	67	176.9	0	113.7	D175 K177 L178 L193 E194 D198	D175-K180 WeakPolarHBondContact O-CD 3.13Å; D175-K180 WeakPolarHBondContact O-CE 3.46Å; D175-K180 PolarHBondContact O-NZ 2.93Å; D175-K180 VanDerWaalsContact OD2-CD 3.27Å; D175-K180 WeakPolarHBondContact OD2-CD 3.28Å; D175-K180 IonicContact OD2-NZ 3.8Å; K177-K180 HydrophobicContact CD-CD 4.43Å; K177-K180 HydrophobicContact CG-CB 4.47Å; K177-K180 HydrophobicContact CG-CD 4.17Å; K177-K180 HydrophobicContact CG-CG 4.13Å; K177-K180 PolarHBondContact O-N 2.63Å; K177-K180 VanDerWaalsContact O-N 3.13Å; L178-K180 PolarHBondContact O-N 2.98Å; K180-L193 HydrophobicContact CB-CD1 4.12Å; K180-L193 CarbonylContact O-C 3.23Å; K180-L193 WeakPolarHBondContact O-CA 3.38Å; K180-E194 WeakPolarHBondContact O-CB 3.31Å; K180-E194 PolarHBondContact O-N 2.7Å; K180-D198 IonicContact NZ-OD2 3.69Å; K180-D198 PolarHBondContact NZ-OD2 2.95Å
181	F	98.2	Very high	96.2	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	109.7	173.3	-69	-91	0	0	0	110.3	D136 M137 I159 A162 V163 L176 L178 R179 K192 L193 M243	D136-F181 WeakPolarHBondContact CA-O 3.49Å; M137-F181 HydrophobicContact CB-CB 4.28Å; M137-F181 WeakPolarHBondContact CB-O 3.48Å; M137-F181 PolarHBondContact N-O 3.1Å; I159-F181 HydrophobicContact CB-CD1 4.29Å; I159-F181 HydrophobicContact CB-CE1 4.15Å; I159-F181 HydrophobicContact CD1-CG 4.41Å; I159-F181 HydrophobicContact CG1-CB 4.45Å; I159-F181 HydrophobicContact CG1-CD1 3.73Å; I159-F181 HydrophobicContact CG1-CE1 4.11Å; I159-F181 HydrophobicContact CG1-CG 4Å; I159-F181 HydrophobicContact CG2-CD1 4.27Å; I159-F181 HydrophobicContact CG2-CD2 4.48Å; I159-F181 HydrophobicContact CG2-CE1 3.87Å; I159-F181 HydrophobicContact CG2-CE2 4.12Å; I159-F181 HydrophobicContact CG2-CZ 3.79Å; A162-F181 HydrophobicContact CB-CE1 4.23Å; V163-F181 HydrophobicContact CG2-CZ 4.37Å; L176-F181 HydrophobicContact CD2-CE2 3.65Å; L176-F181 HydrophobicContact CD2-CZ 3.77Å; L178-F181 PolarHBondContact O-N 3.39Å; R179-F181 PolarHBondContact O-N 2.79Å; F181-K192 WeakPolarHBondContact CA-O 3.32Å; F181-L193 HydrophobicContact CD1-CB 4.28Å; F181-L193 HydrophobicContact CE1-CB 3.8Å; F181-L193 HydrophobicContact CE1-CD1 4.2Å; F181-L193 HydrophobicContact CE2-CD1 4.09Å; F181-L193 HydrophobicContact CZ-CB 4.27Å; F181-L193 HydrophobicContact CZ-CD1 3.84Å; F181-M243 HydrophobicContact CD2-CE 3.38Å; F181-M243 HydrophobicContact CE2-CE 3.43Å; F181-M243 VanDerWaalsContact CE2-CE 3.43Å; F181-M243 HydrophobicContact CE2-SD 4.26Å; F181-M243 HydrophobicContact CG-CE 4.26Å; F181-M243 HydrophobicContact CZ-CE 4.33Å
182	I	97.9	Very high	96.2	Very high	17 Å²	17	40.7 Å²	40.7	9%	0.087	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	148.5	-174.2	56	171.1	0	0	0	111.4	G135 D136 V191 K192 E194	G135-I182 WeakPolarHBondContact O-CA 3.44Å; D136-I182 HydrophobicContact CB-CG2 4.06Å; I182-V191 CarbonylContact O-C 3.56Å; I182-V191 WeakPolarHBondContact O-CA 3.2Å; I182-K192 HydrophobicContact CD1-CD 4.26Å; I182-K192 HydrophobicContact CD1-CG 4.01Å; I182-K192 HydrophobicContact CG1-CD 4.4Å; I182-K192 HydrophobicContact CG1-CG 3.63Å; I182-K192 WeakPolarHBondContact CG1-O 3.31Å; I182-K192 PolarHBondContact N-O 2.75Å; I182-K192 PolarHBondContact O-N 2.85Å; I182-E194 HydrophobicContact CD1-CB 3.85Å; I182-E194 HydrophobicContact CD1-CG 3.65Å; I182-E194 HydrophobicContact CG1-CB 3.93Å; I182-E194 HydrophobicContact CG1-CG 4.21Å; I182-E194 HydrophobicContact CG2-CB 4.12Å; I182-E194 HydrophobicContact CG2-CG 4.07Å
183	F	98.3	Very high	96.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	139.4	-178.1	-65.3	-76.3	0	0	0	112.3	S133 Y134 G135 M137 F140 L155 R188 R190 V191	S133-F183 WeakPolarHBondContact CA-O 3.45Å; Y134-F183 PolarHBondContact N-O 3.48Å; Y134-F183 VanDerWaalsContact N-O 3.1Å; G135-F183 WeakPolarHBondContact O-CD2 3.27Å; G135-F183 PolarHBondContact O-N 2.96Å; M137-F183 HydrophobicContact CE-CE1 3.63Å; M137-F183 HydrophobicContact CE-CE2 4.42Å; M137-F183 HydrophobicContact CE-CZ 3.4Å; M137-F183 HydrophobicContact SD-CZ 3.93Å; F140-F183 HydrophobicContact CB-CE2 3.65Å; F140-F183 HydrophobicContact CB-CZ 3.93Å; F140-F183 HydrophobicContact CD1-CE1 4.43Å; F140-F183 HydrophobicContact CD1-CE2 4.12Å; F140-F183 AromaticContact CD1-CZ 3.51Å; F140-F183 HydrophobicContact CD1-CZ 3.51Å; F140-F183 HydrophobicContact CE1-CZ 4.12Å; F140-F183 AromaticContact CG-CE2 3.93Å; F140-F183 HydrophobicContact CG-CE2 3.93Å; F140-F183 AromaticContact CG-CZ 3.79Å; F140-F183 HydrophobicContact CG-CZ 3.79Å; L155-F183 HydrophobicContact CD2-CE1 4Å; F183-R188 HydrophobicContact CB-CB 4.49Å; F183-R188 HydrophobicContact CB-CG 4.11Å; F183-R188 VanDerWaalsContact CD1-CA 3.43Å; F183-R188 HydrophobicContact CD1-CB 3.53Å; F183-R188 HydrophobicContact CD1-CG 3.97Å; F183-R188 WeakPolarHBondContact CD1-O 3.38Å; F183-R188 HydrophobicContact CD2-CB 4.22Å; F183-R188 HydrophobicContact CD2-CG 3.82Å; F183-R188 HydrophobicContact CE1-CB 3.68Å; F183-R188 HydrophobicContact CE1-CG 4.35Å; F183-R188 WeakPolarHBondContact CE1-O 3.25Å; F183-R188 HydrophobicContact CE2-CB 4.36Å; F183-R188 HydrophobicContact CE2-CG 4.24Å; F183-R188 HydrophobicContact CG-CB 3.81Å; F183-R188 HydrophobicContact CG-CG 3.67Å; F183-R188 HydrophobicContact CZ-CB 4.1Å; F183-R188 HydrophobicContact CZ-CG 4.48Å; F183-R190 WeakPolarHBondContact CA-O 3.45Å; F183-V191 HydrophobicContact CD1-CG1 3.55Å; F183-V191 HydrophobicContact CE1-CG1 3.51Å; F183-V191 HydrophobicContact CG-CG1 4.39Å; F183-V191 HydrophobicContact CZ-CG1 4.3Å
184	K	96.4	Very high	96.3	Very high	40 Å²	40	42.4 Å²	42.4	17%	0.174	19%	0.19	C	C	.	.	S	Bend	trans	-89.9	-12.1	178.4	-51.9	-157.8	70.2	164.6	0	113.5	K111 E131 R190 K192	K111-K184 PolarHBondContact O-NZ 2.63Å; E131-K184 WeakPolarHBondContact OE2-CE 2.96Å; E131-K184 IonicContact OE2-NZ 2.61Å; E131-K184 PolarHBondContact OE2-NZ 2.67Å; K184-R190 HydrophobicContact CB-CB 4.25Å; K184-R190 HydrophobicContact CG-CB 4.4Å; K184-R190 PolarHBondContact N-O 3.1Å; K184-K192 HydrophobicContact CD-CB 4.07Å; K184-K192 HydrophobicContact CD-CD 4.31Å; K184-K192 HydrophobicContact CD-CG 4.3Å; K184-K192 HydrophobicContact CG-CB 4.12Å; K184-K192 HydrophobicContact CG-CD 4.17Å; K184-K192 HydrophobicContact CG-CG 3.94Å
185	D	96.5	Very high	96.2	Very high	13 Å²	13	40.7 Å²	40.7	7%	0.07	19%	0.186	C	C	.	.	S	Bend	trans	-144.4	154	-171.2	54	-74.3	0	0	0	110.4	Y134 E187 R188 T189 R190	Y134-D185 WeakPolarHBondContact CB-O 3.32Å; D185-E187 VanDerWaalsContact C-N 3.31Å; D185-E187 PolarHBondContact O-N 3.19Å; D185-R188 PolarHBondContact O-N 3.1Å; D185-R188 VanDerWaalsContact O-N 3.13Å; D185-R188 PolarHBondContact OD2-N 2.76Å; D185-T189 WeakPolarHBondContact OD2-CB 3.49Å; D185-T189 PolarHBondContact OD2-N 3.35Å; D185-T189 PolarHBondContact OD2-OG1 2.93Å; D185-R190 WeakPolarHBondContact OD1-CA 3.45Å; D185-R190 WeakPolarHBondContact OD1-CB 3.36Å; D185-R190 WeakPolarHBondContact OD1-CG 3.18Å; D185-R190 PolarHBondContact OD1-N 3.48Å
186	E	95.7	Very high	96.5	Very high	151 Å²	151	40.2 Å²	40.2	71%	0.706	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-28.8	-175.7	-165.5	166.3	170.2	0	0	112	Y134 R188	Y134-E186 HydrophobicContact CD1-CB 3.63Å; Y134-E186 HydrophobicContact CD1-CG 3.92Å; Y134-E186 HydrophobicContact CE1-CB 3.72Å; Y134-E186 HydrophobicContact CE1-CG 4.17Å; Y134-E186 HydrophobicContact CG-CB 4.37Å; E186-R188 PolarHBondContact O-N 3.39Å
187	E	96.7	Very high	96.3	Very high	151 Å²	151	42.5 Å²	42.5	71%	0.706	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-6	172	-54.3	97.5	137.4	0	0	113.5	D185 T189	D185-E187 VanDerWaalsContact C-N 3.31Å; D185-E187 PolarHBondContact O-N 3.19Å; E187-T189 VanDerWaalsContact C-N 3.26Å; E187-T189 HydrophobicContact CB-CG2 3.9Å; E187-T189 PolarHBondContact O-N 3.03Å
188	R	96.8	Very high	96.1	Very high	88 Å²	88	44.5 Å²	44.5	33%	0.332	21%	0.206	S	C	.	.			trans	56.6	33.3	178.1	-64	-173.4	172.1	150.7	-1.5	114.5	Y134 F140 F183 D185 E186	Y134-R188 PolarHBondContact O-NE 3.23Å; Y134-R188 VanDerWaalsContact O-NE 3.13Å; Y134-R188 PolarHBondContact O-NH2 3.06Å; Y134-R188 VanDerWaalsContact O-NH2 3.16Å; F140-R188 HydrophobicContact CE2-CB 4.43Å; F140-R188 HydrophobicContact CZ-CB 4.5Å; F183-R188 HydrophobicContact CB-CB 4.49Å; F183-R188 HydrophobicContact CB-CG 4.11Å; F183-R188 VanDerWaalsContact CD1-CA 3.43Å; F183-R188 HydrophobicContact CD1-CB 3.53Å; F183-R188 HydrophobicContact CD1-CG 3.97Å; F183-R188 WeakPolarHBondContact CD1-O 3.38Å; F183-R188 HydrophobicContact CD2-CB 4.22Å; F183-R188 HydrophobicContact CD2-CG 3.82Å; F183-R188 HydrophobicContact CE1-CB 3.68Å; F183-R188 HydrophobicContact CE1-CG 4.35Å; F183-R188 WeakPolarHBondContact CE1-O 3.25Å; F183-R188 HydrophobicContact CE2-CB 4.36Å; F183-R188 HydrophobicContact CE2-CG 4.24Å; F183-R188 HydrophobicContact CG-CB 3.81Å; F183-R188 HydrophobicContact CG-CG 3.67Å; F183-R188 HydrophobicContact CZ-CB 4.1Å; F183-R188 HydrophobicContact CZ-CG 4.48Å; D185-R188 PolarHBondContact O-N 3.1Å; D185-R188 VanDerWaalsContact O-N 3.13Å; D185-R188 PolarHBondContact OD2-N 2.76Å; E186-R188 PolarHBondContact O-N 3.39Å
189	T	97	Very high	96	Very high	82 Å²	82	45.1 Å²	45.1	50%	0.503	21%	0.21	S	C	.	.			trans	-89.8	-24.9	-178.8	65.5	0	0	0	0	113.8	Q158 D185 E187	Q158-T189 PolarHBondContact NE2-O 2.93Å; D185-T189 WeakPolarHBondContact OD2-CB 3.49Å; D185-T189 PolarHBondContact OD2-N 3.35Å; D185-T189 PolarHBondContact OD2-OG1 2.93Å; E187-T189 VanDerWaalsContact C-N 3.26Å; E187-T189 HydrophobicContact CB-CG2 3.9Å; E187-T189 PolarHBondContact O-N 3.03Å
190	R	98.1	Very high	96	Very high	134 Å²	134	46.3 Å²	46.3	51%	0.506	22%	0.216	S	C	.	.			trans	-124.1	141	-177.6	-48.2	151.5	69.1	-159.8	4.4	110.8	Q158 F183 K184 D185	Q158-R190 VanDerWaalsContact OE1-CA 3.29Å; F183-R190 WeakPolarHBondContact CA-O 3.45Å; K184-R190 HydrophobicContact CB-CB 4.25Å; K184-R190 HydrophobicContact CG-CB 4.4Å; K184-R190 PolarHBondContact N-O 3.1Å; D185-R190 WeakPolarHBondContact OD1-CA 3.45Å; D185-R190 WeakPolarHBondContact OD1-CB 3.36Å; D185-R190 WeakPolarHBondContact OD1-CG 3.18Å; D185-R190 PolarHBondContact OD1-N 3.48Å
191	V	98.3	Very high	96	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	151.5	-177.3	-70.1	0	0	0	0	112.4	N112 M137 L155 Q158 I159 I182 F183	N112-V191 PolarHBondContact ND2-O 2.99Å; M137-V191 HydrophobicContact CE-CG1 3.63Å; L155-V191 HydrophobicContact CD2-CG1 4.01Å; Q158-V191 HydrophobicContact CB-CG2 3.5Å; I159-V191 HydrophobicContact CG1-CG2 4.12Å; I182-V191 CarbonylContact O-C 3.56Å; I182-V191 WeakPolarHBondContact O-CA 3.2Å; F183-V191 HydrophobicContact CD1-CG1 3.55Å; F183-V191 HydrophobicContact CE1-CG1 3.51Å; F183-V191 HydrophobicContact CG-CG1 4.39Å; F183-V191 HydrophobicContact CZ-CG1 4.3Å
192	K	97.6	Very high	95.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.6	166.4	57.6	-179.3	169.4	174.8	0	110.3	N112 N114 E131 F181 I182 K184 E194	N112-K192 CarbonylContact O-C 3.57Å; N112-K192 WeakPolarHBondContact O-CA 3.39Å; N114-K192 HydrophobicContact CB-CD 3.91Å; N114-K192 HydrophobicContact CB-CG 4.45Å; N114-K192 WeakPolarHBondContact OD1-CD 3.34Å; N114-K192 WeakPolarHBondContact OD1-CE 3.45Å; N114-K192 PolarHBondContact OD1-NZ 3.28Å; E131-K192 PolarHBondContact O-NZ 3.18Å; E131-K192 IonicContact OE2-NZ 3.46Å; E131-K192 PolarHBondContact OE2-NZ 3.13Å; F181-K192 WeakPolarHBondContact CA-O 3.32Å; I182-K192 HydrophobicContact CD1-CD 4.26Å; I182-K192 HydrophobicContact CD1-CG 4.01Å; I182-K192 HydrophobicContact CG1-CD 4.4Å; I182-K192 HydrophobicContact CG1-CG 3.63Å; I182-K192 WeakPolarHBondContact CG1-O 3.31Å; I182-K192 PolarHBondContact N-O 2.75Å; I182-K192 PolarHBondContact O-N 2.85Å; K184-K192 HydrophobicContact CD-CB 4.07Å; K184-K192 HydrophobicContact CD-CD 4.31Å; K184-K192 HydrophobicContact CD-CG 4.3Å; K184-K192 HydrophobicContact CG-CB 4.12Å; K184-K192 HydrophobicContact CG-CD 4.17Å; K184-K192 HydrophobicContact CG-CG 3.94Å; K192-E194 PolarHBondContact O-N 3.49Å
193	L	97.9	Very high	95.4	Very high	2 Å²	2	60 Å²	60	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	123.1	161.5	174.9	59.9	0	0	0	107.8	N112 N114 A162 L173 K180 F181 L196	N112-L193 PolarHBondContact O-N 2.8Å; N114-L193 WeakPolarHBondContact CB-O 3.37Å; N114-L193 PolarHBondContact N-O 3.23Å; A162-L193 HydrophobicContact CB-CB 4.35Å; L173-L193 HydrophobicContact CD1-CD2 3.76Å; L173-L193 HydrophobicContact CD2-CD2 4.47Å; K180-L193 HydrophobicContact CB-CD1 4.12Å; K180-L193 CarbonylContact O-C 3.23Å; K180-L193 WeakPolarHBondContact O-CA 3.38Å; F181-L193 HydrophobicContact CD1-CB 4.28Å; F181-L193 HydrophobicContact CE1-CB 3.8Å; F181-L193 HydrophobicContact CE1-CD1 4.2Å; F181-L193 HydrophobicContact CE2-CD1 4.09Å; F181-L193 HydrophobicContact CZ-CB 4.27Å; F181-L193 HydrophobicContact CZ-CD1 3.84Å; L193-L196 HydrophobicContact CD2-CD2 3.58Å; L193-L196 HydrophobicContact CG-CD2 4.49Å
194	E	95.8	Very high	94.9	Very high	40 Å²	40	62.1 Å²	62.1	19%	0.187	29%	0.293	C	S	.	.			trans	-70.5	-42.6	-166.9	-176.5	-83.2	147	0	0	113	K90 N114 K180 I182 K192	K90-E194 WeakPolarHBondContact CE-OE1 3.43Å; K90-E194 IonicContact NZ-OE1 2.62Å; K90-E194 PolarHBondContact NZ-OE1 3.45Å; K90-E194 IonicContact NZ-OE2 3.82Å; K90-E194 PolarHBondContact NZ-OE2 2.76Å; N114-E194 WeakPolarHBondContact CB-O 3.5Å; N114-E194 PolarHBondContact ND2-O 2.7Å; K180-E194 WeakPolarHBondContact O-CB 3.31Å; K180-E194 PolarHBondContact O-N 2.7Å; I182-E194 HydrophobicContact CD1-CB 3.85Å; I182-E194 HydrophobicContact CD1-CG 3.65Å; I182-E194 HydrophobicContact CG1-CB 3.93Å; I182-E194 HydrophobicContact CG1-CG 4.21Å; I182-E194 HydrophobicContact CG2-CB 4.12Å; I182-E194 HydrophobicContact CG2-CG 4.07Å; K192-E194 PolarHBondContact O-N 3.49Å
195	S	92.4	Very high	94.6	Very high	15 Å²	15	67.9 Å²	67.9	11%	0.105	33%	0.326	C	S	.	.			trans	-147	160.7	-175.6	49.1	0	0	0	0	111.9	E197	S195-E197 WeakPolarHBondContact CB-OE1 3.42Å
196	L	94.8	Very high	94.4	Very high	5 Å²	5	72.4 Å²	72.4	3%	0.026	35%	0.35	C	S	.	.			trans	-122.6	15.4	172.2	-66.4	170.6	0	0	0	111.8	P103 L107 I113 L171 L173 L193 D198 A199	P103-L196 HydrophobicContact CB-CB 3.85Å; P103-L196 HydrophobicContact CB-CD1 4.45Å; L107-L196 HydrophobicContact CD1-CD1 3.78Å; I113-L196 HydrophobicContact CG2-CD1 3.99Å; I113-L196 HydrophobicContact CG2-CG 4.43Å; L171-L196 HydrophobicContact CD1-CD1 4.39Å; L171-L196 HydrophobicContact CD1-CD2 4.3Å; L173-L196 HydrophobicContact CD2-CD2 3.56Å; L193-L196 HydrophobicContact CD2-CD2 3.58Å; L193-L196 HydrophobicContact CG-CD2 4.49Å; L196-D198 VanDerWaalsContact C-N 3.28Å; L196-D198 PolarHBondContact O-N 3.16Å; L196-A199 HydrophobicContact CB-CB 4.32Å; L196-A199 WeakPolarHBondContact O-CB 3.46Å; L196-A199 PolarHBondContact O-N 3.36Å
197	E	91.6	Very high	94.4	Very high	50 Å²	50	66.6 Å²	66.6	23%	0.234	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-32.2	-170.8	-68.1	152.3	-120.9	0	0	112.2	K90 F92 S195 A199	K90-E197 IonicContact NZ-OE1 3.66Å; K90-E197 PolarHBondContact NZ-OE1 2.92Å; K90-E197 IonicContact NZ-OE2 2.7Å; F92-E197 HydrophobicContact CE1-CG 4.24Å; F92-E197 WeakPolarHBondContact CE1-OE2 3.22Å; F92-E197 HydrophobicContact CZ-CG 4.3Å; S195-E197 WeakPolarHBondContact CB-OE1 3.42Å; E197-A199 VanDerWaalsContact C-N 3.35Å
198	D	90.8	Very high	94.2	Very high	68 Å²	68	62.2 Å²	62.2	36%	0.364	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-4.9	174.2	-45.3	-77.1	0	0	0	114.3	R174 D175 K180 L196	R174-D198 VanDerWaalsContact CZ-O 3.25Å; R174-D198 PolarHBondContact NE-O 3.13Å; R174-D198 PolarHBondContact NH2-O 3.17Å; D175-D198 HydrophobicContact CB-CB 4.47Å; K180-D198 IonicContact NZ-OD2 3.69Å; K180-D198 PolarHBondContact NZ-OD2 2.95Å; L196-D198 VanDerWaalsContact C-N 3.28Å; L196-D198 PolarHBondContact O-N 3.16Å
199	A	94.3	Very high	94	Very high	12 Å²	12	58.4 Å²	58.4	10%	0.099	30%	0.296	C	S	.	.			trans	-76.4	135.2	-169	0	0	0	0	0	112.7	P103 L171 V172 L173 L196 E197	P103-A199 HydrophobicContact CB-CB 4.13Å; P103-A199 HydrophobicContact CG-CB 4.14Å; L171-A199 HydrophobicContact CD1-CB 4.17Å; V172-A199 CarbonylContact O-C 3.41Å; V172-A199 VanDerWaalsContact O-CA 3.28Å; V172-A199 WeakPolarHBondContact O-CA 3.03Å; L173-A199 HydrophobicContact CD2-CB 3.81Å; L196-A199 HydrophobicContact CB-CB 4.32Å; L196-A199 WeakPolarHBondContact O-CB 3.46Å; L196-A199 PolarHBondContact O-N 3.36Å; E197-A199 VanDerWaalsContact C-N 3.35Å
200	Y	94.8	Very high	93.6	Very high	90 Å²	90	59.2 Å²	59.2	35%	0.353	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129	174.8	-169	-78.4	0	0	0	110.8	L171 V172 L202 L209	L171-Y200 WeakPolarHBondContact CA-O 3.35Å; V172-Y200 PolarHBondContact N-O 3.02Å; V172-Y200 PolarHBondContact O-N 3.1Å; Y200-L202 HydrophobicContact CD1-CD2 3.98Å; Y200-L202 HydrophobicContact CE1-CD2 4.31Å; Y200-L209 HydrophobicContact CD1-CD2 3.75Å; Y200-L209 HydrophobicContact CD2-CD2 4.17Å; Y200-L209 HydrophobicContact CE1-CD2 3.92Å; Y200-L209 HydrophobicContact CE2-CD2 4.32Å; Y200-L209 HydrophobicContact CG-CD2 3.88Å
201	I	95.6	Very high	92.9	Very high	64 Å²	64	54.5 Å²	54.5	33%	0.328	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	112	176.8	-51.2	174.1	0	0	0	109.4	A102 P103 L171	A102-I201 HydrophobicContact CB-CD1 3.81Å; P103-I201 HydrophobicContact CG-CD1 4.2Å; P103-I201 HydrophobicContact CG-CG1 4.11Å; L171-I201 HydrophobicContact CD2-CB 4.17Å; L171-I201 HydrophobicContact CD2-CG1 3.73Å; L171-I201 HydrophobicContact CD2-CG2 4.31Å
202	L	94.8	Very high	91.9	Very high	18 Å²	18	58 Å²	58	9%	0.094	31%	0.305	C	S	.	.			trans	-67.9	147.5	-178.5	-61.2	-179.3	0	0	0	112.3	G170 V172 Y200 G204 D207 L209	G170-L202 VanDerWaalsContact O-CB 3.26Å; G170-L202 WeakPolarHBondContact O-CB 3.41Å; G170-L202 WeakPolarHBondContact O-CG 3.42Å; G170-L202 PolarHBondContact O-N 3.22Å; V172-L202 HydrophobicContact CG2-CD1 4.12Å; V172-L202 HydrophobicContact CG2-CD2 3.94Å; V172-L202 HydrophobicContact CG2-CG 4.22Å; Y200-L202 HydrophobicContact CD1-CD2 3.98Å; Y200-L202 HydrophobicContact CE1-CD2 4.31Å; L202-G204 PolarHBondContact O-N 3.04Å; L202-D207 HydrophobicContact CD1-CB 3.72Å; L202-D207 HydrophobicContact CD2-CB 4.21Å; L202-L209 HydrophobicContact CD2-CD2 4.46Å
203	R	88.5	Confident	90.8	Very high	235 Å²	235	61.9 Å²	61.9	89%	0.887	32%	0.323	S	S	*	.	S	Bend	trans	-98.1	60.4	178.3	-66.7	-175.6	-178.4	-94.9	-1.8	111
204	G	89.5	Confident	89.4	Confident	46 Å²	46	62.6 Å²	62.6	47%	0.474	33%	0.331	S	S	.	.	S	Bend	trans	106.7	-144.8	-172.7	0	0	0	0	0	111.2	L202	L202-G204 PolarHBondContact O-N 3.04Å
205	N	88.4	Confident	88.8	Confident	161 Å²	161	61.2 Å²	61.2	86%	0.861	33%	0.326	S	S	*	.	S	Bend	trans	-93.2	-8	-171.8	-63.5	6.6	0	0	0	114.2
206	D	93	Very high	88.4	Confident	107 Å²	107	61.3 Å²	61.3	57%	0.572	33%	0.326	S	S	*	.			trans	-77.9	119.6	175.8	-175	9.2	0	0	0	109.5	S208	D206-S208 WeakPolarHBondContact OD1-CB 3.37Å; D206-S208 PolarHBondContact OD1-N 3.19Å; D206-S208 PolarHBondContact OD1-OG 3.18Å
207	D	95	Very high	88.1	Confident	29 Å²	29	61.3 Å²	61.3	16%	0.155	33%	0.327	C	S	.	.			trans	-104	16.9	176.7	80.3	-49.3	0	0	0	113.1	V172 L202 L209 S231 G232 K233	V172-D207 HydrophobicContact CG2-CB 4.39Å; L202-D207 HydrophobicContact CD1-CB 3.72Å; L202-D207 HydrophobicContact CD2-CB 4.21Å; D207-L209 PolarHBondContact O-N 2.86Å; D207-L209 VanDerWaalsContact O-N 3.14Å; D207-S231 WeakPolarHBondContact OD2-CA 3.5Å; D207-S231 WeakPolarHBondContact OD2-CB 3.4Å; D207-S231 PolarHBondContact OD2-OG 2.64Å; D207-G232 PolarHBondContact O-N 3.26Å; D207-G232 PolarHBondContact OD2-N 2.7Å; D207-G232 VanDerWaalsContact OD2-N 3.08Å; D207-K233 HydrophobicContact CB-CD 4.33Å; D207-K233 HydrophobicContact CB-CG 4.06Å; D207-K233 WeakPolarHBondContact OD2-CB 3.5Å; D207-K233 PolarHBondContact OD2-N 2.91Å
208	S	93.6	Very high	88.2	Confident	60 Å²	60	59.2 Å²	59.2	42%	0.42	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	106.8	173.7	-61	0	0	0	0	111.7	D206 Y230	D206-S208 WeakPolarHBondContact OD1-CB 3.37Å; D206-S208 PolarHBondContact OD1-N 3.19Å; D206-S208 PolarHBondContact OD1-OG 3.18Å; S208-Y230 WeakPolarHBondContact CA-O 3.49Å
209	L	92.2	Very high	88.3	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.037	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	156.8	172.4	-60	-176.1	0	0	0	110.7	V172 R174 Y200 L202 D207 S229 Y230	V172-L209 HydrophobicContact CB-CD1 4.14Å; V172-L209 HydrophobicContact CG1-CD1 3.83Å; V172-L209 HydrophobicContact CG2-CD1 4.46Å; R174-L209 HydrophobicContact CG-CD1 3.99Å; Y200-L209 HydrophobicContact CD1-CD2 3.75Å; Y200-L209 HydrophobicContact CD2-CD2 4.17Å; Y200-L209 HydrophobicContact CE1-CD2 3.92Å; Y200-L209 HydrophobicContact CE2-CD2 4.32Å; Y200-L209 HydrophobicContact CG-CD2 3.88Å; L202-L209 HydrophobicContact CD2-CD2 4.46Å; D207-L209 PolarHBondContact O-N 2.86Å; D207-L209 VanDerWaalsContact O-N 3.14Å; L209-S229 CarbonylContact O-C 3.49Å; L209-S229 WeakPolarHBondContact O-CA 3.31Å; L209-S229 VanDerWaalsContact O-CB 3.23Å; L209-S229 WeakPolarHBondContact O-CB 3.41Å; L209-Y230 HydrophobicContact CB-CD1 4.28Å; L209-Y230 HydrophobicContact CB-CE1 3.62Å; L209-Y230 HydrophobicContact CB-CE2 4.31Å; L209-Y230 PolarHBondContact N-O 2.73Å; L209-Y230 WeakPolarHBondContact O-CD1 2.94Å; L209-Y230 PolarHBondContact O-N 3.12Å
210	S	88.5	Confident	88.3	Confident	99 Å²	99	55.6 Å²	55.6	69%	0.692	30%	0.296	S	S	*	.			trans	-135.6	13.5	179.4	71.1	0	0	0	0	113.2	G228	S210-G228 WeakPolarHBondContact CB-O 3.45Å
211	D	84.5	Confident	88.2	Confident	35 Å²	35	51.5 Å²	51.5	19%	0.187	28%	0.28	C	S	.	.			trans	-83.6	175.6	172.8	52.8	7.8	0	0	0	111	R174 H213 Y230	R174-D211 VanDerWaalsContact CD-OD2 3.31Å; R174-D211 WeakPolarHBondContact CD-OD2 3.35Å; R174-D211 IonicContact CZ-OD2 2.71Å; R174-D211 IonicContact NE-OD2 3.35Å; R174-D211 IonicContact NH1-OD2 3.62Å; R174-D211 PolarHBondContact NH1-OD2 2.96Å; D211-H213 IonicContact OD2-CD2 3.63Å; D211-H213 PolarHBondContact OD2-CD2 3.05Å; D211-H213 IonicContact OD2-NE2 3.49Å; D211-Y230 WeakPolarHBondContact O-CE1 3.12Å; D211-Y230 PolarHBondContact OD1-OH 2.8Å
212	K	77.3	Confident	88.1	Confident	75 Å²	75	49.3 Å²	49.3	33%	0.326	27%	0.269	S	S	.	.			trans	-133.2	86.4	175.1	-72.1	-175.2	177.9	179.3	0	109.8	F341 F342	K212-F341 HydrophobicContact CD-CD1 4.23Å; K212-F341 HydrophobicContact CD-CE1 3.94Å; K212-F341 HydrophobicContact CD-CZ 4.45Å; K212-F341 WeakPolarHBondContact CD-O 3.49Å; K212-F341 VanDerWaalsContact NZ-CZ 3.27Å; K212-F342 HydrophobicContact CB-CD1 4.21Å
213	H	72.7	Confident	87.9	Confident	81 Å²	81	49 Å²	49	38%	0.375	27%	0.267	S	S	.	.			trans	-119.2	162.9	174	-59.7	-59.2	0	0	0	110.8	R174 D211	R174-H213 HydrophobicContact CB-CB 4.34Å; R174-H213 PolarHBondContact NH1-CD2 3.08Å; R174-H213 PolarHBondContact NH1-NE2 3.47Å; D211-H213 IonicContact OD2-CD2 3.63Å; D211-H213 PolarHBondContact OD2-CD2 3.05Å; D211-H213 IonicContact OD2-NE2 3.49Å
214	G	68.9	Low	87.9	Confident	17 Å²	17	38 Å²	38	18%	0.175	23%	0.226	C	C	.	.	S	Bend	trans	113.2	143.3	175	0	0	0	0	0	113.6
215	C	82.8	Confident	87.4	Confident	12 Å²	12	40 Å²	40	8%	0.081	23%	0.226	C	C	.	.			trans	-61.6	137.3	179.2	179.5	0	0	0	0	112.4	A217 Y218 V219	C215-A217 PolarHBondContact O-N 3.23Å; C215-Y218 HydrophobicContact CB-CD2 4Å; C215-Y218 PolarHBondContact O-N 3.45Å; C215-V219 PolarHBondContact O-N 2.78Å
216	P	85.2	Confident	86.4	Confident	16 Å²	16	34 Å²	34	10%	0.104	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-21.6	-179.9	-30.8	36.6	0	0	0	116.7	L262 F263 I266 F342	P216-L262 HydrophobicContact CB-CD2 4.45Å; P216-F263 HydrophobicContact CB-CE1 4.08Å; P216-F263 HydrophobicContact CB-CZ 4.37Å; P216-I266 WeakPolarHBondContact O-CD1 3.14Å; P216-F342 HydrophobicContact CG-CE2 4.04Å
217	A	88.3	Confident	85.1	Confident	6 Å²	6	37.5 Å²	37.5	5%	0.05	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-21.1	175.1	0	0	0	0	0	113.9	C215 V242 Y252	C215-A217 PolarHBondContact O-N 3.23Å; A217-V242 WeakPolarHBondContact O-CG1 3.35Å; A217-Y252 HydrophobicContact CB-CD1 4.27Å; A217-Y252 HydrophobicContact CB-CD2 4.19Å; A217-Y252 HydrophobicContact CB-CE1 4.17Å; A217-Y252 HydrophobicContact CB-CE2 4.04Å; A217-Y252 HydrophobicContact CB-CG 4.29Å
218	Y	93.5	Very high	84.2	Confident	5 Å²	5	38.3 Å²	38.3	2%	0.02	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-17.4	-175.7	-64.2	-97.6	0	0	0	113.1	L176 K177 L178 C215 S239 V242 M243 Y252	L176-Y218 VanDerWaalsContact O-CD1 3.26Å; L176-Y218 WeakPolarHBondContact O-CD1 3.42Å; K177-Y218 HydrophobicContact CB-CD2 4.12Å; K177-Y218 HydrophobicContact CB-CE1 4.29Å; K177-Y218 HydrophobicContact CB-CE2 3.8Å; K177-Y218 HydrophobicContact CB-CG 4.48Å; L178-Y218 PolarHBondContact N-OH 2.78Å; C215-Y218 HydrophobicContact CB-CD2 4Å; C215-Y218 PolarHBondContact O-N 3.45Å; Y218-S239 PolarHBondContact O-OG 2.85Å; Y218-V242 HydrophobicContact CD1-CB 3.82Å; Y218-V242 HydrophobicContact CD1-CG1 3.47Å; Y218-V242 VanDerWaalsContact CD1-CG1 3.47Å; Y218-V242 HydrophobicContact CE1-CB 4.34Å; Y218-V242 HydrophobicContact CE1-CG1 3.73Å; Y218-V242 HydrophobicContact CG-CG1 4.02Å; Y218-M243 HydrophobicContact CD1-CG 4.14Å; Y218-M243 HydrophobicContact CE1-CG 3.63Å; Y218-Y252 HydrophobicContact CE1-CE1 4.45Å; Y218-Y252 AromaticContact CE2-CE1 3.8Å; Y218-Y252 HydrophobicContact CE2-CE1 3.8Å; Y218-Y252 AromaticContact CZ-CE1 3.69Å
219	V	93.1	Very high	84	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.024	23%	0.232	C	C	.	.			trans	-54.1	143.7	-179.1	71.4	0	0	0	0	113.4	C215 I223 L224 W238 F263 I266 F342	C215-V219 PolarHBondContact O-N 2.78Å; V219-I223 HydrophobicContact CG2-CB 3.82Å; V219-I223 HydrophobicContact CG2-CD1 4.18Å; V219-I223 HydrophobicContact CG2-CG2 3.68Å; V219-L224 HydrophobicContact CG1-CD1 4.15Å; V219-L224 HydrophobicContact CG1-CD2 4Å; V219-L224 HydrophobicContact CG1-CG 4.15Å; V219-L224 HydrophobicContact CG2-CD2 4.16Å; V219-L224 HydrophobicContact CG2-CG 4.24Å; V219-W238 PolarHBondContact O-NE1 3.25Å; V219-F263 HydrophobicContact CG1-CE1 4.42Å; V219-I266 HydrophobicContact CG1-CD1 3.93Å; V219-I266 WeakPolarHBondContact O-CG2 3.3Å; V219-F342 HydrophobicContact CG2-CE1 4.1Å; V219-F342 HydrophobicContact CG2-CZ 4.21Å
220	S	94	Very high	84.1	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.007	23%	0.233	C	C	.	.			trans	-91.4	158.9	-176.2	68.7	0	0	0	0	114	E222 I223 L224 W238	S220-E222 VanDerWaalsContact C-N 3.28Å; S220-E222 WeakPolarHBondContact CB-OE1 3.38Å; S220-E222 PolarHBondContact O-N 2.9Å; S220-E222 PolarHBondContact OG-OE1 3.13Å; S220-E222 PolarHBondContact OG-OE2 3.16Å; S220-I223 PolarHBondContact O-N 3.03Å; S220-I223 WeakPolarHBondContact OG-CD1 3.35Å; S220-I223 WeakPolarHBondContact OG-CG1 3.43Å; S220-L224 PolarHBondContact O-N 2.71Å; S220-W238 VanDerWaalsContact CA-CD1 3.49Å
221	P	93.7	Very high	84.4	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.019	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-35.2	-177.1	-25.3	35.2	0	0	0	113.9	N225 W238 I266 R291	P221-N225 WeakPolarHBondContact O-CB 3.49Å; P221-N225 PolarHBondContact O-N 2.98Å; P221-N225 PolarHBondContact O-ND2 3.42Å; P221-W238 HydrophobicContact CG-CD2 4.45Å; P221-W238 HydrophobicContact CG-CE3 4.22Å; P221-W238 HydrophobicContact CG-CH2 3.55Å; P221-W238 HydrophobicContact CG-CZ2 3.8Å; P221-W238 HydrophobicContact CG-CZ3 3.79Å; P221-I266 HydrophobicContact CG-CG2 4.24Å; P221-R291 HydrophobicContact CB-CG 4.38Å; P221-R291 HydrophobicContact CG-CG 4.4Å
222	E	92.3	Very high	85	Confident	19 Å²	19	34.5 Å²	34.5	9%	0.089	20%	0.204	C	C	.	.	H	α-helix	trans	-70.5	-44.2	-179.2	62.3	-75.3	179.1	0	0	112.5	S220 L224 N225 T226 Y230 P293 R296	S220-E222 VanDerWaalsContact C-N 3.28Å; S220-E222 WeakPolarHBondContact CB-OE1 3.38Å; S220-E222 PolarHBondContact O-N 2.9Å; S220-E222 PolarHBondContact OG-OE1 3.13Å; S220-E222 PolarHBondContact OG-OE2 3.16Å; E222-L224 PolarHBondContact O-N 3.19Å; E222-N225 PolarHBondContact O-N 3.28Å; E222-T226 WeakPolarHBondContact O-CB 3.47Å; E222-T226 PolarHBondContact O-N 3.06Å; E222-T226 PolarHBondContact O-OG1 3.32Å; E222-Y230 HydrophobicContact CG-CD2 4.45Å; E222-P293 HydrophobicContact CB-CG 4.11Å; E222-P293 HydrophobicContact CG-CG 3.9Å; E222-R296 IonicContact OE1-CZ 2.7Å; E222-R296 IonicContact OE1-NH1 3.52Å; E222-R296 PolarHBondContact OE1-NH1 3.35Å; E222-R296 IonicContact OE1-NH2 3.88Å; E222-R296 IonicContact OE2-CZ 3.67Å; E222-R296 IonicContact OE2-NH1 3.84Å; E222-R296 PolarHBondContact OE2-NH1 3.33Å; E222-R296 IonicContact OE2-NH2 3.89Å; E222-R296 PolarHBondContact OE2-NH2 2.9Å
223	I	91.6	Very high	85.9	Confident	10 Å²	10	33.8 Å²	33.8	5%	0.051	20%	0.201	C	C	.	.	H	α-helix	trans	-55.9	-39.4	175.2	-65.8	171.2	0	0	0	110.7	V219 S220 Y230 A235	V219-I223 HydrophobicContact CG2-CB 3.82Å; V219-I223 HydrophobicContact CG2-CD1 4.18Å; V219-I223 HydrophobicContact CG2-CG2 3.68Å; S220-I223 PolarHBondContact O-N 3.03Å; S220-I223 WeakPolarHBondContact OG-CD1 3.35Å; S220-I223 WeakPolarHBondContact OG-CG1 3.43Å; I223-Y230 HydrophobicContact CD1-CD2 4.17Å; I223-Y230 HydrophobicContact CD1-CE2 3.68Å; I223-Y230 HydrophobicContact CG1-CD1 4.2Å; I223-Y230 HydrophobicContact CG1-CD2 3.64Å; I223-Y230 HydrophobicContact CG1-CE1 4.18Å; I223-Y230 HydrophobicContact CG1-CE2 3.58Å; I223-Y230 HydrophobicContact CG1-CG 3.97Å; I223-A235 HydrophobicContact CD1-CB 3.9Å
224	L	88.1	Confident	87.1	Confident	6 Å²	6	30.5 Å²	30.5	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-70.7	-29.2	178	-64.5	179.4	0	0	0	113.8	V219 S220 E222 F263 I266 R267 F341 F342	V219-L224 HydrophobicContact CG1-CD1 4.15Å; V219-L224 HydrophobicContact CG1-CD2 4Å; V219-L224 HydrophobicContact CG1-CG 4.15Å; V219-L224 HydrophobicContact CG2-CD2 4.16Å; V219-L224 HydrophobicContact CG2-CG 4.24Å; S220-L224 PolarHBondContact O-N 2.71Å; E222-L224 PolarHBondContact O-N 3.19Å; L224-F263 HydrophobicContact CD1-CB 4.03Å; L224-F263 HydrophobicContact CD1-CD1 3.79Å; L224-F263 HydrophobicContact CD1-CG 4.24Å; L224-F263 HydrophobicContact CD2-CD1 3.6Å; L224-F263 HydrophobicContact CD2-CE1 3.93Å; L224-F263 HydrophobicContact CD2-CG 4.1Å; L224-F263 HydrophobicContact CG-CD1 4.37Å; L224-I266 HydrophobicContact CD1-CB 3.83Å; L224-I266 HydrophobicContact CD1-CD1 4.36Å; L224-I266 HydrophobicContact CD1-CG2 3.56Å; L224-R267 VanDerWaalsContact C-NH1 3.29Å; L224-R267 HydrophobicContact CB-CG 4.3Å; L224-R267 HydrophobicContact CD1-CG 4.29Å; L224-R267 PolarHBondContact O-NH1 3.35Å; L224-R267 PolarHBondContact O-NH2 3.46Å; L224-F341 HydrophobicContact CD2-CE1 4.17Å; L224-F342 HydrophobicContact CD2-CZ 4.4Å
225	N	79.5	Confident	88.5	Confident	87 Å²	87	30 Å²	30	47%	0.465	18%	0.182	S	C	.	.	H	α-helix	trans	-99.2	-10.4	-171.5	-73.3	-28	0	0	0	114.3	P221 E222 R267	P221-N225 WeakPolarHBondContact O-CB 3.49Å; P221-N225 PolarHBondContact O-N 2.98Å; P221-N225 PolarHBondContact O-ND2 3.42Å; E222-N225 PolarHBondContact O-N 3.28Å; N225-R267 WeakPolarHBondContact OD1-CG 3.04Å; N225-R267 PolarHBondContact OD1-NH1 2.98Å
226	T	67.6	Low	89.2	Confident	35 Å²	35	29.5 Å²	29.5	22%	0.215	18%	0.179	C	C	.	.			trans	-90.2	131.2	-164.1	-84.5	0	0	0	0	114.4	E222 G228 S229	E222-T226 WeakPolarHBondContact O-CB 3.47Å; E222-T226 PolarHBondContact O-N 3.06Å; E222-T226 PolarHBondContact O-OG1 3.32Å; T226-G228 VanDerWaalsContact CG2-O 3.24Å; T226-G228 WeakPolarHBondContact CG2-O 3.5Å; T226-S229 WeakPolarHBondContact CG2-O 3.26Å
227	N	64.8	Low	89.8	Confident	180 Å²	180	28.9 Å²	28.9	96%	0.963	18%	0.175	S	C	*	.	S	Bend	trans	-107.8	30.6	167.1	-71.5	-7.7	0	0	0	111.2
228	G	76.1	Confident	90.3	Very high	47 Å²	47	28.6 Å²	28.6	49%	0.485	17%	0.172	S	C	.	.	S	Bend	trans	-165.4	-126.8	-167.6	0	0	0	0	0	110.7	S210 T226	S210-G228 WeakPolarHBondContact CB-O 3.45Å; T226-G228 VanDerWaalsContact CG2-O 3.24Å; T226-G228 WeakPolarHBondContact CG2-O 3.5Å
229	S	90	Very high	90.5	Very high	69 Å²	69	28.9 Å²	28.9	48%	0.483	18%	0.175	S	C	.	.			trans	-111.4	165.9	175.6	58	0	0	0	0	114.5	L209 T226	L209-S229 CarbonylContact O-C 3.49Å; L209-S229 WeakPolarHBondContact O-CA 3.31Å; L209-S229 VanDerWaalsContact O-CB 3.23Å; L209-S229 WeakPolarHBondContact O-CB 3.41Å; T226-S229 WeakPolarHBondContact CG2-O 3.26Å
230	Y	93.4	Very high	90.8	Very high	14 Å²	14	28.7 Å²	28.7	6%	0.055	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	157	174.1	70.1	-79.4	0	0	0	110.6	S208 L209 D211 E222 I223 G232 A235	S208-Y230 WeakPolarHBondContact CA-O 3.49Å; L209-Y230 HydrophobicContact CB-CD1 4.28Å; L209-Y230 HydrophobicContact CB-CE1 3.62Å; L209-Y230 HydrophobicContact CB-CE2 4.31Å; L209-Y230 PolarHBondContact N-O 2.73Å; L209-Y230 WeakPolarHBondContact O-CD1 2.94Å; L209-Y230 PolarHBondContact O-N 3.12Å; D211-Y230 WeakPolarHBondContact O-CE1 3.12Å; D211-Y230 PolarHBondContact OD1-OH 2.8Å; E222-Y230 HydrophobicContact CG-CD2 4.45Å; I223-Y230 HydrophobicContact CD1-CD2 4.17Å; I223-Y230 HydrophobicContact CD1-CE2 3.68Å; I223-Y230 HydrophobicContact CG1-CD1 4.2Å; I223-Y230 HydrophobicContact CG1-CD2 3.64Å; I223-Y230 HydrophobicContact CG1-CE1 4.18Å; I223-Y230 HydrophobicContact CG1-CE2 3.58Å; I223-Y230 HydrophobicContact CG1-CG 3.97Å; Y230-G232 PolarHBondContact O-N 2.96Å; Y230-A235 HydrophobicContact CD2-CB 3.95Å; Y230-A235 HydrophobicContact CE2-CB 3.81Å
231	S	95.4	Very high	91	Very high	38 Å²	38	28.6 Å²	28.6	27%	0.266	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	112.4	172.7	161	0	0	0	0	109.9	D207 K233 A234 A235	D207-S231 WeakPolarHBondContact OD2-CA 3.5Å; D207-S231 WeakPolarHBondContact OD2-CB 3.4Å; D207-S231 PolarHBondContact OD2-OG 2.64Å; S231-K233 PolarHBondContact O-N 2.74Å; S231-A234 PolarHBondContact O-N 3.01Å; S231-A234 VanDerWaalsContact OG-CB 3.28Å; S231-A234 WeakPolarHBondContact OG-CB 3.03Å; S231-A234 PolarHBondContact OG-N 3.15Å; S231-A235 PolarHBondContact O-N 3.02Å; S231-A235 VanDerWaalsContact O-N 3.09Å
232	G	96.1	Very high	91.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-40	178.9	0	0	0	0	0	113.2	V172 D207 Y230 A235 D236	V172-G232 VanDerWaalsContact CG1-C 3.48Å; V172-G232 WeakPolarHBondContact CG1-O 3.39Å; D207-G232 PolarHBondContact O-N 3.26Å; D207-G232 PolarHBondContact OD2-N 2.7Å; D207-G232 VanDerWaalsContact OD2-N 3.08Å; Y230-G232 PolarHBondContact O-N 2.96Å; G232-A235 PolarHBondContact O-N 2.97Å; G232-D236 PolarHBondContact O-N 3.2Å
233	K	97.8	Very high	91.5	Very high	59 Å²	59	27.6 Å²	27.6	26%	0.257	17%	0.168	S	C	.	.	H	α-helix	trans	-67.6	-38.5	178.4	-66.1	-176.5	172.3	-175	0	111.9	H167 V172 D207 S231 A235 D236 V237	H167-K233 HydrophobicContact CB-CD 4.13Å; H167-K233 PolarHBondContact CE1-O 2.84Å; H167-K233 VanDerWaalsContact O-CE 3.3Å; H167-K233 WeakPolarHBondContact O-CE 3.1Å; H167-K233 PolarHBondContact O-NZ 2.93Å; V172-K233 HydrophobicContact CG2-CG 3.96Å; D207-K233 HydrophobicContact CB-CD 4.33Å; D207-K233 HydrophobicContact CB-CG 4.06Å; D207-K233 WeakPolarHBondContact OD2-CB 3.5Å; D207-K233 PolarHBondContact OD2-N 2.91Å; S231-K233 PolarHBondContact O-N 2.74Å; K233-A235 VanDerWaalsContact C-N 3.32Å; K233-D236 PolarHBondContact O-N 2.88Å; K233-V237 WeakPolarHBondContact O-CB 3.2Å; K233-V237 WeakPolarHBondContact O-CG2 3.07Å; K233-V237 PolarHBondContact O-N 2.97Å
234	A	97.7	Very high	91.9	Very high	13 Å²	13	27.1 Å²	27.1	11%	0.107	17%	0.166	C	C	.	.	H	α-helix	trans	-68.7	-31.7	175.5	0	0	0	0	0	112.3	S231 V237 W238 P293 R296	S231-A234 PolarHBondContact O-N 3.01Å; S231-A234 VanDerWaalsContact OG-CB 3.28Å; S231-A234 WeakPolarHBondContact OG-CB 3.03Å; S231-A234 PolarHBondContact OG-N 3.15Å; A234-V237 WeakPolarHBondContact O-CB 3.37Å; A234-W238 PolarHBondContact O-N 3.39Å; A234-P293 HydrophobicContact CB-CB 3.79Å; A234-R296 VanDerWaalsContact C-NH1 3.33Å; A234-R296 PolarHBondContact O-NH1 3.41Å
235	A	96.9	Very high	92.4	Very high	7 Å²	7	26.8 Å²	26.8	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-69.1	-45.3	173.1	0	0	0	0	0	112.1	I223 Y230 S231 G232 K233 V237 W238 S239	I223-A235 HydrophobicContact CD1-CB 3.9Å; Y230-A235 HydrophobicContact CD2-CB 3.95Å; Y230-A235 HydrophobicContact CE2-CB 3.81Å; S231-A235 PolarHBondContact O-N 3.02Å; S231-A235 VanDerWaalsContact O-N 3.09Å; G232-A235 PolarHBondContact O-N 2.97Å; K233-A235 VanDerWaalsContact C-N 3.32Å; A235-V237 VanDerWaalsContact C-N 3.26Å; A235-V237 PolarHBondContact O-N 3.22Å; A235-W238 WeakPolarHBondContact O-CB 3.36Å; A235-W238 PolarHBondContact O-N 3.41Å; A235-W238 VanDerWaalsContact O-N 3.08Å; A235-S239 PolarHBondContact O-N 2.71Å; A235-S239 PolarHBondContact O-OG 3.02Å
236	D	97.9	Very high	93.3	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-54.8	-42.6	171.3	-84.7	-11.8	0	0	0	111.8	V163 H167 L173 R174 L176 G232 K233 S239 L240	V163-D236 HydrophobicContact CG1-CB 4.48Å; H167-D236 IonicContact CD2-OD2 3.29Å; H167-D236 IonicContact CE1-OD2 3.37Å; H167-D236 WeakPolarHBondContact NE2-CB 3.33Å; H167-D236 IonicContact NE2-OD2 2.7Å; H167-D236 PolarHBondContact NE2-OD2 3.4Å; L173-D236 PolarHBondContact N-OD1 3.33Å; L173-D236 PolarHBondContact N-OD2 3.39Å; R174-D236 PolarHBondContact N-OD1 3.27Å; L176-D236 HydrophobicContact CD1-CB 3.65Å; L176-D236 WeakPolarHBondContact CD1-O 3.33Å; G232-D236 PolarHBondContact O-N 3.2Å; K233-D236 PolarHBondContact O-N 2.88Å; D236-S239 WeakPolarHBondContact O-CB 3.37Å; D236-S239 PolarHBondContact O-N 2.99Å; D236-L240 PolarHBondContact O-N 2.66Å
237	V	98.7	Very high	94.7	Very high	3 Å²	3	21 Å²	21	2%	0.018	13%	0.132	C	C	.	.	H	α-helix	trans	-61.3	-42.4	174.8	157.7	0	0	0	0	112	K233 A234 A235 S239 L240 G241 I288 R296 L297 I302	K233-V237 WeakPolarHBondContact O-CB 3.2Å; K233-V237 WeakPolarHBondContact O-CG2 3.07Å; K233-V237 PolarHBondContact O-N 2.97Å; A234-V237 WeakPolarHBondContact O-CB 3.37Å; A235-V237 VanDerWaalsContact C-N 3.26Å; A235-V237 PolarHBondContact O-N 3.22Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.45Å; V237-L240 WeakPolarHBondContact O-CB 3.31Å; V237-L240 PolarHBondContact O-N 3.4Å; V237-G241 PolarHBondContact O-N 2.62Å; V237-G241 VanDerWaalsContact O-N 3.1Å; V237-I288 HydrophobicContact CG1-CG2 3.93Å; V237-I288 WeakPolarHBondContact O-CG2 3.47Å; V237-R296 HydrophobicContact CG1-CB 3.85Å; V237-R296 HydrophobicContact CG1-CG 4.46Å; V237-L297 WeakPolarHBondContact CG1-O 3.3Å; V237-I302 HydrophobicContact CG1-CD1 4.45Å
238	W	98.2	Very high	96.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.1	-43.3	175	172.8	-84.9	0	0	0	111.6	V219 S220 P221 A234 A235 L240 G241 V242 F254 I266 L289	V219-W238 PolarHBondContact O-NE1 3.25Å; S220-W238 VanDerWaalsContact CA-CD1 3.49Å; P221-W238 HydrophobicContact CG-CD2 4.45Å; P221-W238 HydrophobicContact CG-CE3 4.22Å; P221-W238 HydrophobicContact CG-CH2 3.55Å; P221-W238 HydrophobicContact CG-CZ2 3.8Å; P221-W238 HydrophobicContact CG-CZ3 3.79Å; A234-W238 PolarHBondContact O-N 3.39Å; A235-W238 WeakPolarHBondContact O-CB 3.36Å; A235-W238 PolarHBondContact O-N 3.41Å; A235-W238 VanDerWaalsContact O-N 3.08Å; W238-L240 VanDerWaalsContact C-N 3.33Å; W238-L240 PolarHBondContact O-N 2.87Å; W238-G241 WeakPolarHBondContact O-CA 3.44Å; W238-G241 PolarHBondContact O-N 3.27Å; W238-V242 PolarHBondContact O-N 2.98Å; W238-F254 AromaticContact CH2-CE2 3.8Å; W238-F254 HydrophobicContact CH2-CE2 3.8Å; W238-F254 AromaticContact CH2-CZ 3.59Å; W238-F254 HydrophobicContact CH2-CZ 3.59Å; W238-F254 HydrophobicContact CZ2-CD2 4.15Å; W238-F254 AromaticContact CZ2-CE2 3.24Å; W238-F254 HydrophobicContact CZ2-CE2 3.24Å; W238-F254 AromaticContact CZ2-CZ 3.54Å; W238-F254 HydrophobicContact CZ2-CZ 3.54Å; W238-I266 HydrophobicContact CZ2-CG2 4.04Å; W238-L289 HydrophobicContact CD2-CD2 3.67Å; W238-L289 HydrophobicContact CE3-CB 4.37Å; W238-L289 HydrophobicContact CE3-CD2 3.74Å; W238-L289 HydrophobicContact CG-CD2 4.14Å; W238-L289 HydrophobicContact CH2-CD2 4.44Å; W238-L289 HydrophobicContact CZ2-CD2 4.38Å; W238-L289 HydrophobicContact CZ3-CB 4.18Å; W238-L289 HydrophobicContact CZ3-CD2 4.14Å; W238-L289 WeakPolarHBondContact O-CD2 3.27Å
239	S	98.1	Very high	97.4	Very high	10 Å²	10	11.4 Å²	11.4	7%	0.07	7%	0.07	C	C	.	.	H	α-helix	trans	-59.5	-40.2	174.6	-59.2	0	0	0	0	112.5	Y218 A235 D236 V237 G241 V242 M243	Y218-S239 PolarHBondContact O-OG 2.85Å; A235-S239 PolarHBondContact O-N 2.71Å; A235-S239 PolarHBondContact O-OG 3.02Å; D236-S239 WeakPolarHBondContact O-CB 3.37Å; D236-S239 PolarHBondContact O-N 2.99Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.45Å; S239-G241 VanDerWaalsContact C-N 3.27Å; S239-G241 PolarHBondContact O-N 3.27Å; S239-V242 WeakPolarHBondContact O-CB 3.24Å; S239-V242 PolarHBondContact O-N 2.68Å; S239-M243 VanDerWaalsContact O-CG 3.31Å; S239-M243 WeakPolarHBondContact O-CG 3.05Å; S239-M243 PolarHBondContact O-N 3.28Å
240	L	98.6	Very high	97.6	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-57.9	-37.7	170	-75.7	177.8	0	0	0	112.5	F156 I159 V163 L176 D236 V237 W238 M243 L244 I302	F156-L240 HydrophobicContact CE2-CB 4.25Å; F156-L240 HydrophobicContact CE2-CD2 4.04Å; F156-L240 VanDerWaalsContact CE2-O 3.3Å; F156-L240 WeakPolarHBondContact CE2-O 3.4Å; F156-L240 HydrophobicContact CZ-CB 4.06Å; F156-L240 HydrophobicContact CZ-CD2 4.4Å; F156-L240 WeakPolarHBondContact CZ-O 3.15Å; I159-L240 HydrophobicContact CG2-CD2 3.53Å; V163-L240 HydrophobicContact CB-CD1 4.06Å; V163-L240 HydrophobicContact CG1-CD1 4.02Å; V163-L240 HydrophobicContact CG2-CD1 4.24Å; V163-L240 HydrophobicContact CG2-CD2 3.93Å; V163-L240 HydrophobicContact CG2-CG 4.35Å; L176-L240 HydrophobicContact CD1-CG 4.39Å; D236-L240 PolarHBondContact O-N 2.66Å; V237-L240 WeakPolarHBondContact O-CB 3.31Å; V237-L240 PolarHBondContact O-N 3.4Å; W238-L240 VanDerWaalsContact C-N 3.33Å; W238-L240 PolarHBondContact O-N 2.87Å; L240-M243 HydrophobicContact CD2-SD 4.2Å; L240-M243 WeakPolarHBondContact O-CB 3.32Å; L240-M243 PolarHBondContact O-N 2.77Å; L240-L244 WeakPolarHBondContact O-CB 3.49Å; L240-L244 PolarHBondContact O-N 2.83Å; L240-I302 HydrophobicContact CD1-CD1 4.1Å
241	G	98.6	Very high	97.7	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-66.4	-39.7	175.9	0	0	0	0	0	112.9	V237 W238 S239 Y245	V237-G241 PolarHBondContact O-N 2.62Å; V237-G241 VanDerWaalsContact O-N 3.1Å; W238-G241 WeakPolarHBondContact O-CA 3.44Å; W238-G241 PolarHBondContact O-N 3.27Å; S239-G241 VanDerWaalsContact C-N 3.27Å; S239-G241 PolarHBondContact O-N 3.27Å; G241-Y245 WeakPolarHBondContact O-CB 3.34Å; G241-Y245 PolarHBondContact O-N 3.48Å
242	V	98.4	Very high	97.7	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-64	-43.5	172.7	175	0	0	0	0	110.7	A217 Y218 W238 S239 T246 Y252 P253 L289	A217-V242 WeakPolarHBondContact O-CG1 3.35Å; Y218-V242 HydrophobicContact CD1-CB 3.82Å; Y218-V242 HydrophobicContact CD1-CG1 3.47Å; Y218-V242 VanDerWaalsContact CD1-CG1 3.47Å; Y218-V242 HydrophobicContact CE1-CB 4.34Å; Y218-V242 HydrophobicContact CE1-CG1 3.73Å; Y218-V242 HydrophobicContact CG-CG1 4.02Å; W238-V242 PolarHBondContact O-N 2.98Å; S239-V242 WeakPolarHBondContact O-CB 3.24Å; S239-V242 PolarHBondContact O-N 2.68Å; V242-T246 WeakPolarHBondContact O-CB 3.18Å; V242-T246 PolarHBondContact O-N 3Å; V242-T246 PolarHBondContact O-OG1 3.19Å; V242-Y252 HydrophobicContact CG1-CD1 4.02Å; V242-P253 HydrophobicContact CB-CG 4.39Å; V242-P253 HydrophobicContact CG1-CG 4.25Å; V242-P253 HydrophobicContact CG2-CG 4.04Å; V242-L289 HydrophobicContact CG2-CD2 4.13Å
243	M	98.5	Very high	97.7	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-58.9	-52.1	175.1	-70.1	170.5	69.8	0	0	111.7	I159 L176 L178 F181 Y218 S239 L240 Y245 T246 M247	I159-M243 HydrophobicContact CD1-CE 4.04Å; I159-M243 HydrophobicContact CG2-CE 3.56Å; I159-M243 HydrophobicContact CG2-SD 4.48Å; L176-M243 HydrophobicContact CB-SD 4.41Å; L178-M243 HydrophobicContact CD2-CB 3.71Å; L178-M243 HydrophobicContact CD2-CE 3.92Å; L178-M243 HydrophobicContact CD2-CG 3.85Å; L178-M243 HydrophobicContact CG-CB 4.42Å; L178-M243 HydrophobicContact CG-CG 4.18Å; F181-M243 HydrophobicContact CD2-CE 3.38Å; F181-M243 HydrophobicContact CE2-CE 3.43Å; F181-M243 VanDerWaalsContact CE2-CE 3.43Å; F181-M243 HydrophobicContact CE2-SD 4.26Å; F181-M243 HydrophobicContact CG-CE 4.26Å; F181-M243 HydrophobicContact CZ-CE 4.33Å; Y218-M243 HydrophobicContact CD1-CG 4.14Å; Y218-M243 HydrophobicContact CE1-CG 3.63Å; S239-M243 VanDerWaalsContact O-CG 3.31Å; S239-M243 WeakPolarHBondContact O-CG 3.05Å; S239-M243 PolarHBondContact O-N 3.28Å; L240-M243 HydrophobicContact CD2-SD 4.2Å; L240-M243 WeakPolarHBondContact O-CB 3.32Å; L240-M243 PolarHBondContact O-N 2.77Å; M243-Y245 PolarHBondContact O-N 3.25Å; M243-T246 PolarHBondContact O-N 2.82Å; M243-M247 WeakPolarHBondContact O-CG 3.43Å; M243-M247 PolarHBondContact O-N 3.33Å
244	L	98.7	Very high	97.5	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-59.4	-46.3	179.4	176.3	60.6	0	0	0	112.4	F156 L240 T246 M247 L248 L284 I285 I288 W307	F156-L244 HydrophobicContact CB-CD1 4.33Å; F156-L244 HydrophobicContact CD1-CB 4.41Å; F156-L244 HydrophobicContact CD1-CD1 3.86Å; F156-L244 HydrophobicContact CD1-CD2 4.22Å; F156-L244 HydrophobicContact CD1-CG 4.38Å; F156-L244 HydrophobicContact CD2-CB 4.09Å; F156-L244 HydrophobicContact CD2-CD1 4.38Å; F156-L244 HydrophobicContact CE1-CB 4.11Å; F156-L244 HydrophobicContact CE1-CD1 4.28Å; F156-L244 HydrophobicContact CE1-CD2 3.87Å; F156-L244 HydrophobicContact CE1-CG 4.31Å; F156-L244 HydrophobicContact CE2-CB 3.76Å; F156-L244 HydrophobicContact CG-CB 4.41Å; F156-L244 HydrophobicContact CG-CD1 3.93Å; F156-L244 HydrophobicContact CZ-CB 3.78Å; F156-L244 HydrophobicContact CZ-CD2 4.28Å; F156-L244 HydrophobicContact CZ-CG 4.47Å; L240-L244 WeakPolarHBondContact O-CB 3.49Å; L240-L244 PolarHBondContact O-N 2.83Å; L244-T246 VanDerWaalsContact C-N 3.31Å; L244-T246 PolarHBondContact O-N 3.49Å; L244-M247 PolarHBondContact O-N 3.16Å; L244-L248 HydrophobicContact CD1-CD1 3.66Å; L244-L248 HydrophobicContact CD1-CG 4.13Å; L244-L248 HydrophobicContact CG-CD1 4.13Å; L244-L248 WeakPolarHBondContact O-CG 3.25Å; L244-L248 PolarHBondContact O-N 2.95Å; L244-L248 VanDerWaalsContact O-N 3.12Å; L244-L284 HydrophobicContact CD2-CB 4.34Å; L244-L284 HydrophobicContact CD2-CD2 3.67Å; L244-L284 HydrophobicContact CD2-CG 3.73Å; L244-I285 HydrophobicContact CD2-CG1 3.77Å; L244-I285 HydrophobicContact CG-CG1 4.02Å; L244-I288 HydrophobicContact CD2-CD1 4.14Å; L244-W307 HydrophobicContact CD1-CH2 3.55Å; L244-W307 HydrophobicContact CD1-CZ2 4.46Å; L244-W307 HydrophobicContact CD1-CZ3 3.68Å
245	Y	98.6	Very high	97.1	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-59.2	-45.6	176	-176.8	-78.2	0	0	0	110.6	G241 M243 L248 V249 R251 P253 F271 N272 I273 I285	G241-Y245 WeakPolarHBondContact O-CB 3.34Å; G241-Y245 PolarHBondContact O-N 3.48Å; M243-Y245 PolarHBondContact O-N 3.25Å; Y245-L248 PolarHBondContact O-N 3.08Å; Y245-V249 HydrophobicContact CD1-CB 3.96Å; Y245-V249 HydrophobicContact CD1-CG2 4.02Å; Y245-V249 HydrophobicContact CD2-CG2 4.12Å; Y245-V249 HydrophobicContact CE1-CB 3.66Å; Y245-V249 HydrophobicContact CE1-CG1 3.73Å; Y245-V249 HydrophobicContact CE1-CG2 3.85Å; Y245-V249 HydrophobicContact CE2-CG2 3.96Å; Y245-V249 HydrophobicContact CG-CG2 4.16Å; Y245-V249 VanDerWaalsContact O-CB 3.26Å; Y245-V249 WeakPolarHBondContact O-CB 3.17Å; Y245-V249 WeakPolarHBondContact O-CG2 3.37Å; Y245-V249 PolarHBondContact O-N 3.14Å; Y245-R251 VanDerWaalsContact CD1-O 3.27Å; Y245-R251 WeakPolarHBondContact CD1-O 3.35Å; Y245-R251 VanDerWaalsContact CE1-O 3.29Å; Y245-R251 WeakPolarHBondContact CE1-O 3.48Å; Y245-R251 PolarHBondContact OH-NH1 3.25Å; Y245-R251 PolarHBondContact OH-NH2 2.98Å; Y245-R251 VanDerWaalsContact OH-NH2 3.17Å; Y245-P253 HydrophobicContact CD1-CB 3.72Å; Y245-P253 HydrophobicContact CD1-CG 4.09Å; Y245-P253 HydrophobicContact CD2-CB 3.94Å; Y245-P253 VanDerWaalsContact CE1-CA 3.42Å; Y245-P253 HydrophobicContact CE1-CB 3.92Å; Y245-P253 HydrophobicContact CE2-CB 4.13Å; Y245-P253 HydrophobicContact CG-CB 3.73Å; Y245-P253 HydrophobicContact CG-CG 4.13Å; Y245-F271 HydrophobicContact CD2-CD2 4.07Å; Y245-F271 HydrophobicContact CD2-CE2 4.31Å; Y245-F271 AromaticContact CE2-CD2 3.86Å; Y245-F271 HydrophobicContact CE2-CD2 3.86Å; Y245-F271 HydrophobicContact CE2-CE2 4.44Å; Y245-N272 PolarHBondContact OH-O 3.31Å; Y245-I273 HydrophobicContact CE2-CG1 4.35Å; Y245-I285 HydrophobicContact CD2-CG2 4.15Å
246	T	98.3	Very high	96.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-65.8	-41.4	-177.5	-53.3	0	0	0	0	111.7	L178 V242 M243 L244 L248 G250 Y252 V329	L178-T246 HydrophobicContact CD1-CG2 3.79Å; V242-T246 WeakPolarHBondContact O-CB 3.18Å; V242-T246 PolarHBondContact O-N 3Å; V242-T246 PolarHBondContact O-OG1 3.19Å; M243-T246 PolarHBondContact O-N 2.82Å; L244-T246 VanDerWaalsContact C-N 3.31Å; L244-T246 PolarHBondContact O-N 3.49Å; T246-L248 VanDerWaalsContact C-N 3.34Å; T246-L248 PolarHBondContact O-N 3.26Å; T246-G250 WeakPolarHBondContact O-CA 3.41Å; T246-G250 PolarHBondContact O-N 3.3Å; T246-Y252 HydrophobicContact CG2-CD1 4.12Å; T246-Y252 HydrophobicContact CG2-CE1 4.07Å; T246-Y252 VanDerWaalsContact OG1-CD1 3.29Å; T246-Y252 WeakPolarHBondContact OG1-CD1 3.43Å; T246-V329 HydrophobicContact CG2-CG2 3.91Å
247	M	98.6	Very high	96.2	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.5	-41.6	173.3	-71.4	167.8	71.9	0	0	112.5	M137 V141 L147 A152 L155 F156 I159 L178 M243 L244	M137-M247 HydrophobicContact SD-CE 4.14Å; V141-M247 HydrophobicContact CG2-CB 4.43Å; V141-M247 HydrophobicContact CG2-CG 3.92Å; L147-M247 HydrophobicContact CD1-CB 4.33Å; L147-M247 HydrophobicContact CD1-CE 3.86Å; L147-M247 HydrophobicContact CD1-CG 4.41Å; L147-M247 PolarHBondContact N-O 2.99Å; A152-M247 HydrophobicContact CB-CE 4.35Å; L155-M247 HydrophobicContact CB-CE 3.9Å; F156-M247 HydrophobicContact CB-CE 4.15Å; F156-M247 HydrophobicContact CB-SD 4.43Å; F156-M247 HydrophobicContact CD2-SD 4.21Å; I159-M247 HydrophobicContact CD1-CE 4.3Å; I159-M247 HydrophobicContact CD1-SD 4.01Å; L178-M247 HydrophobicContact CD2-CG 3.84Å; L178-M247 HydrophobicContact CD2-SD 4.05Å; M243-M247 WeakPolarHBondContact O-CG 3.43Å; M243-M247 PolarHBondContact O-N 3.33Å; L244-M247 PolarHBondContact O-N 3.16Å
248	L	98.3	Very high	95.7	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.026	12%	0.12	C	C	.	.	H	α-helix	trans	-87.7	-26.5	-174.7	-70.4	178.3	0	0	0	114.9	E149 A152 L244 Y245 T246 L277 A281 I285 W307	E149-L248 HydrophobicContact CB-CD2 4.35Å; E149-L248 HydrophobicContact CG-CD2 3.62Å; A152-L248 HydrophobicContact CB-CD2 3.43Å; A152-L248 VanDerWaalsContact CB-CD2 3.43Å; A152-L248 HydrophobicContact CB-CG 4.21Å; L244-L248 HydrophobicContact CD1-CD1 3.66Å; L244-L248 HydrophobicContact CD1-CG 4.13Å; L244-L248 HydrophobicContact CG-CD1 4.13Å; L244-L248 WeakPolarHBondContact O-CG 3.25Å; L244-L248 PolarHBondContact O-N 2.95Å; L244-L248 VanDerWaalsContact O-N 3.12Å; Y245-L248 PolarHBondContact O-N 3.08Å; T246-L248 VanDerWaalsContact C-N 3.34Å; T246-L248 PolarHBondContact O-N 3.26Å; L248-L277 HydrophobicContact CB-CD1 4.05Å; L248-L277 HydrophobicContact CB-CD2 4.17Å; L248-L277 HydrophobicContact CD1-CD1 4.36Å; L248-A281 HydrophobicContact CD1-CB 4.13Å; L248-I285 HydrophobicContact CD1-CD1 4.17Å; L248-W307 HydrophobicContact CD1-CH2 4.25Å; L248-W307 HydrophobicContact CD1-CZ2 4Å; L248-W307 HydrophobicContact CD2-CZ2 4.26Å
249	V	97.6	Very high	95.1	Very high	21 Å²	21	27.4 Å²	27.4	13%	0.127	14%	0.14	C	C	.	.	H	α-helix	trans	-109.1	-26	-172.7	-176.8	0	0	0	0	112.5	Y245 R251 P274 L277	Y245-V249 HydrophobicContact CD1-CB 3.96Å; Y245-V249 HydrophobicContact CD1-CG2 4.02Å; Y245-V249 HydrophobicContact CD2-CG2 4.12Å; Y245-V249 HydrophobicContact CE1-CB 3.66Å; Y245-V249 HydrophobicContact CE1-CG1 3.73Å; Y245-V249 HydrophobicContact CE1-CG2 3.85Å; Y245-V249 HydrophobicContact CE2-CG2 3.96Å; Y245-V249 HydrophobicContact CG-CG2 4.16Å; Y245-V249 VanDerWaalsContact O-CB 3.26Å; Y245-V249 WeakPolarHBondContact O-CB 3.17Å; Y245-V249 WeakPolarHBondContact O-CG2 3.37Å; Y245-V249 PolarHBondContact O-N 3.14Å; V249-R251 HydrophobicContact CG1-CG 4.07Å; V249-P274 HydrophobicContact CG1-CG 3.83Å; V249-P274 HydrophobicContact CG2-CG 3.97Å; V249-L277 HydrophobicContact CG2-CD1 4.05Å
250	G	95.6	Very high	94.7	Very high	4 Å²	4	30.1 Å²	30.1	4%	0.041	16%	0.159	C	C	.	.	S	Bend	trans	85.9	11.2	178.1	0	0	0	0	0	115.9	K145 T246 V329	K145-G250 WeakPolarHBondContact O-CA 3.34Å; T246-G250 WeakPolarHBondContact O-CA 3.41Å; T246-G250 PolarHBondContact O-N 3.3Å; G250-V329 WeakPolarHBondContact O-CG2 3.35Å; G250-V329 PolarHBondContact O-N 2.66Å
251	R	94.2	Very high	94.3	Very high	59 Å²	59	32 Å²	32	22%	0.223	17%	0.172	C	C	.	.	S	Bend	trans	-158.2	164.1	174.6	55.6	165.5	-176.4	67.6	9.1	109.2	Y245 V249 Q327	Y245-R251 VanDerWaalsContact CD1-O 3.27Å; Y245-R251 WeakPolarHBondContact CD1-O 3.35Å; Y245-R251 VanDerWaalsContact CE1-O 3.29Å; Y245-R251 WeakPolarHBondContact CE1-O 3.48Å; Y245-R251 PolarHBondContact OH-NH1 3.25Å; Y245-R251 PolarHBondContact OH-NH2 2.98Å; Y245-R251 VanDerWaalsContact OH-NH2 3.17Å; V249-R251 HydrophobicContact CG1-CG 4.07Å; R251-Q327 VanDerWaalsContact CB-O 3.29Å; R251-Q327 WeakPolarHBondContact CB-O 3.33Å
252	Y	95.5	Very high	93.9	Very high	18 Å²	18	33 Å²	33	7%	0.071	18%	0.177	C	C	.	.			trans	-66.2	152.4	178.8	-63.1	-60.7	0	0	0	112.8	H138 A217 Y218 V242 T246 F254 P330	H138-Y252 AromaticContact NE2-CZ 3.39Å; H138-Y252 PolarHBondContact NE2-OH 2.93Å; A217-Y252 HydrophobicContact CB-CD1 4.27Å; A217-Y252 HydrophobicContact CB-CD2 4.19Å; A217-Y252 HydrophobicContact CB-CE1 4.17Å; A217-Y252 HydrophobicContact CB-CE2 4.04Å; A217-Y252 HydrophobicContact CB-CG 4.29Å; Y218-Y252 HydrophobicContact CE1-CE1 4.45Å; Y218-Y252 AromaticContact CE2-CE1 3.8Å; Y218-Y252 HydrophobicContact CE2-CE1 3.8Å; Y218-Y252 AromaticContact CZ-CE1 3.69Å; V242-Y252 HydrophobicContact CG1-CD1 4.02Å; T246-Y252 HydrophobicContact CG2-CD1 4.12Å; T246-Y252 HydrophobicContact CG2-CE1 4.07Å; T246-Y252 VanDerWaalsContact OG1-CD1 3.29Å; T246-Y252 WeakPolarHBondContact OG1-CD1 3.43Å; Y252-F254 VanDerWaalsContact C-N 3.31Å; Y252-F254 VanDerWaalsContact CB-O 3.3Å; Y252-F254 WeakPolarHBondContact CB-O 3.37Å; Y252-P330 HydrophobicContact CE2-CG 4.43Å
253	P	96	Very high	93.6	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.058	18%	0.181	C	C	.	.	S	Bend	trans	-69	-31.2	173.6	25.6	-30.5	0	0	0	112.3	V242 Y245 F271 L289	V242-P253 HydrophobicContact CB-CG 4.39Å; V242-P253 HydrophobicContact CG1-CG 4.25Å; V242-P253 HydrophobicContact CG2-CG 4.04Å; Y245-P253 HydrophobicContact CD1-CB 3.72Å; Y245-P253 HydrophobicContact CD1-CG 4.09Å; Y245-P253 HydrophobicContact CD2-CB 3.94Å; Y245-P253 VanDerWaalsContact CE1-CA 3.42Å; Y245-P253 HydrophobicContact CE1-CB 3.92Å; Y245-P253 HydrophobicContact CE2-CB 4.13Å; Y245-P253 HydrophobicContact CG-CB 3.73Å; Y245-P253 HydrophobicContact CG-CG 4.13Å; P253-F271 HydrophobicContact CB-CB 3.96Å; P253-F271 HydrophobicContact CB-CD2 4.2Å; P253-F271 HydrophobicContact CB-CG 4.12Å; P253-F271 WeakPolarHBondContact O-CB 3.38Å; P253-L289 HydrophobicContact CB-CD1 4.35Å; P253-L289 HydrophobicContact CG-CD1 4.3Å
254	F	94.4	Very high	93.2	Very high	5 Å²	5	35.9 Å²	35.9	2%	0.022	20%	0.195	C	C	.	.	S	Bend	trans	-121.1	126.7	173.9	-43.1	-76.9	0	0	0	108.1	W238 Y252 L262 K265 I266 F271	W238-F254 AromaticContact CH2-CE2 3.8Å; W238-F254 HydrophobicContact CH2-CE2 3.8Å; W238-F254 AromaticContact CH2-CZ 3.59Å; W238-F254 HydrophobicContact CH2-CZ 3.59Å; W238-F254 HydrophobicContact CZ2-CD2 4.15Å; W238-F254 AromaticContact CZ2-CE2 3.24Å; W238-F254 HydrophobicContact CZ2-CE2 3.24Å; W238-F254 AromaticContact CZ2-CZ 3.54Å; W238-F254 HydrophobicContact CZ2-CZ 3.54Å; Y252-F254 VanDerWaalsContact C-N 3.31Å; Y252-F254 VanDerWaalsContact CB-O 3.3Å; Y252-F254 WeakPolarHBondContact CB-O 3.37Å; F254-L262 HydrophobicContact CB-CD1 3.94Å; F254-K265 HydrophobicContact CD1-CB 4.32Å; F254-I266 HydrophobicContact CB-CG1 3.75Å; F254-I266 HydrophobicContact CD1-CG1 4.41Å; F254-I266 HydrophobicContact CD2-CG1 3.95Å; F254-I266 HydrophobicContact CG-CG1 3.76Å; F254-F271 HydrophobicContact CD1-CB 4.34Å; F254-F271 HydrophobicContact CE1-CB 3.84Å; F254-F271 AromaticContact CE1-CD1 3.88Å; F254-F271 HydrophobicContact CE1-CD1 3.88Å; F254-F271 HydrophobicContact CE1-CG 4.26Å; F254-F271 HydrophobicContact CZ-CB 4.21Å; F254-F271 AromaticContact CZ-CD1 3.64Å; F254-F271 HydrophobicContact CZ-CD1 3.64Å; F254-F271 HydrophobicContact CZ-CE1 4.42Å; F254-F271 HydrophobicContact CZ-CG 4.2Å
255	H	89	Confident	92.9	Very high	72 Å²	72	39.3 Å²	39.3	33%	0.333	21%	0.21	S	C	.	.			trans	-148.6	149	171.2	71.5	111.7	0	0	0	109	K265 Q327	H255-K265 WeakPolarHBondContact O-CD 3.3Å; H255-K265 PolarHBondContact O-NZ 2.96Å; H255-Q327 PolarHBondContact ND1-OE1 2.92Å
256	D	88.4	Confident	92.7	Very high	54 Å²	54	39.3 Å²	39.3	29%	0.289	21%	0.21	S	C	.	.			trans	-155	169.5	167.8	-149	-66.7	0	0	0	108.4	E258 S261 L262 K265	D256-E258 PolarHBondContact OD1-N 2.71Å; D256-E258 VanDerWaalsContact OD1-N 3.1Å; D256-S261 VanDerWaalsContact CG-CB 3.47Å; D256-S261 WeakPolarHBondContact OD2-CB 3.49Å; D256-L262 HydrophobicContact CB-CB 3.9Å; D256-K265 WeakPolarHBondContact OD2-CE 3.48Å; D256-K265 IonicContact OD2-NZ 3.41Å; D256-K265 PolarHBondContact OD2-NZ 2.59Å
257	I	86.8	Confident	92.4	Very high	160 Å²	160	43.1 Å²	43.1	82%	0.821	22%	0.224	S	C	*	.	S	Bend	trans	-85.3	-33	168.6	-59.6	174.1	0	0	0	109.6
258	E	88.6	Confident	92.1	Very high	96 Å²	96	49.8 Å²	49.8	45%	0.449	25%	0.25	S	C	.	.	S	Bend	trans	-95.6	124.1	179.9	-171.3	-157	177.3	0	0	111.1	D256 S260 S261 L262	D256-E258 PolarHBondContact OD1-N 2.71Å; D256-E258 VanDerWaalsContact OD1-N 3.1Å; E258-S260 VanDerWaalsContact C-N 3.27Å; E258-S260 PolarHBondContact O-N 2.92Å; E258-S260 VanDerWaalsContact OE1-CB 3.31Å; E258-S260 WeakPolarHBondContact OE1-CB 3.33Å; E258-S260 PolarHBondContact OE1-OG 3.01Å; E258-S260 PolarHBondContact OE2-OG 3.1Å; E258-S261 PolarHBondContact O-N 3.37Å; E258-S261 VanDerWaalsContact O-N 3.09Å; E258-S261 WeakPolarHBondContact OE2-CB 3.22Å; E258-S261 PolarHBondContact OE2-OG 3.17Å; E258-L262 PolarHBondContact O-N 3.46Å
259	P	87	Confident	91.8	Very high	62 Å²	62	50.4 Å²	50.4	40%	0.403	26%	0.257	S	S	.	.	H	α-helix	trans	-56	-38	178.3	-27.9	35.5	0	0	0	113.5	S261 L262 F263	P259-S261 VanDerWaalsContact C-N 3.33Å; P259-S261 PolarHBondContact O-N 2.92Å; P259-L262 PolarHBondContact O-N 2.92Å; P259-F263 HydrophobicContact CB-CD2 4.38Å; P259-F263 HydrophobicContact CB-CE2 3.87Å; P259-F263 HydrophobicContact CB-CZ 4.39Å; P259-F263 WeakPolarHBondContact O-CB 3.13Å; P259-F263 WeakPolarHBondContact O-CD2 3.44Å; P259-F263 WeakPolarHBondContact O-CG 3.38Å; P259-F263 PolarHBondContact O-N 3.41Å
260	S	88.7	Confident	91.4	Very high	68 Å²	68	56 Å²	56	48%	0.476	28%	0.282	S	S	.	.	H	α-helix	trans	-60.3	-43.1	177.7	106.7	0	0	0	0	111.7	E258 S264	E258-S260 VanDerWaalsContact C-N 3.27Å; E258-S260 PolarHBondContact O-N 2.92Å; E258-S260 VanDerWaalsContact OE1-CB 3.31Å; E258-S260 WeakPolarHBondContact OE1-CB 3.33Å; E258-S260 PolarHBondContact OE1-OG 3.01Å; E258-S260 PolarHBondContact OE2-OG 3.1Å; S260-S264 VanDerWaalsContact O-CB 3.26Å; S260-S264 WeakPolarHBondContact O-CB 3.33Å; S260-S264 PolarHBondContact O-N 3.46Å
261	S	90.2	Very high	91.3	Very high	39 Å²	39	57.5 Å²	57.5	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-73.3	-36.3	177.7	-72.2	0	0	0	0	112.5	D256 E258 P259 S264 K265	D256-S261 VanDerWaalsContact CG-CB 3.47Å; D256-S261 WeakPolarHBondContact OD2-CB 3.49Å; E258-S261 PolarHBondContact O-N 3.37Å; E258-S261 VanDerWaalsContact O-N 3.09Å; E258-S261 WeakPolarHBondContact OE2-CB 3.22Å; E258-S261 PolarHBondContact OE2-OG 3.17Å; P259-S261 VanDerWaalsContact C-N 3.33Å; P259-S261 PolarHBondContact O-N 2.92Å; S261-S264 PolarHBondContact O-N 2.89Å; S261-K265 WeakPolarHBondContact O-CG 3.13Å; S261-K265 PolarHBondContact O-N 3.28Å
262	L	90.7	Very high	91.3	Very high	22 Å²	22	61.1 Å²	61.1	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-54.7	170.1	173.1	58.7	0	0	0	111.3	P216 F254 D256 E258 P259 S264 K265 I266	P216-L262 HydrophobicContact CB-CD2 4.45Å; F254-L262 HydrophobicContact CB-CD1 3.94Å; D256-L262 HydrophobicContact CB-CB 3.9Å; E258-L262 PolarHBondContact O-N 3.46Å; P259-L262 PolarHBondContact O-N 2.92Å; L262-S264 PolarHBondContact O-N 3.06Å; L262-K265 WeakPolarHBondContact O-CB 3.38Å; L262-K265 PolarHBondContact O-N 3.49Å; L262-I266 HydrophobicContact CD1-CD1 3.97Å; L262-I266 HydrophobicContact CD1-CG1 4.3Å; L262-I266 HydrophobicContact CG-CD1 4.05Å; L262-I266 WeakPolarHBondContact O-CG1 3.41Å; L262-I266 PolarHBondContact O-N 2.99Å
263	F	91.3	Very high	91.3	Very high	18 Å²	18	61.3 Å²	61.3	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-35.3	177.4	-60.5	-38.8	0	0	0	111.3	P216 V219 L224 P259 K265 I266 R267 F342	P216-F263 HydrophobicContact CB-CE1 4.08Å; P216-F263 HydrophobicContact CB-CZ 4.37Å; V219-F263 HydrophobicContact CG1-CE1 4.42Å; L224-F263 HydrophobicContact CD1-CB 4.03Å; L224-F263 HydrophobicContact CD1-CD1 3.79Å; L224-F263 HydrophobicContact CD1-CG 4.24Å; L224-F263 HydrophobicContact CD2-CD1 3.6Å; L224-F263 HydrophobicContact CD2-CE1 3.93Å; L224-F263 HydrophobicContact CD2-CG 4.1Å; L224-F263 HydrophobicContact CG-CD1 4.37Å; P259-F263 HydrophobicContact CB-CD2 4.38Å; P259-F263 HydrophobicContact CB-CE2 3.87Å; P259-F263 HydrophobicContact CB-CZ 4.39Å; P259-F263 WeakPolarHBondContact O-CB 3.13Å; P259-F263 WeakPolarHBondContact O-CD2 3.44Å; P259-F263 WeakPolarHBondContact O-CG 3.38Å; P259-F263 PolarHBondContact O-N 3.41Å; F263-K265 VanDerWaalsContact C-N 3.33Å; F263-K265 PolarHBondContact O-N 2.69Å; F263-I266 HydrophobicContact CD1-CD1 4.44Å; F263-I266 PolarHBondContact O-N 2.99Å; F263-R267 WeakPolarHBondContact O-CB 3.47Å; F263-R267 WeakPolarHBondContact O-CD 3.47Å; F263-R267 WeakPolarHBondContact O-CG 3.22Å; F263-R267 PolarHBondContact O-N 2.78Å; F263-F342 HydrophobicContact CE1-CE2 4.41Å; F263-F342 HydrophobicContact CE1-CZ 4.49Å; F263-F342 HydrophobicContact CZ-CE2 4.06Å
264	S	91.8	Very high	91.2	Very high	42 Å²	42	62.8 Å²	62.8	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-65.3	-32.7	174.5	-160.2	0	0	0	0	113.2	S260 S261 L262 R268	S260-S264 VanDerWaalsContact O-CB 3.26Å; S260-S264 WeakPolarHBondContact O-CB 3.33Å; S260-S264 PolarHBondContact O-N 3.46Å; S261-S264 PolarHBondContact O-N 2.89Å; L262-S264 PolarHBondContact O-N 3.06Å; S264-R268 VanDerWaalsContact O-CG 3.3Å; S264-R268 WeakPolarHBondContact O-CG 3.34Å; S264-R268 PolarHBondContact O-N 2.75Å; S264-R268 PolarHBondContact O-NE 2.8Å; S264-R268 PolarHBondContact OG-NH2 3.26Å
265	K	92.4	Very high	91.2	Very high	72 Å²	72	71.2 Å²	71.2	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-70.6	-46.3	171.8	-72.2	165.1	171.7	171	0	111.6	F254 H255 D256 S261 L262 F263 R268 G269	F254-K265 HydrophobicContact CD1-CB 4.32Å; H255-K265 WeakPolarHBondContact O-CD 3.3Å; H255-K265 PolarHBondContact O-NZ 2.96Å; D256-K265 WeakPolarHBondContact OD2-CE 3.48Å; D256-K265 IonicContact OD2-NZ 3.41Å; D256-K265 PolarHBondContact OD2-NZ 2.59Å; S261-K265 WeakPolarHBondContact O-CG 3.13Å; S261-K265 PolarHBondContact O-N 3.28Å; L262-K265 WeakPolarHBondContact O-CB 3.38Å; L262-K265 PolarHBondContact O-N 3.49Å; F263-K265 VanDerWaalsContact C-N 3.33Å; F263-K265 PolarHBondContact O-N 2.69Å; K265-R268 PolarHBondContact O-N 3.02Å; K265-G269 PolarHBondContact O-N 2.72Å; K265-G269 VanDerWaalsContact O-N 3.16Å
266	I	93.6	Very high	91.4	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-59.4	-50.3	178.1	-65.4	170	0	0	0	110.6	P216 V219 P221 L224 W238 F254 L262 F263 R268 G269	P216-I266 WeakPolarHBondContact O-CD1 3.14Å; V219-I266 HydrophobicContact CG1-CD1 3.93Å; V219-I266 WeakPolarHBondContact O-CG2 3.3Å; P221-I266 HydrophobicContact CG-CG2 4.24Å; L224-I266 HydrophobicContact CD1-CB 3.83Å; L224-I266 HydrophobicContact CD1-CD1 4.36Å; L224-I266 HydrophobicContact CD1-CG2 3.56Å; W238-I266 HydrophobicContact CZ2-CG2 4.04Å; F254-I266 HydrophobicContact CB-CG1 3.75Å; F254-I266 HydrophobicContact CD1-CG1 4.41Å; F254-I266 HydrophobicContact CD2-CG1 3.95Å; F254-I266 HydrophobicContact CG-CG1 3.76Å; L262-I266 HydrophobicContact CD1-CD1 3.97Å; L262-I266 HydrophobicContact CD1-CG1 4.3Å; L262-I266 HydrophobicContact CG-CD1 4.05Å; L262-I266 WeakPolarHBondContact O-CG1 3.41Å; L262-I266 PolarHBondContact O-N 2.99Å; F263-I266 HydrophobicContact CD1-CD1 4.44Å; F263-I266 PolarHBondContact O-N 2.99Å; I266-R268 PolarHBondContact O-N 2.87Å; I266-R268 VanDerWaalsContact O-N 3.14Å; I266-G269 PolarHBondContact O-N 2.78Å
267	R	92.7	Very high	91.7	Very high	80 Å²	80	71.3 Å²	71.3	30%	0.302	37%	0.369	S	S	.	.	H	α-helix	trans	-56.4	-30.9	177.7	-68.5	168	-157.5	-90.2	-0.8	113.7	L224 N225 F263	L224-R267 VanDerWaalsContact C-NH1 3.29Å; L224-R267 HydrophobicContact CB-CG 4.3Å; L224-R267 HydrophobicContact CD1-CG 4.29Å; L224-R267 PolarHBondContact O-NH1 3.35Å; L224-R267 PolarHBondContact O-NH2 3.46Å; N225-R267 WeakPolarHBondContact OD1-CG 3.04Å; N225-R267 PolarHBondContact OD1-NH1 2.98Å; F263-R267 WeakPolarHBondContact O-CB 3.47Å; F263-R267 WeakPolarHBondContact O-CD 3.47Å; F263-R267 WeakPolarHBondContact O-CG 3.22Å; F263-R267 PolarHBondContact O-N 2.78Å
268	R	92.1	Very high	92.2	Very high	140 Å²	140	65.1 Å²	65.1	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-78.4	-24.8	175.5	-73.6	177.4	-118.1	-172.6	-4.3	113	S264 K265 I266 Q270	S264-R268 VanDerWaalsContact O-CG 3.3Å; S264-R268 WeakPolarHBondContact O-CG 3.34Å; S264-R268 PolarHBondContact O-N 2.75Å; S264-R268 PolarHBondContact O-NE 2.8Å; S264-R268 PolarHBondContact OG-NH2 3.26Å; K265-R268 PolarHBondContact O-N 3.02Å; I266-R268 PolarHBondContact O-N 2.87Å; I266-R268 VanDerWaalsContact O-N 3.14Å; R268-Q270 HydrophobicContact CB-CB 4.4Å; R268-Q270 HydrophobicContact CB-CG 4.21Å; R268-Q270 PolarHBondContact O-N 3Å
269	G	90.7	Very high	92.6	Very high	17 Å²	17	65.6 Å²	65.6	18%	0.175	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	23.1	-175.6	0	0	0	0	0	114.1	K265 I266 F271	K265-G269 PolarHBondContact O-N 2.72Å; K265-G269 VanDerWaalsContact O-N 3.16Å; I266-G269 PolarHBondContact O-N 2.78Å; G269-F271 WeakPolarHBondContact O-CD1 3.49Å
270	Q	89	Confident	93.1	Very high	139 Å²	139	66 Å²	66	65%	0.65	35%	0.347	S	S	*	.			trans	-100.4	118.1	-175.5	-71.6	176.8	-11.7	0	0	111	R268	R268-Q270 HydrophobicContact CB-CB 4.4Å; R268-Q270 HydrophobicContact CB-CG 4.21Å; R268-Q270 PolarHBondContact O-N 3Å
271	F	93.6	Very high	93.6	Very high	36 Å²	36	62.8 Å²	62.8	16%	0.158	32%	0.324	C	S	.	.			trans	-148.4	150.7	-179.4	62.2	-83	0	0	0	110.9	Y245 P253 F254 G269 I273 I285 L289	Y245-F271 HydrophobicContact CD2-CD2 4.07Å; Y245-F271 HydrophobicContact CD2-CE2 4.31Å; Y245-F271 AromaticContact CE2-CD2 3.86Å; Y245-F271 HydrophobicContact CE2-CD2 3.86Å; Y245-F271 HydrophobicContact CE2-CE2 4.44Å; P253-F271 HydrophobicContact CB-CB 3.96Å; P253-F271 HydrophobicContact CB-CD2 4.2Å; P253-F271 HydrophobicContact CB-CG 4.12Å; P253-F271 WeakPolarHBondContact O-CB 3.38Å; F254-F271 HydrophobicContact CD1-CB 4.34Å; F254-F271 HydrophobicContact CE1-CB 3.84Å; F254-F271 AromaticContact CE1-CD1 3.88Å; F254-F271 HydrophobicContact CE1-CD1 3.88Å; F254-F271 HydrophobicContact CE1-CG 4.26Å; F254-F271 HydrophobicContact CZ-CB 4.21Å; F254-F271 AromaticContact CZ-CD1 3.64Å; F254-F271 HydrophobicContact CZ-CD1 3.64Å; F254-F271 HydrophobicContact CZ-CE1 4.42Å; F254-F271 HydrophobicContact CZ-CG 4.2Å; G269-F271 WeakPolarHBondContact O-CD1 3.49Å; F271-I273 HydrophobicContact CD2-CG1 3.96Å; F271-I273 HydrophobicContact CE2-CD1 3.8Å; F271-I273 HydrophobicContact CE2-CG1 3.57Å; F271-I285 HydrophobicContact CE2-CG2 3.58Å; F271-I285 HydrophobicContact CZ-CG2 4Å; F271-L289 HydrophobicContact CD1-CD1 4.45Å; F271-L289 HydrophobicContact CD2-CD1 4.42Å; F271-L289 HydrophobicContact CE1-CB 3.65Å; F271-L289 HydrophobicContact CE1-CD1 3.96Å; F271-L289 HydrophobicContact CE1-CG 4.47Å; F271-L289 HydrophobicContact CE2-CD1 3.93Å; F271-L289 HydrophobicContact CZ-CB 3.65Å; F271-L289 HydrophobicContact CZ-CD1 3.68Å; F271-L289 HydrophobicContact CZ-CG 4.3Å
272	N	94.3	Very high	93.9	Very high	134 Å²	134	63 Å²	63	72%	0.717	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-100.5	117.6	-175	-67.7	14.9	0	0	0	110.7	Y245	Y245-N272 PolarHBondContact OH-O 3.31Å
273	I	95.4	Very high	94.3	Very high	23 Å²	23	64.7 Å²	64.7	12%	0.118	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-89.2	126.3	173.3	-49.4	177.6	0	0	0	109.1	Y245 F271 L277 K282 I285 R286	Y245-I273 HydrophobicContact CE2-CG1 4.35Å; F271-I273 HydrophobicContact CD2-CG1 3.96Å; F271-I273 HydrophobicContact CE2-CD1 3.8Å; F271-I273 HydrophobicContact CE2-CG1 3.57Å; I273-L277 HydrophobicContact CG2-CD1 3.83Å; I273-K282 HydrophobicContact CG2-CG 3.79Å; I273-I285 HydrophobicContact CD1-CB 4.03Å; I273-I285 HydrophobicContact CD1-CG2 3.76Å; I273-I285 HydrophobicContact CG1-CG2 4.3Å; I273-I285 HydrophobicContact CG2-CD1 4.32Å; I273-R286 HydrophobicContact CD1-CG 3.72Å
274	P	94.6	Very high	94.6	Very high	39 Å²	39	63.9 Å²	63.9	25%	0.253	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-58	144.5	178.8	-25.3	34.5	0	0	0	113.6	V249 T276 L277 K282	V249-P274 HydrophobicContact CG1-CG 3.83Å; V249-P274 HydrophobicContact CG2-CG 3.97Å; P274-T276 PolarHBondContact O-N 3.01Å; P274-L277 PolarHBondContact O-N 3.43Å; P274-K282 WeakPolarHBondContact O-CE 3.37Å
275	E	93.6	Very high	95	Very high	182 Å²	182	61.9 Å²	61.9	85%	0.85	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-19.2	177.3	-63.6	-154.1	145.6	0	0	113.4	L277 K282	E275-L277 PolarHBondContact O-N 3.13Å; E275-K282 PolarHBondContact O-NZ 2.94Å
276	T	93.6	Very high	95.2	Very high	113 Å²	113	64.7 Å²	64.7	69%	0.693	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-15	177.7	60.2	0	0	0	0	114.8	P274	P274-T276 PolarHBondContact O-N 3.01Å
277	L	96.1	Very high	95.5	Very high	15 Å²	15	66 Å²	66	8%	0.079	33%	0.333	C	S	.	.	S	Bend	trans	-83.2	151.3	178.3	-63.6	-176.5	0	0	0	112	E149 L248 V249 I273 P274 E275 A281 K282 I285	E149-L277 HydrophobicContact CG-CD2 4.25Å; E149-L277 WeakPolarHBondContact OE1-CA 3.44Å; L248-L277 HydrophobicContact CB-CD1 4.05Å; L248-L277 HydrophobicContact CB-CD2 4.17Å; L248-L277 HydrophobicContact CD1-CD1 4.36Å; V249-L277 HydrophobicContact CG2-CD1 4.05Å; I273-L277 HydrophobicContact CG2-CD1 3.83Å; P274-L277 PolarHBondContact O-N 3.43Å; E275-L277 PolarHBondContact O-N 3.13Å; L277-A281 HydrophobicContact CB-CB 4.34Å; L277-K282 HydrophobicContact CB-CG 4.25Å; L277-K282 WeakPolarHBondContact O-CD 3.38Å; L277-K282 WeakPolarHBondContact O-CE 3.26Å; L277-K282 PolarHBondContact O-NZ 3Å; L277-I285 HydrophobicContact CD1-CD1 4.13Å
278	S	96.9	Very high	95.7	Very high	30 Å²	30	62.1 Å²	62.1	21%	0.21	32%	0.319	C	S	.	.			trans	-61.5	153.2	179	75.2	0	0	0	0	111.9	E149 K280 A281 K282	E149-S278 PolarHBondContact OE1-N 2.76Å; E149-S278 VanDerWaalsContact OE2-CB 3.26Å; E149-S278 WeakPolarHBondContact OE2-CB 3.37Å; E149-S278 PolarHBondContact OE2-OG 3.19Å; S278-K280 PolarHBondContact O-N 2.97Å; S278-A281 PolarHBondContact O-N 3.24Å; S278-A281 WeakPolarHBondContact OG-CB 3.34Å; S278-A281 PolarHBondContact OG-N 3.37Å; S278-K282 WeakPolarHBondContact O-CB 3.33Å; S278-K282 WeakPolarHBondContact O-CG 3.29Å; S278-K282 PolarHBondContact O-N 3.25Å
279	P	96.9	Very high	96	Very high	106 Å²	106	55.8 Å²	55.8	69%	0.688	30%	0.295	S	S	*	.	H	α-helix	trans	-55.2	-32.3	172.2	-26.2	35.5	0	0	0	112.8	C283	P279-C283 WeakPolarHBondContact O-CB 3.3Å; P279-C283 PolarHBondContact O-N 2.59Å
280	K	97.4	Very high	96.3	Very high	72 Å²	72	60 Å²	60	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-71.6	-44.1	178	-70.1	-178.9	169.8	-163.2	0	112.6	S278 C283 L284 H305 P306 W307 S309 T310	S278-K280 PolarHBondContact O-N 2.97Å; K280-C283 WeakPolarHBondContact O-CB 3.45Å; K280-C283 PolarHBondContact O-N 2.88Å; K280-L284 PolarHBondContact O-N 2.72Å; K280-H305 PolarHBondContact O-CE1 3.39Å; K280-P306 WeakPolarHBondContact CD-O 3.26Å; K280-P306 WeakPolarHBondContact CE-O 3.46Å; K280-P306 PolarHBondContact NZ-O 2.7Å; K280-W307 HydrophobicContact CB-CB 4.09Å; K280-W307 HydrophobicContact CB-CG 4.31Å; K280-S309 PolarHBondContact NZ-O 3.48Å; K280-T310 HydrophobicContact CD-CG2 4.13Å; K280-T310 WeakPolarHBondContact CD-OG1 2.89Å; K280-T310 PolarHBondContact NZ-OG1 2.62Å
281	A	97.9	Very high	96.6	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-45.8	172.8	0	0	0	0	0	111.4	E149 L248 L277 S278 C283 L284 I285	E149-A281 WeakPolarHBondContact OE2-CB 3.17Å; L248-A281 HydrophobicContact CD1-CB 4.13Å; L277-A281 HydrophobicContact CB-CB 4.34Å; S278-A281 PolarHBondContact O-N 3.24Å; S278-A281 WeakPolarHBondContact OG-CB 3.34Å; S278-A281 PolarHBondContact OG-N 3.37Å; A281-C283 PolarHBondContact O-N 3.21Å; A281-L284 PolarHBondContact O-N 2.85Å; A281-I285 VanDerWaalsContact O-CG1 3.3Å; A281-I285 WeakPolarHBondContact O-CG1 3.48Å; A281-I285 PolarHBondContact O-N 2.92Å
282	K	98.3	Very high	96.7	Very high	42 Å²	42	62 Å²	62	18%	0.183	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-26.9	173.5	-76.4	165.6	176.7	156.1	0	113.5	I273 P274 E275 L277 S278 R286	I273-K282 HydrophobicContact CG2-CG 3.79Å; P274-K282 WeakPolarHBondContact O-CE 3.37Å; E275-K282 PolarHBondContact O-NZ 2.94Å; L277-K282 HydrophobicContact CB-CG 4.25Å; L277-K282 WeakPolarHBondContact O-CD 3.38Å; L277-K282 WeakPolarHBondContact O-CE 3.26Å; L277-K282 PolarHBondContact O-NZ 3Å; S278-K282 WeakPolarHBondContact O-CB 3.33Å; S278-K282 WeakPolarHBondContact O-CG 3.29Å; S278-K282 PolarHBondContact O-N 3.25Å; K282-R286 WeakPolarHBondContact O-CG 3.4Å; K282-R286 PolarHBondContact O-NH1 3.24Å
283	C	98	Very high	96.8	Very high	59 Å²	59	57.2 Å²	57.2	40%	0.399	29%	0.286	S	S	.	.	H	α-helix	trans	-74.9	-57.6	172.6	-169	0	0	0	0	109.9	P279 K280 A281 I285 R286 S287	P279-C283 WeakPolarHBondContact O-CB 3.3Å; P279-C283 PolarHBondContact O-N 2.59Å; K280-C283 WeakPolarHBondContact O-CB 3.45Å; K280-C283 PolarHBondContact O-N 2.88Å; A281-C283 PolarHBondContact O-N 3.21Å; C283-I285 PolarHBondContact O-N 3.42Å; C283-R286 PolarHBondContact O-N 3.24Å; C283-S287 PolarHBondContact O-N 3.12Å; C283-S287 PolarHBondContact O-OG 2.96Å
284	L	98.6	Very high	96.8	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-54	-49.8	-177.3	-175.2	52.6	0	0	0	112.2	F156 L244 K280 A281 R286 S287 I288 L297 I302 H305 W307	F156-L284 HydrophobicContact CE1-CD2 4.37Å; L244-L284 HydrophobicContact CD2-CB 4.34Å; L244-L284 HydrophobicContact CD2-CD2 3.67Å; L244-L284 HydrophobicContact CD2-CG 3.73Å; K280-L284 PolarHBondContact O-N 2.72Å; A281-L284 PolarHBondContact O-N 2.85Å; L284-R286 VanDerWaalsContact C-N 3.27Å; L284-R286 PolarHBondContact O-N 3.43Å; L284-S287 PolarHBondContact O-N 3.45Å; L284-S287 VanDerWaalsContact O-N 3.08Å; L284-I288 HydrophobicContact CD1-CD1 3.63Å; L284-I288 HydrophobicContact CD1-CG1 3.92Å; L284-I288 HydrophobicContact CG-CD1 3.75Å; L284-I288 HydrophobicContact CG-CG1 4.4Å; L284-I288 WeakPolarHBondContact O-CG1 3.26Å; L284-I288 PolarHBondContact O-N 3.45Å; L284-L297 HydrophobicContact CD1-CD1 4Å; L284-I302 HydrophobicContact CD1-CG2 4.47Å; L284-H305 HydrophobicContact CD1-CB 3.89Å; L284-W307 HydrophobicContact CD2-CB 4.25Å; L284-W307 HydrophobicContact CD2-CD2 4.13Å; L284-W307 HydrophobicContact CD2-CE3 3.45Å; L284-W307 VanDerWaalsContact CD2-CE3 3.45Å; L284-W307 HydrophobicContact CD2-CG 4.49Å; L284-W307 HydrophobicContact CD2-CZ3 4.11Å
285	I	98.5	Very high	96.9	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-57.3	-39.9	179.1	-65	165.7	0	0	0	111.4	L244 Y245 L248 F271 I273 L277 A281 C283 L289	L244-I285 HydrophobicContact CD2-CG1 3.77Å; L244-I285 HydrophobicContact CG-CG1 4.02Å; Y245-I285 HydrophobicContact CD2-CG2 4.15Å; L248-I285 HydrophobicContact CD1-CD1 4.17Å; F271-I285 HydrophobicContact CE2-CG2 3.58Å; F271-I285 HydrophobicContact CZ-CG2 4Å; I273-I285 HydrophobicContact CD1-CB 4.03Å; I273-I285 HydrophobicContact CD1-CG2 3.76Å; I273-I285 HydrophobicContact CG1-CG2 4.3Å; I273-I285 HydrophobicContact CG2-CD1 4.32Å; L277-I285 HydrophobicContact CD1-CD1 4.13Å; A281-I285 VanDerWaalsContact O-CG1 3.3Å; A281-I285 WeakPolarHBondContact O-CG1 3.48Å; A281-I285 PolarHBondContact O-N 2.92Å; C283-I285 PolarHBondContact O-N 3.42Å; I285-L289 HydrophobicContact CG2-CD1 4.02Å; I285-L289 WeakPolarHBondContact O-CB 3.27Å; I285-L289 PolarHBondContact O-N 2.94Å
286	R	98.1	Very high	97.1	Very high	132 Å²	132	56.5 Å²	56.5	50%	0.498	29%	0.289	S	S	.	.	H	α-helix	trans	-78.1	-19.9	179	-72.2	-171.2	-177.5	105.9	-9.3	114.2	I273 K282 C283 L284 R290	I273-R286 HydrophobicContact CD1-CG 3.72Å; K282-R286 WeakPolarHBondContact O-CG 3.4Å; K282-R286 PolarHBondContact O-NH1 3.24Å; C283-R286 PolarHBondContact O-N 3.24Å; L284-R286 VanDerWaalsContact C-N 3.27Å; L284-R286 PolarHBondContact O-N 3.43Å; R286-R290 VanDerWaalsContact O-CD 3.25Å; R286-R290 WeakPolarHBondContact O-CD 3.4Å; R286-R290 WeakPolarHBondContact O-CG 3.29Å; R286-R290 PolarHBondContact O-NE 3.39Å; R286-R290 VanDerWaalsContact O-NE 3.1Å
287	S	98.3	Very high	97.3	Very high	26 Å²	26	52.9 Å²	52.9	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-86.9	-24.8	175.2	-55.3	0	0	0	0	111.9	C283 L284 R296 L297	C283-S287 PolarHBondContact O-N 3.12Å; C283-S287 PolarHBondContact O-OG 2.96Å; L284-S287 PolarHBondContact O-N 3.45Å; L284-S287 VanDerWaalsContact O-N 3.08Å; S287-R296 WeakPolarHBondContact O-CA 3.25Å; S287-L297 PolarHBondContact O-N 3.14Å; S287-L297 VanDerWaalsContact O-N 3.17Å
288	I	98.3	Very high	97.5	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-84.1	-52	171.8	-60	171.5	0	0	0	111.2	F156 V237 L244 L284 R290 R296 I302	F156-I288 HydrophobicContact CE1-CD1 4.22Å; F156-I288 HydrophobicContact CZ-CD1 4.2Å; V237-I288 HydrophobicContact CG1-CG2 3.93Å; V237-I288 WeakPolarHBondContact O-CG2 3.47Å; L244-I288 HydrophobicContact CD2-CD1 4.14Å; L284-I288 HydrophobicContact CD1-CD1 3.63Å; L284-I288 HydrophobicContact CD1-CG1 3.92Å; L284-I288 HydrophobicContact CG-CD1 3.75Å; L284-I288 HydrophobicContact CG-CG1 4.4Å; L284-I288 WeakPolarHBondContact O-CG1 3.26Å; L284-I288 PolarHBondContact O-N 3.45Å; I288-R290 PolarHBondContact O-N 2.83Å; I288-R296 WeakPolarHBondContact O-CG 3.48Å; I288-I302 HydrophobicContact CD1-CD1 3.72Å; I288-I302 HydrophobicContact CD1-CG1 3.93Å; I288-I302 HydrophobicContact CD1-CG2 4.42Å; I288-I302 HydrophobicContact CG1-CD1 3.72Å; I288-I302 HydrophobicContact CG1-CG1 3.84Å; I288-I302 HydrophobicContact CG2-CD1 4.43Å
289	L	97.9	Very high	97.5	Very high	6 Å²	6	54.4 Å²	54.4	3%	0.031	27%	0.274	C	S	.	.	S	Bend	trans	-82.4	45.4	-178.4	-64.2	177.5	0	0	0	112.7	W238 V242 P253 F271 I285	W238-L289 HydrophobicContact CD2-CD2 3.67Å; W238-L289 HydrophobicContact CE3-CB 4.37Å; W238-L289 HydrophobicContact CE3-CD2 3.74Å; W238-L289 HydrophobicContact CG-CD2 4.14Å; W238-L289 HydrophobicContact CH2-CD2 4.44Å; W238-L289 HydrophobicContact CZ2-CD2 4.38Å; W238-L289 HydrophobicContact CZ3-CB 4.18Å; W238-L289 HydrophobicContact CZ3-CD2 4.14Å; W238-L289 WeakPolarHBondContact O-CD2 3.27Å; V242-L289 HydrophobicContact CG2-CD2 4.13Å; P253-L289 HydrophobicContact CB-CD1 4.35Å; P253-L289 HydrophobicContact CG-CD1 4.3Å; F271-L289 HydrophobicContact CD1-CD1 4.45Å; F271-L289 HydrophobicContact CD2-CD1 4.42Å; F271-L289 HydrophobicContact CE1-CB 3.65Å; F271-L289 HydrophobicContact CE1-CD1 3.96Å; F271-L289 HydrophobicContact CE1-CG 4.47Å; F271-L289 HydrophobicContact CE2-CD1 3.93Å; F271-L289 HydrophobicContact CZ-CB 3.65Å; F271-L289 HydrophobicContact CZ-CD1 3.68Å; F271-L289 HydrophobicContact CZ-CG 4.3Å; I285-L289 HydrophobicContact CG2-CD1 4.02Å; I285-L289 WeakPolarHBondContact O-CB 3.27Å; I285-L289 PolarHBondContact O-N 2.94Å
290	R	97.3	Very high	97.6	Very high	105 Å²	105	53 Å²	53	40%	0.396	26%	0.258	S	S	.	.			trans	-73.7	135	166.4	-69.4	-62.5	-170.5	113	1.8	109.8	R286 I288 E292 E295 R296	R286-R290 VanDerWaalsContact O-CD 3.25Å; R286-R290 WeakPolarHBondContact O-CD 3.4Å; R286-R290 WeakPolarHBondContact O-CG 3.29Å; R286-R290 PolarHBondContact O-NE 3.39Å; R286-R290 VanDerWaalsContact O-NE 3.1Å; I288-R290 PolarHBondContact O-N 2.83Å; R290-E292 VanDerWaalsContact C-N 3.33Å; R290-E292 PolarHBondContact O-N 3.21Å; R290-E295 HydrophobicContact CB-CB 3.78Å; R290-E295 WeakPolarHBondContact CD-OE2 3.47Å; R290-E295 HydrophobicContact CG-CB 3.85Å; R290-E295 IonicContact CZ-OE2 3.72Å; R290-E295 IonicContact NE-OE2 2.84Å; R290-E295 IonicContact NH1-OE1 3.56Å; R290-E295 IonicContact NH1-OE2 2.75Å; R290-E295 PolarHBondContact NH1-OE2 3.42Å; R290-R296 HydrophobicContact CB-CG 3.9Å; R290-R296 PolarHBondContact O-NE 3.36Å; R290-R296 PolarHBondContact O-NH2 2.93Å
291	R	94.8	Very high	97.6	Very high	142 Å²	142	54.2 Å²	54.2	54%	0.536	27%	0.265	S	S	.	.	S	Bend	trans	-61.2	-45.7	178.9	-174.2	-167.2	67.7	121	8	110.8	P221 R296	P221-R291 HydrophobicContact CB-CG 4.38Å; P221-R291 HydrophobicContact CG-CG 4.4Å; R291-R296 PolarHBondContact O-NH2 3.16Å
292	E	95.3	Very high	97.6	Very high	77 Å²	77	54.2 Å²	54.2	36%	0.36	27%	0.265	S	S	.	.	S	Bend	trans	-76	121.2	177	176.3	48.4	-131.4	0	0	110.1	R290 S294 E295	R290-E292 VanDerWaalsContact C-N 3.33Å; R290-E292 PolarHBondContact O-N 3.21Å; E292-S294 VanDerWaalsContact C-N 3.25Å; E292-S294 VanDerWaalsContact CG-OG 3.31Å; E292-S294 WeakPolarHBondContact CG-OG 3.29Å; E292-S294 PolarHBondContact O-N 3Å; E292-S294 PolarHBondContact OE1-N 2.26Å; E292-S294 PolarHBondContact OE1-OG 2.69Å; E292-E295 HydrophobicContact CB-CB 4.26Å; E292-E295 HydrophobicContact CB-CG 3.95Å; E292-E295 HydrophobicContact CG-CB 4.46Å; E292-E295 HydrophobicContact CG-CG 3.94Å; E292-E295 PolarHBondContact O-N 3.41Å; E292-E295 VanDerWaalsContact O-N 3.12Å
293	P	96.1	Very high	97.6	Very high	32 Å²	32	53 Å²	53	21%	0.208	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-55.3	-39.2	180	-29.1	36.9	0	0	0	113.5	E222 A234 E295 R296	E222-P293 HydrophobicContact CB-CG 4.11Å; E222-P293 HydrophobicContact CG-CG 3.9Å; A234-P293 HydrophobicContact CB-CB 3.79Å; P293-E295 PolarHBondContact O-N 2.91Å; P293-R296 PolarHBondContact O-N 3.39Å
294	S	96.1	Very high	97.6	Very high	104 Å²	104	55.7 Å²	55.7	73%	0.727	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-73.8	-6.5	-179.2	60.2	0	0	0	0	115	E292	E292-S294 VanDerWaalsContact C-N 3.25Å; E292-S294 VanDerWaalsContact CG-OG 3.31Å; E292-S294 WeakPolarHBondContact CG-OG 3.29Å; E292-S294 PolarHBondContact O-N 3Å; E292-S294 PolarHBondContact OE1-N 2.26Å; E292-S294 PolarHBondContact OE1-OG 2.69Å
295	E	97.2	Very high	97.6	Very high	107 Å²	107	56.8 Å²	56.8	50%	0.5	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-95.6	-5.6	171.2	-69.7	-170.9	166.7	0	0	113.7	R290 E292 P293	R290-E295 HydrophobicContact CB-CB 3.78Å; R290-E295 WeakPolarHBondContact CD-OE2 3.47Å; R290-E295 HydrophobicContact CG-CB 3.85Å; R290-E295 IonicContact CZ-OE2 3.72Å; R290-E295 IonicContact NE-OE2 2.84Å; R290-E295 IonicContact NH1-OE1 3.56Å; R290-E295 IonicContact NH1-OE2 2.75Å; R290-E295 PolarHBondContact NH1-OE2 3.42Å; E292-E295 HydrophobicContact CB-CB 4.26Å; E292-E295 HydrophobicContact CB-CG 3.95Å; E292-E295 HydrophobicContact CG-CB 4.46Å; E292-E295 HydrophobicContact CG-CG 3.94Å; E292-E295 PolarHBondContact O-N 3.41Å; E292-E295 VanDerWaalsContact O-N 3.12Å; P293-E295 PolarHBondContact O-N 2.91Å
296	R	98	Very high	97.5	Very high	19 Å²	19	60.3 Å²	60.3	7%	0.072	30%	0.299	C	S	.	.	S	Bend	trans	-79.8	146.3	-176.4	-58.7	-179.7	-170.9	145.1	15.4	111.3	E222 A234 V237 S287 I288 R290 R291 P293	E222-R296 IonicContact OE1-CZ 2.7Å; E222-R296 IonicContact OE1-NH1 3.52Å; E222-R296 PolarHBondContact OE1-NH1 3.35Å; E222-R296 IonicContact OE1-NH2 3.88Å; E222-R296 IonicContact OE2-CZ 3.67Å; E222-R296 IonicContact OE2-NH1 3.84Å; E222-R296 PolarHBondContact OE2-NH1 3.33Å; E222-R296 IonicContact OE2-NH2 3.89Å; E222-R296 PolarHBondContact OE2-NH2 2.9Å; A234-R296 VanDerWaalsContact C-NH1 3.33Å; A234-R296 PolarHBondContact O-NH1 3.41Å; V237-R296 HydrophobicContact CG1-CB 3.85Å; V237-R296 HydrophobicContact CG1-CG 4.46Å; S287-R296 WeakPolarHBondContact O-CA 3.25Å; I288-R296 WeakPolarHBondContact O-CG 3.48Å; R290-R296 HydrophobicContact CB-CG 3.9Å; R290-R296 PolarHBondContact O-NE 3.36Å; R290-R296 PolarHBondContact O-NH2 2.93Å; R291-R296 PolarHBondContact O-NH2 3.16Å; P293-R296 PolarHBondContact O-N 3.39Å
297	L	98.4	Very high	97.4	Very high	37 Å²	37	54 Å²	54	19%	0.194	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-62.3	135.4	164	-61.1	177.3	0	0	0	110	V237 L284 S287 E301 I302	V237-L297 WeakPolarHBondContact CG1-O 3.3Å; L284-L297 HydrophobicContact CD1-CD1 4Å; S287-L297 PolarHBondContact O-N 3.14Å; S287-L297 VanDerWaalsContact O-N 3.17Å; L297-E301 HydrophobicContact CB-CB 4.13Å; L297-E301 HydrophobicContact CD2-CB 4.16Å; L297-I302 HydrophobicContact CB-CG1 3.93Å; L297-I302 HydrophobicContact CD1-CG1 4.35Å
298	T	98.6	Very high	97.2	Very high	71 Å²	71	54.5 Å²	54.5	44%	0.436	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-63	162.1	166.5	59.3	0	0	0	0	111.6	Q300 E301 I302	T298-Q300 PolarHBondContact O-N 3.08Å; T298-E301 VanDerWaalsContact CB-OE2 3.31Å; T298-E301 WeakPolarHBondContact CB-OE2 3.38Å; T298-E301 WeakPolarHBondContact CG2-OE2 3.3Å; T298-E301 PolarHBondContact N-OE2 3.47Å; T298-E301 PolarHBondContact O-N 2.82Å; T298-E301 VanDerWaalsContact O-N 3.14Å; T298-E301 VanDerWaalsContact OG1-CG 3.28Å; T298-E301 WeakPolarHBondContact OG1-CG 3.3Å; T298-E301 PolarHBondContact OG1-N 2.83Å; T298-E301 PolarHBondContact OG1-OE2 2.93Å; T298-I302 WeakPolarHBondContact O-CG1 3.41Å; T298-I302 PolarHBondContact O-N 2.92Å
299	S	98.1	Very high	96.7	Very high	5 Å²	5	59.4 Å²	59.4	4%	0.035	31%	0.308	C	S	.	.	H	α-helix	trans	-57	-29.5	175.8	48.2	0	0	0	0	113.5	H167	H167-S299 PolarHBondContact ND1-OG 3.2Å
300	Q	97.9	Very high	95.7	Very high	76 Å²	76	60.6 Å²	60.6	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-74.6	-50.5	171.2	178.4	52.1	51.6	0	0	112.1	T298 I302 L303 D304	T298-Q300 PolarHBondContact O-N 3.08Å; Q300-I302 PolarHBondContact O-N 3.37Å; Q300-I302 VanDerWaalsContact O-N 3.12Å; Q300-L303 WeakPolarHBondContact O-CB 3.49Å; Q300-L303 PolarHBondContact O-N 2.99Å; Q300-D304 PolarHBondContact NE2-OD2 2.82Å; Q300-D304 PolarHBondContact O-N 3.03Å
301	E	98.4	Very high	94.4	Very high	98 Å²	98	62.6 Å²	62.6	46%	0.458	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-23.3	179.3	-69.6	164.2	120.1	0	0	113.4	L297 T298 H305	L297-E301 HydrophobicContact CB-CB 4.13Å; L297-E301 HydrophobicContact CD2-CB 4.16Å; T298-E301 VanDerWaalsContact CB-OE2 3.31Å; T298-E301 WeakPolarHBondContact CB-OE2 3.38Å; T298-E301 WeakPolarHBondContact CG2-OE2 3.3Å; T298-E301 PolarHBondContact N-OE2 3.47Å; T298-E301 PolarHBondContact O-N 2.82Å; T298-E301 VanDerWaalsContact O-N 3.14Å; T298-E301 VanDerWaalsContact OG1-CG 3.28Å; T298-E301 WeakPolarHBondContact OG1-CG 3.3Å; T298-E301 PolarHBondContact OG1-N 2.83Å; T298-E301 PolarHBondContact OG1-OE2 2.93Å; E301-H305 PolarHBondContact O-N 3.29Å
302	I	98.6	Very high	93.1	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.5	-46.7	168.1	-73.3	171.1	0	0	0	110.6	F156 A160 V237 L240 L284 I288 L297 T298 Q300 D304 H305 F308	F156-I302 HydrophobicContact CE1-CG2 3.97Å; A160-I302 HydrophobicContact CB-CG2 3.83Å; V237-I302 HydrophobicContact CG1-CD1 4.45Å; L240-I302 HydrophobicContact CD1-CD1 4.1Å; L284-I302 HydrophobicContact CD1-CG2 4.47Å; I288-I302 HydrophobicContact CD1-CD1 3.72Å; I288-I302 HydrophobicContact CD1-CG1 3.93Å; I288-I302 HydrophobicContact CD1-CG2 4.42Å; I288-I302 HydrophobicContact CG1-CD1 3.72Å; I288-I302 HydrophobicContact CG1-CG1 3.84Å; I288-I302 HydrophobicContact CG2-CD1 4.43Å; L297-I302 HydrophobicContact CB-CG1 3.93Å; L297-I302 HydrophobicContact CD1-CG1 4.35Å; T298-I302 WeakPolarHBondContact O-CG1 3.41Å; T298-I302 PolarHBondContact O-N 2.92Å; Q300-I302 PolarHBondContact O-N 3.37Å; Q300-I302 VanDerWaalsContact O-N 3.12Å; I302-D304 VanDerWaalsContact C-N 3.3Å; I302-D304 PolarHBondContact O-N 2.97Å; I302-H305 WeakPolarHBondContact O-CB 3.4Å; I302-H305 PolarHBondContact O-N 2.85Å; I302-H305 VanDerWaalsContact O-N 3.1Å; I302-F308 HydrophobicContact CG2-CE2 4.24Å; I302-F308 WeakPolarHBondContact O-CE2 3.41Å
303	L	97.9	Very high	90.9	Very high	17 Å²	17	61.8 Å²	61.8	9%	0.089	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-35.8	-177.4	-63.1	170.8	0	0	0	112.4	Y157 A160 A164 Q300 H305 F308	Y157-L303 HydrophobicContact CD1-CD2 4.39Å; Y157-L303 HydrophobicContact CD2-CD2 3.83Å; Y157-L303 HydrophobicContact CE1-CD2 4.26Å; Y157-L303 HydrophobicContact CE2-CB 4.09Å; Y157-L303 HydrophobicContact CE2-CD2 3.71Å; Y157-L303 HydrophobicContact CG-CD2 4.18Å; A160-L303 HydrophobicContact CB-CD2 3.72Å; A160-L303 HydrophobicContact CB-CG 4.4Å; A164-L303 HydrophobicContact CB-CD1 3.91Å; Q300-L303 WeakPolarHBondContact O-CB 3.49Å; Q300-L303 PolarHBondContact O-N 2.99Å; L303-H305 PolarHBondContact O-N 3.46Å; L303-F308 WeakPolarHBondContact O-CD2 3.47Å
304	D	97.2	Very high	88.6	Confident	115 Å²	115	66.7 Å²	66.7	62%	0.615	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.3	178	-61.6	-57.2	0	0	0	113.1	Q300 I302	Q300-D304 PolarHBondContact NE2-OD2 2.82Å; Q300-D304 PolarHBondContact O-N 3.03Å; I302-D304 VanDerWaalsContact C-N 3.3Å; I302-D304 PolarHBondContact O-N 2.97Å
305	H	98	Very high	86.1	Confident	23 Å²	23	66.1 Å²	66.1	11%	0.106	37%	0.366	C	S	.	.	S	Bend	trans	-69.9	132	-175.3	-175.5	-95.1	0	0	0	112.8	K280 L284 E301 I302 L303 W307 F308	K280-H305 PolarHBondContact O-CE1 3.39Å; L284-H305 HydrophobicContact CD1-CB 3.89Å; E301-H305 PolarHBondContact O-N 3.29Å; I302-H305 WeakPolarHBondContact O-CB 3.4Å; I302-H305 PolarHBondContact O-N 2.85Å; I302-H305 VanDerWaalsContact O-N 3.1Å; L303-H305 PolarHBondContact O-N 3.46Å; H305-W307 WeakPolarHBondContact ND1-CB 3.31Å; H305-W307 PolarHBondContact ND1-N 3.22Å; H305-W307 PolarHBondContact O-N 2.91Å; H305-F308 PolarHBondContact O-N 3.24Å
306	P	96.1	Very high	83.7	Confident	74 Å²	74	69.1 Å²	69.1	48%	0.481	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-1.7	-174.6	-28.7	35.8	0	0	0	118.1	K280 T310	K280-P306 WeakPolarHBondContact CD-O 3.26Å; K280-P306 WeakPolarHBondContact CE-O 3.46Å; K280-P306 PolarHBondContact NZ-O 2.7Å; P306-T310 PolarHBondContact O-OG1 3.33Å
307	W	97.1	Very high	81	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-38.3	171.6	-177.7	59.2	0	0	0	112.3	E149 A152 A153 F156 L244 L248 K280 L284 H305 S309 T310 F312	E149-W307 HydrophobicContact CB-CZ2 4.26Å; E149-W307 HydrophobicContact CG-CZ2 4.2Å; E149-W307 PolarHBondContact OE2-NE1 3.34Å; A152-W307 HydrophobicContact CB-CH2 4.22Å; A153-W307 VanDerWaalsContact CA-CH2 3.48Å; A153-W307 HydrophobicContact CB-CD2 4.46Å; A153-W307 HydrophobicContact CB-CE3 4.24Å; A153-W307 HydrophobicContact CB-CH2 3.75Å; A153-W307 HydrophobicContact CB-CZ2 3.94Å; A153-W307 HydrophobicContact CB-CZ3 3.9Å; F156-W307 HydrophobicContact CB-CZ3 4.41Å; F156-W307 HydrophobicContact CD1-CZ3 4.12Å; L244-W307 HydrophobicContact CD1-CH2 3.55Å; L244-W307 HydrophobicContact CD1-CZ2 4.46Å; L244-W307 HydrophobicContact CD1-CZ3 3.68Å; L248-W307 HydrophobicContact CD1-CH2 4.25Å; L248-W307 HydrophobicContact CD1-CZ2 4Å; L248-W307 HydrophobicContact CD2-CZ2 4.26Å; K280-W307 HydrophobicContact CB-CB 4.09Å; K280-W307 HydrophobicContact CB-CG 4.31Å; L284-W307 HydrophobicContact CD2-CB 4.25Å; L284-W307 HydrophobicContact CD2-CD2 4.13Å; L284-W307 HydrophobicContact CD2-CE3 3.45Å; L284-W307 VanDerWaalsContact CD2-CE3 3.45Å; L284-W307 HydrophobicContact CD2-CG 4.49Å; L284-W307 HydrophobicContact CD2-CZ3 4.11Å; H305-W307 WeakPolarHBondContact ND1-CB 3.31Å; H305-W307 PolarHBondContact ND1-N 3.22Å; H305-W307 PolarHBondContact O-N 2.91Å; W307-S309 VanDerWaalsContact C-N 3.33Å; W307-S309 PolarHBondContact O-N 2.91Å; W307-T310 VanDerWaalsContact O-CB 3.31Å; W307-T310 WeakPolarHBondContact O-CB 3.14Å; W307-T310 PolarHBondContact O-OG1 3.18Å; W307-F312 AromaticContact NE1-CE1 3.83Å
308	F	94.9	Very high	78.5	Confident	36 Å²	36	74.2 Å²	74.2	16%	0.158	44%	0.437	C	S	.	.	S	Bend	trans	-68.4	-33.6	177.6	-62.8	-59.8	0	0	0	112.3	A153 F156 Y157 I302 L303 H305 T310	A153-F308 HydrophobicContact CB-CD1 4.11Å; A153-F308 HydrophobicContact CB-CE1 4.48Å; A153-F308 WeakPolarHBondContact O-CE1 3Å; F156-F308 HydrophobicContact CD1-CE1 4.18Å; F156-F308 AromaticContact CD1-CZ 3.73Å; F156-F308 HydrophobicContact CD1-CZ 3.73Å; F156-F308 HydrophobicContact CE1-CZ 4.34Å; Y157-F308 HydrophobicContact CD2-CB 4.19Å; Y157-F308 AromaticContact CD2-CD1 3.91Å; Y157-F308 HydrophobicContact CD2-CD1 3.91Å; Y157-F308 AromaticContact CD2-CD2 3.7Å; Y157-F308 HydrophobicContact CD2-CD2 3.7Å; Y157-F308 HydrophobicContact CD2-CE1 4.13Å; Y157-F308 AromaticContact CD2-CE2 3.89Å; Y157-F308 HydrophobicContact CD2-CE2 3.89Å; Y157-F308 AromaticContact CD2-CG 3.68Å; Y157-F308 HydrophobicContact CD2-CG 3.68Å; Y157-F308 HydrophobicContact CD2-CZ 4.1Å; Y157-F308 HydrophobicContact CE2-CD2 4.29Å; Y157-F308 HydrophobicContact CE2-CG 4.47Å; Y157-F308 HydrophobicContact CG-CD1 4.41Å; Y157-F308 HydrophobicContact CG-CE1 4.41Å; I302-F308 HydrophobicContact CG2-CE2 4.24Å; I302-F308 WeakPolarHBondContact O-CE2 3.41Å; L303-F308 WeakPolarHBondContact O-CD2 3.47Å; H305-F308 PolarHBondContact O-N 3.24Å; F308-T310 PolarHBondContact O-N 2.84Å; F308-T310 VanDerWaalsContact O-N 3.1Å
309	S	86	Confident	75.6	Confident	103 Å²	103	81.8 Å²	81.8	72%	0.72	46%	0.46	S	S	*	.	S	Bend	trans	-84.1	56.9	171.8	-46.8	0	0	0	0	112	K280 W307	K280-S309 PolarHBondContact NZ-O 3.48Å; W307-S309 VanDerWaalsContact C-N 3.33Å; W307-S309 PolarHBondContact O-N 2.91Å
310	T	77.3	Confident	73.1	Confident	31 Å²	31	85.4 Å²	85.4	19%	0.19	50%	0.497	C	S	.	.			trans	-123.5	124.4	178.5	-51.5	0	0	0	0	111.3	K280 P306 W307 F308 F312	K280-T310 HydrophobicContact CD-CG2 4.13Å; K280-T310 WeakPolarHBondContact CD-OG1 2.89Å; K280-T310 PolarHBondContact NZ-OG1 2.62Å; P306-T310 PolarHBondContact O-OG1 3.33Å; W307-T310 VanDerWaalsContact O-CB 3.31Å; W307-T310 WeakPolarHBondContact O-CB 3.14Å; W307-T310 PolarHBondContact O-OG1 3.18Å; F308-T310 PolarHBondContact O-N 2.84Å; F308-T310 VanDerWaalsContact O-N 3.1Å; T310-F312 HydrophobicContact CG2-CD1 4.22Å; T310-F312 HydrophobicContact CG2-CE1 4.15Å; T310-F312 HydrophobicContact CG2-CZ 4.43Å; T310-F312 WeakPolarHBondContact O-CD2 3.43Å; T310-F312 VanDerWaalsContact O-CE2 3.24Å; T310-F312 WeakPolarHBondContact O-CE2 3.29Å; T310-F312 PolarHBondContact O-N 2.91Å; T310-F312 VanDerWaalsContact O-N 3.13Å
311	D	70.3	Confident	70.4	Confident	147 Å²	147	86.5 Å²	86.5	79%	0.786	52%	0.52	S	S	*	.			trans	-69.1	103.8	159.8	-63.1	-59.4	0	0	0	108.3	N313	D311-N313 PolarHBondContact O-N 3.43Å
312	F	68.3	Low	67.7	Low	62 Å²	62	91.1 Å²	91.1	27%	0.272	54%	0.538	S	S	.	.			trans	-72.3	8.8	-179.2	-65.8	-80.9	0	0	0	113.8	E149 E150 A153 W307 T310 V314	E149-F312 HydrophobicContact CB-CD1 3.91Å; E149-F312 HydrophobicContact CB-CE1 3.71Å; E150-F312 HydrophobicContact CB-CB 3.79Å; E150-F312 HydrophobicContact CB-CD1 4.33Å; E150-F312 HydrophobicContact CB-CD2 3.72Å; E150-F312 HydrophobicContact CB-CE2 4.4Å; E150-F312 HydrophobicContact CB-CG 3.67Å; E150-F312 HydrophobicContact CG-CB 4.09Å; E150-F312 HydrophobicContact CG-CD2 3.7Å; E150-F312 HydrophobicContact CG-CE2 4.45Å; E150-F312 HydrophobicContact CG-CG 4.07Å; A153-F312 HydrophobicContact CB-CE2 3.98Å; A153-F312 HydrophobicContact CB-CZ 3.67Å; W307-F312 AromaticContact NE1-CE1 3.83Å; T310-F312 HydrophobicContact CG2-CD1 4.22Å; T310-F312 HydrophobicContact CG2-CE1 4.15Å; T310-F312 HydrophobicContact CG2-CZ 4.43Å; T310-F312 WeakPolarHBondContact O-CD2 3.43Å; T310-F312 VanDerWaalsContact O-CE2 3.24Å; T310-F312 WeakPolarHBondContact O-CE2 3.29Å; T310-F312 PolarHBondContact O-N 2.91Å; T310-F312 VanDerWaalsContact O-N 3.13Å; F312-V314 PolarHBondContact O-N 3.17Å
313	N	48.5	Very low	64.8	Low	141 Å²	141	100.6 Å²	100.6	75%	0.754	58%	0.582	S	S	*	*			trans	-82.1	103	172.2	-72.8	-54.4	0	0	0	110.9	D311	D311-N313 PolarHBondContact O-N 3.43Å
314	V	47.2	Very low	62.2	Low	134 Å²	134	105 Å²	105	81%	0.812	61%	0.61	S	S	*	*			trans	166.2	150.9	133.1	152.3	0	0	0	0	112.1	F312	F312-V314 PolarHBondContact O-N 3.17Å
315	S	44.3	Very low	59.5	Low	93 Å²	93	105.3 Å²	105.3	65%	0.65	62%	0.621	S	S	*	*			trans	61.6	86.8	167.1	58.1	0	0	0	0	117.6	S317	S315-S317 PolarHBondContact O-N 2.78Å
316	N	47	Very low	56.9	Low	169 Å²	169	110 Å²	110	90%	0.904	65%	0.647	S	S	*	*			trans	-65.7	120.2	146.8	-166.7	18.7	0	0	0	107.9
317	S	40.4	Very low	54.6	Low	97 Å²	97	110.9 Å²	110.9	68%	0.678	64%	0.644	S	S	*	*			trans	-141.7	96.1	176.7	-71.8	0	0	0	0	109.5	S315	S315-S317 PolarHBondContact O-N 2.78Å
318	G	45.9	Very low	52.8	Low	66 Å²	66	114.8 Å²	114.8	68%	0.68	67%	0.665	S	S	*	*			trans	-85.5	134	-172.5	0	0	0	0	0	113.2
319	Y	39	Very low	51.2	Low	231 Å²	231	113.4 Å²	113.4	91%	0.906	66%	0.659	S	S	*	*			trans	-127.7	143	155.2	-78.8	-78.2	0	0	0	108.7	A321	Y319-A321 PolarHBondContact O-N 2.82Å
320	G	45.3	Very low	49.7	Very low	80 Å²	80	110.1 Å²	110.1	83%	0.825	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-66.9	126.7	-168	0	0	0	0	0	113.1
321	A	40.6	Very low	48.3	Very low	100 Å²	100	114.6 Å²	114.6	83%	0.826	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-69.9	132.7	167	0	0	0	0	0	109.7	Y319	Y319-A321 PolarHBondContact O-N 2.82Å
322	K	41.1	Very low	47.2	Very low	195 Å²	195	111.5 Å²	111.5	85%	0.848	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-75.7	136.1	156.7	-73.6	-176.5	175.4	-178.5	0	107.7	V324	K322-V324 PolarHBondContact O-N 3.33Å
323	E	39.6	Very low	46.3	Very low	199 Å²	199	111.2 Å²	111.2	93%	0.93	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-61.5	119.8	170.2	-65.3	-178.7	147.6	0	0	109.3
324	V	43.3	Very low	46.5	Very low	110 Å²	110	107.9 Å²	107.9	67%	0.667	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-101.1	149.3	157.1	-178.3	0	0	0	0	105.1	K322 D326	K322-V324 PolarHBondContact O-N 3.33Å; V324-D326 PolarHBondContact O-N 2.65Å
325	S	39.9	Very low	46.5	Very low	120 Å²	120	104.8 Å²	104.8	84%	0.839	60%	0.603	S	S	*	*			trans	-62.6	96.4	-179.6	54.1	0	0	0	0	111	Q327	S325-Q327 PolarHBondContact O-N 2.75Å
326	D	42.3	Very low	46.6	Very low	122 Å²	122	107.7 Å²	107.7	65%	0.652	61%	0.606	S	S	*	*			trans	-72.4	107.1	-170.6	-84.7	-35.2	0	0	0	112.2	V324 L328	V324-D326 PolarHBondContact O-N 2.65Å; D326-L328 PolarHBondContact O-N 3.29Å; D326-L328 VanDerWaalsContact O-N 3.16Å
327	Q	49	Very low	46.4	Very low	92 Å²	92	106 Å²	106	43%	0.43	60%	0.597	S	S	.	*			trans	-80	90	161.7	-166.4	173.4	12.6	0	0	108.7	R251 H255 S325	R251-Q327 VanDerWaalsContact CB-O 3.29Å; R251-Q327 WeakPolarHBondContact CB-O 3.33Å; H255-Q327 PolarHBondContact ND1-OE1 2.92Å; S325-Q327 PolarHBondContact O-N 2.75Å
328	L	59.7	Low	46.6	Very low	83 Å²	83	105.2 Å²	105.2	44%	0.435	59%	0.585	S	S	.	*			trans	-62.3	169.3	172.1	-64.4	173.4	0	0	0	111.5	D326 P330	D326-L328 PolarHBondContact O-N 3.29Å; D326-L328 VanDerWaalsContact O-N 3.16Å; L328-P330 WeakPolarHBondContact O-CD 3.46Å; L328-P330 VanDerWaalsContact O-N 3.08Å
329	V	59.4	Low	46.8	Very low	6 Å²	6	104.5 Å²	104.5	4%	0.036	57%	0.566	C	S	.	*	S	Bend	trans	-51.2	114.7	170.9	-177.5	0	0	0	0	109.9	H138 V141 R142 T246 G250	H138-V329 VanDerWaalsContact CE1-CG1 3.48Å; H138-V329 WeakPolarHBondContact CE1-CG1 3.47Å; H138-V329 VanDerWaalsContact NE2-CG1 3.25Å; H138-V329 WeakPolarHBondContact NE2-CG1 3.39Å; V141-V329 HydrophobicContact CG1-CG2 4.35Å; R142-V329 HydrophobicContact CB-CB 4.44Å; R142-V329 HydrophobicContact CG-CB 4.42Å; T246-V329 HydrophobicContact CG2-CG2 3.91Å; G250-V329 WeakPolarHBondContact O-CG2 3.35Å; G250-V329 PolarHBondContact O-N 2.66Å
330	P	54.9	Low	47.5	Very low	34 Å²	34	98.9 Å²	98.9	22%	0.221	56%	0.557	C	S	.	*			trans	-71.3	156.8	-168.3	28.1	-35.6	0	0	0	112.9	H138 R142 Y252 L328 V332	H138-P330 PolarHBondContact CE1-O 3.09Å; R142-P330 PolarHBondContact NE-O 2.77Å; R142-P330 PolarHBondContact NH2-O 3.37Å; Y252-P330 HydrophobicContact CE2-CG 4.43Å; L328-P330 WeakPolarHBondContact O-CD 3.46Å; L328-P330 VanDerWaalsContact O-N 3.08Å; P330-V332 VanDerWaalsContact C-N 3.33Å
331	D	47.8	Very low	47.9	Very low	126 Å²	126	98.5 Å²	98.5	67%	0.674	53%	0.533	S	S	*	.			trans	-77.7	-14.8	175.3	-70.1	-59.9	0	0	0	114.2	R142	R142-D331 VanDerWaalsContact CD-OD1 3.3Å; R142-D331 WeakPolarHBondContact CD-OD1 3.49Å; R142-D331 IonicContact CZ-OD1 3.4Å; R142-D331 IonicContact NE-OD1 2.77Å; R142-D331 PolarHBondContact NE-OD1 3.48Å; R142-D331 IonicContact NH1-OD1 3.84Å; R142-D331 PolarHBondContact NH1-OD1 2.88Å
332	V	48.7	Very low	48.6	Very low	81 Å²	81	94.5 Å²	94.5	49%	0.491	50%	0.497	S	S	.	.	S	Bend	trans	-62.5	140	-175.2	-175.2	0	0	0	0	112.5	P330 M334	P330-V332 VanDerWaalsContact C-N 3.33Å; V332-M334 HydrophobicContact CB-SD 3.97Å; V332-M334 HydrophobicContact CG1-SD 3.96Å; V332-M334 PolarHBondContact O-N 3.1Å; V332-M334 VanDerWaalsContact O-N 3.08Å
333	N	49.1	Very low	48.5	Very low	56 Å²	56	93.8 Å²	93.8	30%	0.299	50%	0.503	S	S	.	.			trans	-79.1	84.8	172.2	-156.3	27.1	0	0	0	110.4	R179 E335 E336	R179-N333 PolarHBondContact NH1-OD1 3.09Å; R179-N333 PolarHBondContact NH2-OD1 2.86Å; N333-E335 PolarHBondContact O-N 3.42Å; N333-E336 PolarHBondContact ND2-OE1 3.2Å; N333-E336 PolarHBondContact O-N 2.6Å
334	M	51.6	Low	49	Very low	72 Å²	72	88.5 Å²	88.5	36%	0.355	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	26.9	-173.3	-56.6	-67.1	-59.6	0	0	115.3	V332	V332-M334 HydrophobicContact CB-SD 3.97Å; V332-M334 HydrophobicContact CG1-SD 3.96Å; V332-M334 PolarHBondContact O-N 3.1Å; V332-M334 VanDerWaalsContact O-N 3.08Å
335	E	48.4	Very low	49.3	Very low	68 Å²	68	87.4 Å²	87.4	32%	0.318	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-20.9	-178.2	-74.4	161.6	-157.2	0	0	112	K177 R179 N333	K177-E335 WeakPolarHBondContact CE-OE1 3.44Å; K177-E335 VanDerWaalsContact NZ-CD 3.25Å; K177-E335 IonicContact NZ-OE1 3.66Å; K177-E335 PolarHBondContact NZ-OE1 3.41Å; K177-E335 IonicContact NZ-OE2 2.72Å; R179-E335 IonicContact CZ-OE1 3.36Å; R179-E335 IonicContact NH1-OE1 2.69Å; R179-E335 PolarHBondContact NH1-OE1 2.72Å; R179-E335 IonicContact NH1-OE2 3.16Å; R179-E335 PolarHBondContact NH1-OE2 3.27Å; N333-E335 PolarHBondContact O-N 3.42Å
336	E	46.2	Very low	49.8	Very low	154 Å²	154	85.6 Å²	85.6	72%	0.72	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-32.4	176.6	-72.2	168.1	-130.5	0	0	112.2	N333 L338	N333-E336 PolarHBondContact ND2-OE1 3.2Å; N333-E336 PolarHBondContact O-N 2.6Å; E336-L338 PolarHBondContact O-N 3.16Å
337	D	41.9	Very low	50.3	Low	133 Å²	133	83.4 Å²	83.4	71%	0.711	44%	0.439	S	S	*	.			trans	-92.4	66.4	173.2	-72.4	-49.2	0	0	0	111.5	D339	D337-D339 PolarHBondContact O-N 3.41Å
338	L	44.6	Very low	50.3	Low	82 Å²	82	82.9 Å²	82.9	43%	0.429	44%	0.44	S	S	.	.			trans	-69.2	95.5	164	-78.6	176.3	0	0	0	109.7	E336 F342	E336-L338 PolarHBondContact O-N 3.16Å; L338-F342 HydrophobicContact CD2-CB 4.43Å
339	D	51.6	Low	49.7	Very low	51 Å²	51	82.9 Å²	82.9	27%	0.273	44%	0.44	S	S	.	.			trans	-44.1	133.3	172.5	-156.6	-1.4	0	0	0	110.1	D337 F341 F342	D337-D339 PolarHBondContact O-N 3.41Å; D339-F341 PolarHBondContact O-N 3.2Å; D339-F342 HydrophobicContact CB-CD2 4.23Å; D339-F342 PolarHBondContact O-N 2.83Å
340	P	52.5	Low	49	Very low	112 Å²	112	88.4 Å²	88.4	73%	0.727	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	9.1	-172.7	-26.6	36.1	0	0	0	117.1
341	F	54.4	Low	48.6	Very low	73 Å²	73	92.5 Å²	92.5	32%	0.32	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-14.2	169.9	-166.9	-95.3	0	0	0	113.5	K212 L224 D339	K212-F341 HydrophobicContact CD-CD1 4.23Å; K212-F341 HydrophobicContact CD-CE1 3.94Å; K212-F341 HydrophobicContact CD-CZ 4.45Å; K212-F341 WeakPolarHBondContact CD-O 3.49Å; K212-F341 VanDerWaalsContact NZ-CZ 3.27Å; L224-F341 HydrophobicContact CD2-CE1 4.17Å; D339-F341 PolarHBondContact O-N 3.2Å
342	F	54	Low	48.6	Very low	16 Å²	16	89.8 Å²	89.8	7%	0.07	47%	0.473	C	S	.	.			trans	-118.4	9.6	-174.3	-61.2	-81.2	0	0	0	114.6	K212 P216 V219 L224 F263 L338 D339	K212-F342 HydrophobicContact CB-CD1 4.21Å; P216-F342 HydrophobicContact CG-CE2 4.04Å; V219-F342 HydrophobicContact CG2-CE1 4.1Å; V219-F342 HydrophobicContact CG2-CZ 4.21Å; L224-F342 HydrophobicContact CD2-CZ 4.4Å; F263-F342 HydrophobicContact CE1-CE2 4.41Å; F263-F342 HydrophobicContact CE1-CZ 4.49Å; F263-F342 HydrophobicContact CZ-CE2 4.06Å; L338-F342 HydrophobicContact CD2-CB 4.43Å; D339-F342 HydrophobicContact CB-CD2 4.23Å; D339-F342 PolarHBondContact O-N 2.83Å
343	N	40.5	Very low	48.6	Very low	179 Å²	179	90.5 Å²	90.5	96%	0.957	47%	0.471	S	S	*	.			trans	-110.3	0	172.2	-75.2	-40.9	0	0	0	111

Retrieved 343 of 343 residues in 739.8 ms (Link to these results)

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