A0A087XMF5_POEFO Loading...

Phosphatidylinositol 4-kinase type 2

AlphaFold DB , UniProt , Accession A0A087XMF5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 447 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	35.7	Very low	226 Å²	226	141.5 Å²	141.5	100%	1.113	81%	0.806	S	S	*	*				0	66.8	0	-60	174.9	-177.9	0	0	106.4
2	D	30.8	Very low	35.3	Very low	152 Å²	152	147.5 Å²	147.5	81%	0.813	81%	0.806	S	S	*	*				68.1	107.8	52.6	-58.2	-54.5	0	0	0	112.4
3	E	35.7	Very low	34.8	Very low	182 Å²	182	146.9 Å²	146.9	85%	0.85	80%	0.802	S	S	*	*				-171.6	102.4	120.8	-94.3	-168.1	159.6	0	0	106.8
4	T	37.5	Very low	34.5	Very low	125 Å²	125	144.4 Å²	144.4	77%	0.767	80%	0.8	S	S	*	*				75.3	118.9	88	54.1	0	0	0	0	116.1
5	S	32.2	Very low	34.1	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	80%	0.799	S	S	*	*			trans	-86.6	-152.1	170.3	-37.6	0	0	0	0	110.3
6	P	50.3	Low	33.7	Very low	103 Å²	103	140 Å²	140	67%	0.669	80%	0.797	S	S	*	*			cis	-142.4	-163.8	-17.9	24.5	3.5	0	0	0	114.6
7	L	30.3	Very low	33.4	Very low	156 Å²	156	143.1 Å²	143.1	82%	0.817	80%	0.8	S	S	*	*			trans	78.5	156.3	152.7	-49.4	-174.4	0	0	0	119.7
8	V	31.1	Very low	33	Very low	127 Å²	127	139.6 Å²	139.6	77%	0.77	79%	0.786	S	S	*	*			cis	-165.4	161.1	-16.7	132.6	0	0	0	0	110.3
9	S	34	Very low	32.7	Very low	105 Å²	105	143.1 Å²	143.1	73%	0.734	79%	0.788	S	S	*	*			trans	-84.1	168.6	173.2	-42.1	0	0	0	0	115.4
10	P	45.2	Very low	32.5	Very low	111 Å²	111	142.5 Å²	142.5	72%	0.721	79%	0.788	S	S	*	*				-132.5	145.8	127.9	6.5	16.7	0	0	0	112.7
11	L	31.2	Very low	32.4	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	79%	0.79	S	S	*	*				58.4	145	85.4	-65	164.2	0	0	0	114.8
12	R	30.8	Very low	32.6	Very low	213 Å²	213	138.6 Å²	138.6	80%	0.804	77%	0.771	S	S	*	*			cis	-171.7	-163.4	-23.8	-147.6	-171.5	-169.8	178.9	1.5	107.3
13	D	29.3	Very low	32.4	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	77%	0.772	S	S	*	*			trans	71.9	140.3	166.4	-62	0.4	0	0	0	117
14	S	30.3	Very low	32.2	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	77%	0.769	S	S	*	*			cis	129.8	129.9	-3.3	65.2	0	0	0	0	109.2
15	G	28.6	Very low	32.4	Very low	77 Å²	77	135.1 Å²	135.1	79%	0.794	77%	0.769	S	S	*	*			trans	166.1	121.3	174.9	0	0	0	0	0	113.9
16	D	28.3	Very low	32.2	Very low	142 Å²	142	141.9 Å²	141.9	76%	0.759	78%	0.776	S	S	*	*			trans	-92	-179.8	-175.3	-72.6	-62.8	0	0	0	114.4
17	F	28.7	Very low	31.1	Very low	192 Å²	192	140.6 Å²	140.6	84%	0.842	78%	0.782	S	S	*	*			trans	73.6	148	159.9	-58.7	-71.6	0	0	0	117.7
18	S	26.2	Very low	31	Very low	80 Å²	80	137.3 Å²	137.3	56%	0.559	78%	0.777	S	S	*	*			cis	162.5	154.8	-30.1	53.8	0	0	0	0	107.5
19	Y	27	Very low	30.8	Very low	207 Å²	207	141.5 Å²	141.5	81%	0.812	79%	0.785	S	S	*	*			trans	89.3	129.6	157.5	-77.5	-71.4	0	0	0	123.3
20	T	27.9	Very low	30.5	Very low	130 Å²	130	140 Å²	140	80%	0.798	79%	0.787	S	S	*	*			trans	79.5	124.8	144.5	30.9	0	0	0	0	123.1
21	E	31.9	Very low	29.7	Very low	179 Å²	179	140.4 Å²	140.4	84%	0.836	79%	0.793	S	S	*	*			trans	-63.2	169.5	151	-49.6	-178.3	129.1	0	0	111.2
22	P	36.4	Very low	29.6	Very low	109 Å²	109	139.2 Å²	139.2	71%	0.708	79%	0.792	S	S	*	*				-152	160.5	92.8	38.2	-20.4	0	0	0	118.1
23	N	27.4	Very low	29.6	Very low	157 Å²	157	135.4 Å²	135.4	84%	0.84	79%	0.794	S	S	*	*			trans	68.7	124.7	145	-72.4	-21.7	0	0	0	123.2
24	S	30.8	Very low	29.7	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	80%	0.799	S	S	*	*			trans	-66.4	170.1	157.4	-34.2	0	0	0	0	113.1
25	P	41.8	Very low	29.5	Very low	117 Å²	117	132 Å²	132	76%	0.76	80%	0.795	S	S	*	*				-153.2	146.7	96.7	37.4	-18.9	0	0	0	119.2
26	R	28	Very low	29.4	Very low	257 Å²	257	135 Å²	135	97%	0.97	80%	0.797	S	S	*	*			trans	48.1	130.9	136.8	-64.8	-176.8	170.9	-169.4	-2.7	124
27	G	27.3	Very low	29.3	Very low	76 Å²	76	133.9 Å²	133.9	78%	0.784	80%	0.795	S	S	*	*			trans	136.3	139.3	143.4	0	0	0	0	0	114.2
28	A	28.6	Very low	29.3	Very low	87 Å²	87	135.8 Å²	135.8	72%	0.719	80%	0.797	S	S	*	*			cis	-162.7	161.5	-10.2	0	0	0	0	0	110.7
29	F	28	Very low	29.3	Very low	215 Å²	215	139.8 Å²	139.8	94%	0.943	81%	0.81	S	S	*	*			trans	15.1	137.3	165.2	-54.2	-81.8	0	0	0	120.9
30	G	26.4	Very low	30	Very low	75 Å²	75	135.4 Å²	135.4	77%	0.773	81%	0.807	S	S	*	*			cis	-170.4	-156.3	5.6	0	0	0	0	0	108.7
31	S	28.4	Very low	29.9	Very low	119 Å²	119	134.4 Å²	134.4	83%	0.832	81%	0.812	S	S	*	*			cis	-155.7	-163.9	-2.7	63.8	0	0	0	0	109.3
32	T	28.6	Very low	29.5	Very low	129 Å²	129	129.4 Å²	129.4	79%	0.791	81%	0.809	S	S	*	*			trans	-142.5	162.4	175.2	57.7	0	0	0	0	110.7
33	P	32.4	Very low	29.2	Very low	133 Å²	133	130.3 Å²	130.3	86%	0.864	82%	0.817	S	S	*	*				-144.6	149.9	91.8	36.7	-20.5	0	0	0	115.4
34	G	30.1	Very low	29.5	Very low	81 Å²	81	129 Å²	129	84%	0.835	82%	0.818	S	S	*	*			trans	163.3	48.4	178.3	0	0	0	0	0	114.1
35	S	25.8	Very low	29.4	Very low	100 Å²	100	127.1 Å²	127.1	70%	0.699	82%	0.816	S	S	*	*			trans	-90.5	136.4	-176.7	175.6	0	0	0	0	112.2
36	V	27.2	Very low	28.8	Very low	139 Å²	139	133.1 Å²	133.1	84%	0.842	82%	0.823	S	S	*	*				-149.1	107.2	123.3	-176.1	0	0	0	0	111.3
37	V	26.3	Very low	28.8	Very low	118 Å²	118	126 Å²	126	72%	0.715	81%	0.813	S	S	*	*			trans	22.4	134.2	137.6	-173.7	0	0	0	0	121.9
38	R	28.3	Very low	29	Very low	232 Å²	232	129.9 Å²	129.9	88%	0.875	82%	0.815	S	S	*	*			trans	-87.2	157.5	164.2	-64.3	175.4	175.8	166.5	-2.6	112.9
39	I	27.5	Very low	29.1	Very low	164 Å²	164	133.7 Å²	133.7	84%	0.841	82%	0.818	S	S	*	*			trans	-134.3	136.5	146	-60	-175.1	0	0	0	110.1
40	P	40.5	Very low	29.6	Very low	116 Å²	116	135.1 Å²	135.1	75%	0.753	82%	0.817	S	S	*	*			trans	-111.3	154.3	176.6	39.7	-31.3	0	0	0	114.4
41	A	26	Very low	30	Very low	109 Å²	109	139.6 Å²	139.6	90%	0.901	82%	0.818	S	S	*	*			trans	-170.9	143	152.3	0	0	0	0	0	108.4
42	G	24.8	Very low	30.3	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	82%	0.815	S	S	*	*			cis	-174.6	154.8	-8.5	0	0	0	0	0	109.2
43	S	29.2	Very low	30.6	Very low	127 Å²	127	142 Å²	142	89%	0.888	82%	0.822	S	S	*	*			trans	-108.5	139.3	179.6	-52.2	0	0	0	0	111.8
44	P	34.5	Very low	30.8	Very low	131 Å²	131	143.2 Å²	143.2	85%	0.851	82%	0.82	S	S	*	*				-133.9	156.4	127.4	37.4	-27.6	0	0	0	111
45	G	27.1	Very low	30.9	Very low	71 Å²	71	147.3 Å²	147.3	73%	0.732	82%	0.823	S	S	*	*			cis	171.6	111.6	-4.4	0	0	0	0	0	111.8
46	R	29.5	Very low	31.6	Very low	242 Å²	242	153.7 Å²	153.7	91%	0.913	83%	0.832	S	S	*	*			trans	65.8	135.3	160.3	-72.7	-174	169.2	-172.4	-3.1	122.5
47	S	28.6	Very low	31.9	Very low	109 Å²	109	155.8 Å²	155.8	76%	0.762	83%	0.832	S	S	*	*			trans	79.1	136.8	139.1	53	0	0	0	0	121.6
48	L	30.6	Very low	32.3	Very low	156 Å²	156	162 Å²	162	82%	0.817	84%	0.843	S	S	*	*			trans	88.8	133.9	-176.4	-58.5	164.3	0	0	0	114.4
49	E	31.8	Very low	32.3	Very low	167 Å²	167	154.3 Å²	154.3	78%	0.78	84%	0.836	S	S	*	*			cis	-157	160.1	-25	-160	166.1	-168.3	0	0	107.6	Q51	E49-Q51 PolarHBondContact O-N 2.82Å
50	R	38.2	Very low	32.9	Very low	246 Å²	246	155.8 Å²	155.8	93%	0.928	84%	0.839	S	S	*	*			trans	-76.7	104.7	-176.5	-69	-177.9	178.4	-162.5	0.3	111.9
51	Q	35	Very low	32.5	Very low	169 Å²	169	154.3 Å²	154.3	79%	0.79	84%	0.836	S	S	*	*			trans	-139.7	139.1	159.4	-66.5	-168.9	6.1	0	0	111.4	E49	E49-Q51 PolarHBondContact O-N 2.82Å
52	P	35.2	Very low	33	Very low	120 Å²	120	154.6 Å²	154.6	78%	0.779	83%	0.832	S	S	*	*			trans	-73.7	127.5	174.4	30.3	-32.4	0	0	0	110.1	L54	P52-L54 PolarHBondContact O-N 3.12Å; P52-L54 VanDerWaalsContact O-N 3.09Å
53	L	33.7	Very low	33.9	Very low	177 Å²	177	160.8 Å²	160.8	93%	0.927	83%	0.832	S	S	*	*			trans	-63.9	110.3	172.5	-78.6	159.9	0	0	0	109.4	D55	L53-D55 PolarHBondContact O-N 3.41Å
54	L	37.3	Very low	34.9	Very low	160 Å²	160	159 Å²	159	84%	0.838	81%	0.81	S	S	*	*			trans	-66.6	114.8	168.2	-72.9	167.8	0	0	0	108.3	P52 R56	P52-L54 PolarHBondContact O-N 3.12Å; P52-L54 VanDerWaalsContact O-N 3.09Å; L54-R56 PolarHBondContact O-N 3.04Å
55	D	32	Very low	36	Very low	166 Å²	166	157.2 Å²	157.2	89%	0.888	80%	0.798	S	S	*	*			trans	-72	78.7	178.9	-157.1	12.9	0	0	0	109.9	L53 E57	L53-D55 PolarHBondContact O-N 3.41Å; D55-E57 VanDerWaalsContact C-N 3.29Å; D55-E57 PolarHBondContact O-N 3.26Å; D55-E57 VanDerWaalsContact O-N 3.12Å
56	R	39.5	Very low	37.8	Very low	234 Å²	234	156.5 Å²	156.5	88%	0.883	78%	0.776	S	S	*	*			trans	-88.2	56.1	-168.8	-170.1	-171.8	150.3	165.7	-6.5	111.1	L54	L54-R56 PolarHBondContact O-N 3.04Å
57	E	34	Very low	40	Very low	183 Å²	183	152.7 Å²	152.7	86%	0.855	76%	0.761	S	S	*	*			trans	-161	70.9	164.3	-120.9	167.1	-134.2	0	0	115.2	D55	D55-E57 VanDerWaalsContact C-N 3.29Å; D55-E57 PolarHBondContact O-N 3.26Å; D55-E57 VanDerWaalsContact O-N 3.12Å
58	R	35.1	Very low	42.9	Very low	248 Å²	248	148.5 Å²	148.5	94%	0.936	73%	0.73	S	S	*	*			trans	-136.9	107.3	145.7	-75	-166.4	-170	-163.6	2.1	110.4
59	G	28.9	Very low	45.6	Very low	71 Å²	71	145.6 Å²	145.6	73%	0.732	71%	0.713	S	S	*	*			trans	-68.9	146.1	177.9	0	0	0	0	0	113.2	A61	G59-A61 PolarHBondContact O-N 3.45Å
60	H	39.6	Very low	48.5	Very low	196 Å²	196	138.7 Å²	138.7	91%	0.907	68%	0.68	S	S	*	*	S	Bend	trans	36.3	74.8	152.4	-89.1	-82.7	0	0	0	118.5
61	A	32.3	Very low	51	Low	84 Å²	84	131.7 Å²	131.7	69%	0.694	67%	0.666	S	S	*	*			trans	-148.6	53.3	152.8	0	0	0	0	0	112.8	G59 R63	G59-A61 PolarHBondContact O-N 3.45Å; A61-R63 PolarHBondContact O-N 2.91Å
62	S	35.8	Very low	53.6	Low	116 Å²	116	129.4 Å²	129.4	81%	0.811	66%	0.656	S	S	*	*			trans	-71.1	61.9	158.1	60.8	0	0	0	0	109.8	E64	S62-E64 PolarHBondContact O-N 3.45Å; S62-E64 VanDerWaalsContact O-N 3.13Å
63	R	44.9	Very low	56.4	Low	204 Å²	204	124.3 Å²	124.3	77%	0.77	62%	0.622	S	S	*	*			trans	-61.8	111	168.3	-92.9	-179.6	154.5	164	-5.8	106.9	A61 P65	A61-R63 PolarHBondContact O-N 2.91Å; R63-P65 WeakPolarHBondContact O-CD 3.4Å
64	E	50.2	Low	59.3	Low	90 Å²	90	119.4 Å²	119.4	42%	0.421	60%	0.601	S	S	.	*			trans	-59.2	120.6	169.7	-78.6	-149.4	99.4	0	0	108.9	S62 H66 R67 R216	S62-E64 PolarHBondContact O-N 3.45Å; S62-E64 VanDerWaalsContact O-N 3.13Å; E64-H66 PolarHBondContact O-N 3.08Å; E64-R67 HydrophobicContact CB-CG 4.36Å; E64-R67 PolarHBondContact O-N 2.71Å; E64-R216 IonicContact OE1-CZ 3.47Å; E64-R216 IonicContact OE1-NE 3.27Å; E64-R216 PolarHBondContact OE1-NE 3.11Å; E64-R216 IonicContact OE1-NH2 2.78Å; E64-R216 PolarHBondContact OE1-NH2 2.96Å
65	P	56	Low	62	Low	92 Å²	92	117 Å²	117	60%	0.597	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	19	-169.4	28.4	-34.3	0	0	0	114.5	R63 Y181	R63-P65 WeakPolarHBondContact O-CD 3.4Å; P65-Y181 WeakPolarHBondContact O-CE2 3.4Å; P65-Y181 PolarHBondContact O-OH 3.42Å
66	H	65.8	Low	65.1	Low	57 Å²	57	109 Å²	109	26%	0.264	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	11.1	-177.3	-45.1	-86.3	0	0	0	113.4	E64 Y181 R216	E64-H66 PolarHBondContact O-N 3.08Å; H66-Y181 HydrophobicContact CB-CD1 4.1Å; H66-Y181 HydrophobicContact CB-CD2 4.31Å; H66-Y181 HydrophobicContact CB-CG 3.93Å; H66-Y181 AromaticContact ND1-CD1 3.39Å; H66-Y181 WeakPolarHBondContact ND1-CD1 3.5Å; H66-Y181 AromaticContact ND1-CE1 3.37Å; H66-Y181 WeakPolarHBondContact ND1-CE1 3.45Å; H66-R216 PolarHBondContact CD2-NH1 3.14Å; H66-R216 PolarHBondContact CD2-NH2 3.01Å; H66-R216 PolarHBondContact NE2-NH1 2.78Å
67	R	76	Confident	67.7	Low	162 Å²	162	101.3 Å²	101.3	61%	0.611	51%	0.514	S	S	*	.			trans	-76.8	128.3	174.3	-74.6	-167.5	171.6	-167.1	-5	110.5	E64 E69	E64-R67 HydrophobicContact CB-CG 4.36Å; E64-R67 PolarHBondContact O-N 2.71Å; R67-E69 HydrophobicContact CB-CG 4.07Å; R67-E69 WeakPolarHBondContact CD-OE1 3.41Å; R67-E69 IonicContact CZ-OE1 3.97Å; R67-E69 IonicContact NE-OE1 2.64Å; R67-E69 IonicContact NH1-OE1 3.11Å; R67-E69 PolarHBondContact NH1-OE1 3.22Å; R67-E69 VanDerWaalsContact NH1-OE1 3.11Å; R67-E69 PolarHBondContact O-N 3.42Å
68	N	89.3	Confident	70.7	Confident	20 Å²	20	95.9 Å²	95.9	11%	0.107	49%	0.488	C	S	.	.			trans	-77.9	57.1	175.6	-65.5	-40.2	0	0	0	111	F70 I80 E84 V180 Y181	N68-F70 HydrophobicContact CB-CE2 3.88Å; N68-F70 HydrophobicContact CB-CZ 4.43Å; N68-F70 WeakPolarHBondContact O-CD2 3.36Å; N68-I80 HydrophobicContact CB-CG2 3.8Å; N68-E84 PolarHBondContact ND2-OE1 3.39Å; N68-V180 WeakPolarHBondContact OD1-CG1 3.43Å; N68-Y181 PolarHBondContact ND2-O 2.73Å; N68-Y181 PolarHBondContact OD1-N 2.93Å
69	E	87.8	Confident	73.6	Confident	96 Å²	96	85.3 Å²	85.3	45%	0.449	45%	0.45	S	S	.	.			trans	-87.3	108	178.7	-76.7	173.1	-162.9	0	0	110.4	R67 P71	R67-E69 HydrophobicContact CB-CG 4.07Å; R67-E69 WeakPolarHBondContact CD-OE1 3.41Å; R67-E69 IonicContact CZ-OE1 3.97Å; R67-E69 IonicContact NE-OE1 2.64Å; R67-E69 IonicContact NH1-OE1 3.11Å; R67-E69 PolarHBondContact NH1-OE1 3.22Å; R67-E69 VanDerWaalsContact NH1-OE1 3.11Å; R67-E69 PolarHBondContact O-N 3.42Å; E69-P71 WeakPolarHBondContact O-CD 3.46Å
70	F	92.3	Very high	76.8	Confident	22 Å²	22	82 Å²	82	10%	0.096	42%	0.415	C	S	.	.			trans	-116.8	83	172	-49	-75.6	0	0	0	109.2	N68 E72 D73 F76 R77 I80 K178 V180	N68-F70 HydrophobicContact CB-CE2 3.88Å; N68-F70 HydrophobicContact CB-CZ 4.43Å; N68-F70 WeakPolarHBondContact O-CD2 3.36Å; F70-E72 VanDerWaalsContact C-N 3.27Å; F70-D73 CarbonylContact O-C 3.24Å; F70-F76 AromaticContact CD2-CD1 3.73Å; F70-F76 HydrophobicContact CD2-CD1 3.73Å; F70-F76 HydrophobicContact CD2-CE1 4.09Å; F70-F76 HydrophobicContact CE1-CE1 4.38Å; F70-F76 AromaticContact CE2-CD1 3.87Å; F70-F76 HydrophobicContact CE2-CD1 3.87Å; F70-F76 AromaticContact CE2-CE1 3.73Å; F70-F76 HydrophobicContact CE2-CE1 3.73Å; F70-F76 HydrophobicContact CG-CD1 4.09Å; F70-F76 HydrophobicContact CZ-CD1 4.35Å; F70-F76 AromaticContact CZ-CE1 3.91Å; F70-F76 HydrophobicContact CZ-CE1 3.91Å; F70-R77 HydrophobicContact CB-CB 4.23Å; F70-R77 HydrophobicContact CD2-CB 4.27Å; F70-I80 HydrophobicContact CE2-CG1 4.07Å; F70-K178 HydrophobicContact CD1-CD 3.75Å; F70-K178 HydrophobicContact CE1-CB 4.16Å; F70-K178 HydrophobicContact CE1-CD 3.99Å; F70-K178 HydrophobicContact CG-CD 4.42Å; F70-V180 HydrophobicContact CE2-CG2 4.41Å; F70-V180 HydrophobicContact CZ-CG2 3.96Å
71	P	89.8	Confident	79.5	Confident	98 Å²	98	78.1 Å²	78.1	64%	0.636	39%	0.393	S	S	*	.	S	Bend	trans	-64.2	-32.2	175.8	26.2	-35.1	0	0	0	112.8	E69	E69-P71 WeakPolarHBondContact O-CD 3.46Å
72	E	90.4	Very high	82.6	Confident	122 Å²	122	78.2 Å²	78.2	57%	0.57	38%	0.377	S	S	*	.	S	Bend	trans	-77.7	-15.6	-178.9	77.5	-63.3	157.9	0	0	114.1	F70 K178	F70-E72 VanDerWaalsContact C-N 3.27Å; E72-K178 IonicContact OE1-NZ 2.74Å; E72-K178 PolarHBondContact OE1-NZ 3.27Å
73	D	92.9	Very high	85.5	Confident	13 Å²	13	72.7 Å²	72.7	7%	0.07	34%	0.339	C	S	.	.			trans	-138.9	81.6	177.8	-166.3	-23	0	0	0	110.9	F70 E75 F76 R77 R176 K178	F70-D73 CarbonylContact O-C 3.24Å; D73-E75 PolarHBondContact O-N 3.02Å; D73-E75 PolarHBondContact OD1-N 3.12Å; D73-F76 HydrophobicContact CB-CB 4.02Å; D73-F76 PolarHBondContact O-N 2.88Å; D73-F76 WeakPolarHBondContact OD1-CB 3.18Å; D73-F76 PolarHBondContact OD1-N 3.4Å; D73-F76 WeakPolarHBondContact OD2-CB 3.45Å; D73-R77 WeakPolarHBondContact O-CB 3.29Å; D73-R77 PolarHBondContact O-N 2.88Å; D73-R176 IonicContact OD1-NH1 3.43Å; D73-R176 PolarHBondContact OD1-NH1 3.26Å; D73-R176 VanDerWaalsContact OD1-NH1 3.08Å; D73-R176 VanDerWaalsContact OD2-CD 3.29Å; D73-R176 WeakPolarHBondContact OD2-CD 3.25Å; D73-R176 IonicContact OD2-NH1 2.73Å; D73-K178 IonicContact OD2-NZ 3.03Å
74	P	94.9	Very high	87.8	Confident	74 Å²	74	66 Å²	66	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-28.9	-179.2	-26.4	36.6	0	0	0	114	E78	P74-E78 PolarHBondContact O-N 3.08Å
75	E	94.9	Very high	89.9	Confident	108 Å²	108	67.4 Å²	67.4	51%	0.505	32%	0.318	S	S	.	.	H	α-helix	trans	-75.7	-49.1	-178.6	-170.1	-163.6	162.5	0	0	110.7	D73 R77 E78 I79 R176	D73-E75 PolarHBondContact O-N 3.02Å; D73-E75 PolarHBondContact OD1-N 3.12Å; E75-R77 VanDerWaalsContact C-N 3.27Å; E75-R77 PolarHBondContact O-N 3.12Å; E75-E78 PolarHBondContact O-N 3.26Å; E75-I79 PolarHBondContact O-N 2.87Å; E75-R176 IonicContact OE1-NH2 2.62Å; E75-R176 PolarHBondContact OE1-NH2 3.29Å; E75-R176 IonicContact OE2-CZ 2.6Å; E75-R176 VanDerWaalsContact OE2-CZ 3.23Å; E75-R176 IonicContact OE2-NH1 2.73Å; E75-R176 PolarHBondContact OE2-NH1 2.96Å; E75-R176 IonicContact OE2-NH2 3.95Å; E75-R176 PolarHBondContact OE2-NH2 3.01Å
76	F	95.8	Very high	91.9	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-57.9	-42.3	173.4	-174.3	-86.2	0	0	0	111.1	F70 D73 E78 I79 I80 R176 K178 V180 F226 M228	F70-F76 AromaticContact CD2-CD1 3.73Å; F70-F76 HydrophobicContact CD2-CD1 3.73Å; F70-F76 HydrophobicContact CD2-CE1 4.09Å; F70-F76 HydrophobicContact CE1-CE1 4.38Å; F70-F76 AromaticContact CE2-CD1 3.87Å; F70-F76 HydrophobicContact CE2-CD1 3.87Å; F70-F76 AromaticContact CE2-CE1 3.73Å; F70-F76 HydrophobicContact CE2-CE1 3.73Å; F70-F76 HydrophobicContact CG-CD1 4.09Å; F70-F76 HydrophobicContact CZ-CD1 4.35Å; F70-F76 AromaticContact CZ-CE1 3.91Å; F70-F76 HydrophobicContact CZ-CE1 3.91Å; D73-F76 HydrophobicContact CB-CB 4.02Å; D73-F76 PolarHBondContact O-N 2.88Å; D73-F76 WeakPolarHBondContact OD1-CB 3.18Å; D73-F76 PolarHBondContact OD1-N 3.4Å; D73-F76 WeakPolarHBondContact OD2-CB 3.45Å; F76-E78 VanDerWaalsContact C-N 3.28Å; F76-E78 PolarHBondContact O-N 2.9Å; F76-I79 WeakPolarHBondContact O-CB 3.39Å; F76-I79 PolarHBondContact O-N 3.18Å; F76-I79 VanDerWaalsContact O-N 3.16Å; F76-I80 HydrophobicContact CD1-CD1 4.47Å; F76-I80 HydrophobicContact CD1-CG1 3.9Å; F76-I80 HydrophobicContact CE1-CD1 3.79Å; F76-I80 HydrophobicContact CE1-CG1 3.55Å; F76-I80 HydrophobicContact CZ-CD1 3.93Å; F76-I80 HydrophobicContact CZ-CG1 4.21Å; F76-I80 WeakPolarHBondContact O-CG1 3.28Å; F76-I80 PolarHBondContact O-N 3.48Å; F76-R176 HydrophobicContact CD2-CB 4.26Å; F76-K178 HydrophobicContact CD1-CD 3.93Å; F76-K178 HydrophobicContact CD1-CG 4.4Å; F76-K178 HydrophobicContact CE1-CB 3.72Å; F76-K178 HydrophobicContact CE1-CD 4.01Å; F76-K178 HydrophobicContact CE1-CG 4.07Å; F76-K178 HydrophobicContact CE2-CB 4.33Å; F76-K178 HydrophobicContact CE2-CG 4.26Å; F76-K178 HydrophobicContact CG-CD 4.26Å; F76-K178 HydrophobicContact CZ-CB 3.63Å; F76-K178 HydrophobicContact CZ-CD 4.4Å; F76-K178 HydrophobicContact CZ-CG 3.99Å; F76-V180 HydrophobicContact CE1-CG2 3.86Å; F76-V180 HydrophobicContact CZ-CG2 3.98Å; F76-F226 AromaticContact CE2-CD1 3.91Å; F76-F226 HydrophobicContact CE2-CD1 3.91Å; F76-F226 HydrophobicContact CZ-CB 4.23Å; F76-F226 AromaticContact CZ-CD1 3.77Å; F76-F226 HydrophobicContact CZ-CD1 3.77Å; F76-F226 HydrophobicContact CZ-CG 4.37Å; F76-M228 HydrophobicContact CD2-CG 4.06Å; F76-M228 HydrophobicContact CD2-SD 4.19Å; F76-M228 HydrophobicContact CE2-CG 4.22Å
77	R	95.3	Very high	93.2	Very high	72 Å²	72	61.5 Å²	61.5	27%	0.272	28%	0.283	S	S	.	.	H	α-helix	trans	-56.1	-40.1	173.8	-175.1	179.8	63.4	-155.4	-1.6	112.8	F70 D73 E75 I80 R81	F70-R77 HydrophobicContact CB-CB 4.23Å; F70-R77 HydrophobicContact CD2-CB 4.27Å; D73-R77 WeakPolarHBondContact O-CB 3.29Å; D73-R77 PolarHBondContact O-N 2.88Å; E75-R77 VanDerWaalsContact C-N 3.27Å; E75-R77 PolarHBondContact O-N 3.12Å; R77-I80 PolarHBondContact O-N 2.86Å; R77-R81 WeakPolarHBondContact O-CG 3.48Å; R77-R81 PolarHBondContact O-N 3.33Å
78	E	95.9	Very high	93.9	Very high	68 Å²	68	61.6 Å²	61.6	32%	0.318	29%	0.29	S	S	.	.	H	α-helix	trans	-73.3	-32.4	179.1	-165.5	57.1	-152.5	0	0	112.2	P74 E75 F76 R81 K82	P74-E78 PolarHBondContact O-N 3.08Å; E75-E78 PolarHBondContact O-N 3.26Å; F76-E78 VanDerWaalsContact C-N 3.28Å; F76-E78 PolarHBondContact O-N 2.9Å; E78-R81 PolarHBondContact O-N 3.16Å; E78-R81 WeakPolarHBondContact OE2-CD 3.41Å; E78-R81 IonicContact OE2-CZ 2.61Å; E78-R81 IonicContact OE2-NH1 3.92Å; E78-R81 PolarHBondContact OE2-NH1 3.28Å; E78-K82 WeakPolarHBondContact O-CG 3.45Å; E78-K82 PolarHBondContact O-N 3.38Å
79	I	96.8	Very high	94.1	Very high	26 Å²	26	66 Å²	66	13%	0.133	31%	0.31	C	S	.	.	H	α-helix	trans	-62.6	-43.4	169.3	-63.1	-64	0	0	0	111.2	E75 F76 R81 K82 A83 I114 F226 M228	E75-I79 PolarHBondContact O-N 2.87Å; F76-I79 WeakPolarHBondContact O-CB 3.39Å; F76-I79 PolarHBondContact O-N 3.18Å; F76-I79 VanDerWaalsContact O-N 3.16Å; I79-R81 PolarHBondContact O-N 2.79Å; I79-K82 WeakPolarHBondContact O-CB 3.44Å; I79-K82 PolarHBondContact O-N 3.05Å; I79-A83 PolarHBondContact O-N 2.81Å; I79-A83 VanDerWaalsContact O-N 3.08Å; I79-I114 HydrophobicContact CG2-CB 4.29Å; I79-I114 HydrophobicContact CG2-CD1 4.21Å; I79-F226 HydrophobicContact CG2-CE1 3.83Å; I79-F226 HydrophobicContact CG2-CZ 3.91Å; I79-M228 HydrophobicContact CG1-CE 4.16Å
80	I	96.9	Very high	94.3	Very high	1 Å²	1	63 Å²	63	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-39.3	176.2	-58.2	-48.6	0	0	0	111.7	N68 F70 F76 R77 K82 A83 E84 V180 F226	N68-I80 HydrophobicContact CB-CG2 3.8Å; F70-I80 HydrophobicContact CE2-CG1 4.07Å; F76-I80 HydrophobicContact CD1-CD1 4.47Å; F76-I80 HydrophobicContact CD1-CG1 3.9Å; F76-I80 HydrophobicContact CE1-CD1 3.79Å; F76-I80 HydrophobicContact CE1-CG1 3.55Å; F76-I80 HydrophobicContact CZ-CD1 3.93Å; F76-I80 HydrophobicContact CZ-CG1 4.21Å; F76-I80 WeakPolarHBondContact O-CG1 3.28Å; F76-I80 PolarHBondContact O-N 3.48Å; R77-I80 PolarHBondContact O-N 2.86Å; I80-K82 VanDerWaalsContact C-N 3.32Å; I80-K82 PolarHBondContact O-N 3.24Å; I80-A83 WeakPolarHBondContact O-CB 3.43Å; I80-A83 PolarHBondContact O-N 3.35Å; I80-A83 VanDerWaalsContact O-N 3.13Å; I80-E84 HydrophobicContact CG2-CG 4.3Å; I80-E84 WeakPolarHBondContact O-CG 3.46Å; I80-E84 PolarHBondContact O-N 3.23Å; I80-V180 HydrophobicContact CD1-CG1 4.09Å; I80-V180 HydrophobicContact CD1-CG2 3.94Å; I80-V180 HydrophobicContact CG1-CG1 4.36Å; I80-V180 HydrophobicContact CG1-CG2 4.24Å; I80-V180 HydrophobicContact CG2-CG1 3.91Å; I80-F226 HydrophobicContact CD1-CB 4.2Å; I80-F226 HydrophobicContact CD1-CD1 3.47Å; I80-F226 VanDerWaalsContact CD1-CD1 3.47Å; I80-F226 HydrophobicContact CD1-CD2 3.68Å; I80-F226 HydrophobicContact CD1-CE1 3.62Å; I80-F226 HydrophobicContact CD1-CE2 3.8Å; I80-F226 HydrophobicContact CD1-CG 3.51Å; I80-F226 HydrophobicContact CD1-CZ 3.78Å
81	R	95.3	Very high	94.4	Very high	115 Å²	115	64.5 Å²	64.5	43%	0.434	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-35.1	174	-74.4	166.8	170.2	-178.3	-5.5	113.5	R77 E78 I79 R85	R77-R81 WeakPolarHBondContact O-CG 3.48Å; R77-R81 PolarHBondContact O-N 3.33Å; E78-R81 PolarHBondContact O-N 3.16Å; E78-R81 WeakPolarHBondContact OE2-CD 3.41Å; E78-R81 IonicContact OE2-CZ 2.61Å; E78-R81 IonicContact OE2-NH1 3.92Å; E78-R81 PolarHBondContact OE2-NH1 3.28Å; I79-R81 PolarHBondContact O-N 2.79Å; R81-R85 WeakPolarHBondContact O-CB 3.45Å; R81-R85 PolarHBondContact O-N 3.06Å
82	K	96.6	Very high	94.6	Very high	86 Å²	86	63.8 Å²	63.8	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-40.2	172.3	-72.5	175.5	-178.2	-176.2	0	111.6	E78 I79 I80 A86 D108 I114	E78-K82 WeakPolarHBondContact O-CG 3.45Å; E78-K82 PolarHBondContact O-N 3.38Å; I79-K82 WeakPolarHBondContact O-CB 3.44Å; I79-K82 PolarHBondContact O-N 3.05Å; I80-K82 VanDerWaalsContact C-N 3.32Å; I80-K82 PolarHBondContact O-N 3.24Å; K82-A86 WeakPolarHBondContact O-CB 3.33Å; K82-A86 PolarHBondContact O-N 3.35Å; K82-D108 HydrophobicContact CB-CB 4.28Å; K82-I114 HydrophobicContact CB-CD1 4.09Å
83	A	96.8	Very high	94.9	Very high	0 Å²	0	58 Å²	58	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-45.2	174	0	0	0	0	0	112.6	I79 I80 A86 I87 V106 I114 F226	I79-A83 PolarHBondContact O-N 2.81Å; I79-A83 VanDerWaalsContact O-N 3.08Å; I80-A83 WeakPolarHBondContact O-CB 3.43Å; I80-A83 PolarHBondContact O-N 3.35Å; I80-A83 VanDerWaalsContact O-N 3.13Å; A83-A86 PolarHBondContact O-N 3.32Å; A83-I87 WeakPolarHBondContact O-CD1 3.45Å; A83-I87 VanDerWaalsContact O-CG1 3.31Å; A83-I87 WeakPolarHBondContact O-CG1 3.44Å; A83-I87 PolarHBondContact O-N 3.26Å; A83-I87 VanDerWaalsContact O-N 3.14Å; A83-V106 HydrophobicContact CB-CG1 3.41Å; A83-V106 VanDerWaalsContact CB-CG1 3.41Å; A83-I114 HydrophobicContact CB-CD1 3.92Å; A83-F226 HydrophobicContact CB-CE2 4.38Å
84	E	94.7	Very high	95	Very high	65 Å²	65	62.2 Å²	62.2	30%	0.304	29%	0.291	S	S	.	.	H	α-helix	trans	-60.4	-48.1	177	-71.2	168.9	159.5	0	0	110.9	N68 I80 A86 I87 E88 L182	N68-E84 PolarHBondContact ND2-OE1 3.39Å; I80-E84 HydrophobicContact CG2-CG 4.3Å; I80-E84 WeakPolarHBondContact O-CG 3.46Å; I80-E84 PolarHBondContact O-N 3.23Å; E84-A86 PolarHBondContact O-N 3.05Å; E84-I87 WeakPolarHBondContact O-CB 3.45Å; E84-I87 PolarHBondContact O-N 3.02Å; E84-E88 WeakPolarHBondContact O-CG 3.41Å; E84-E88 PolarHBondContact O-N 3.26Å; E84-L182 HydrophobicContact CG-CD2 4.16Å
85	R	94.6	Very high	94.8	Very high	119 Å²	119	62.1 Å²	62.1	45%	0.449	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-44.5	177.1	-170.6	-174.5	-54.4	167.7	8.9	112.9	R81 I87 E88 E89	R81-R85 WeakPolarHBondContact O-CB 3.45Å; R81-R85 PolarHBondContact O-N 3.06Å; R85-I87 VanDerWaalsContact C-N 3.26Å; R85-I87 PolarHBondContact O-N 3.04Å; R85-E88 WeakPolarHBondContact O-CB 3.29Å; R85-E88 PolarHBondContact O-N 2.86Å; R85-E88 VanDerWaalsContact O-N 3.12Å; R85-E89 WeakPolarHBondContact CD-OE1 3.3Å; R85-E89 HydrophobicContact CG-CG 4.41Å; R85-E89 WeakPolarHBondContact CG-OE1 3.19Å; R85-E89 WeakPolarHBondContact O-CB 3.39Å; R85-E89 WeakPolarHBondContact O-CG 3.41Å; R85-E89 PolarHBondContact O-N 3.25Å
86	A	96.3	Very high	94.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.7	-42.1	177.6	0	0	0	0	0	111.6	K82 A83 E84 E89 G90 I91 K107 D108	K82-A86 WeakPolarHBondContact O-CB 3.33Å; K82-A86 PolarHBondContact O-N 3.35Å; A83-A86 PolarHBondContact O-N 3.32Å; E84-A86 PolarHBondContact O-N 3.05Å; A86-E89 CarbonylContact O-C 3.59Å; A86-E89 PolarHBondContact O-N 3.43Å; A86-G90 PolarHBondContact O-N 3.29Å; A86-G90 VanDerWaalsContact O-N 3.17Å; A86-I91 CarbonylContact C-O 3.57Å; A86-I91 HydrophobicContact CB-CB 4.22Å; A86-I91 CarbonylContact O-C 3.59Å; A86-I91 WeakPolarHBondContact O-CA 3.44Å; A86-I91 WeakPolarHBondContact O-CB 3.39Å; A86-I91 PolarHBondContact O-N 3.31Å; A86-K107 VanDerWaalsContact CB-O 3.28Å; A86-K107 WeakPolarHBondContact CB-O 3.43Å; A86-D108 VanDerWaalsContact CB-C 3.42Å
87	I	94	Very high	93.5	Very high	25 Å²	25	67 Å²	67	13%	0.128	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-40.9	176.1	-71.3	165.2	0	0	0	111.7	A83 E84 R85 E89 G90 Y92 P93 L182 A183	A83-I87 WeakPolarHBondContact O-CD1 3.45Å; A83-I87 VanDerWaalsContact O-CG1 3.31Å; A83-I87 WeakPolarHBondContact O-CG1 3.44Å; A83-I87 PolarHBondContact O-N 3.26Å; A83-I87 VanDerWaalsContact O-N 3.14Å; E84-I87 WeakPolarHBondContact O-CB 3.45Å; E84-I87 PolarHBondContact O-N 3.02Å; R85-I87 VanDerWaalsContact C-N 3.26Å; R85-I87 PolarHBondContact O-N 3.04Å; I87-E89 VanDerWaalsContact C-N 3.32Å; I87-G90 PolarHBondContact O-N 3.1Å; I87-Y92 HydrophobicContact CG2-CD1 4.34Å; I87-Y92 HydrophobicContact CG2-CE1 4.38Å; I87-Y92 WeakPolarHBondContact O-CE1 3.08Å; I87-P93 HydrophobicContact CD1-CG 4.06Å; I87-P93 HydrophobicContact CG1-CG 4.27Å; I87-L182 HydrophobicContact CD1-CD2 4.49Å; I87-A183 WeakPolarHBondContact CG2-O 3.1Å
88	E	90.3	Very high	92.2	Very high	164 Å²	164	72.3 Å²	72.3	77%	0.766	33%	0.326	S	S	*	.	H	α-helix	trans	-64.1	-36.8	175.2	-70.5	175.8	167.4	0	0	112.1	E84 R85 G90	E84-E88 WeakPolarHBondContact O-CG 3.41Å; E84-E88 PolarHBondContact O-N 3.26Å; R85-E88 WeakPolarHBondContact O-CB 3.29Å; R85-E88 PolarHBondContact O-N 2.86Å; R85-E88 VanDerWaalsContact O-N 3.12Å; E88-G90 PolarHBondContact O-N 3.43Å
89	E	93.1	Very high	90.6	Very high	111 Å²	111	71.3 Å²	71.3	52%	0.519	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-1.6	175.2	-69.2	166.2	173.3	0	0	113.5	R85 A86 I87 S109	R85-E89 WeakPolarHBondContact CD-OE1 3.3Å; R85-E89 HydrophobicContact CG-CG 4.41Å; R85-E89 WeakPolarHBondContact CG-OE1 3.19Å; R85-E89 WeakPolarHBondContact O-CB 3.39Å; R85-E89 WeakPolarHBondContact O-CG 3.41Å; R85-E89 PolarHBondContact O-N 3.25Å; A86-E89 CarbonylContact O-C 3.59Å; A86-E89 PolarHBondContact O-N 3.43Å; I87-E89 VanDerWaalsContact C-N 3.32Å; E89-S109 WeakPolarHBondContact OE2-CB 3.34Å; E89-S109 PolarHBondContact OE2-OG 3.47Å
90	G	92.1	Very high	88.5	Confident	34 Å²	34	72.5 Å²	72.5	35%	0.351	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	6.5	177.9	0	0	0	0	0	115.4	A86 I87 E88 Y92	A86-G90 PolarHBondContact O-N 3.29Å; A86-G90 VanDerWaalsContact O-N 3.17Å; I87-G90 PolarHBondContact O-N 3.1Å; E88-G90 PolarHBondContact O-N 3.43Å; G90-Y92 WeakPolarHBondContact O-CD2 3.22Å; G90-Y92 WeakPolarHBondContact O-CE2 3.41Å; G90-Y92 PolarHBondContact O-N 3.38Å
91	I	94.6	Very high	86.9	Confident	53 Å²	53	73.1 Å²	73.1	27%	0.272	35%	0.349	S	S	.	.			trans	-89.1	89.4	175.3	-58.4	173.4	0	0	0	108.2	A86 K107 S109	A86-I91 CarbonylContact C-O 3.57Å; A86-I91 HydrophobicContact CB-CB 4.22Å; A86-I91 CarbonylContact O-C 3.59Å; A86-I91 WeakPolarHBondContact O-CA 3.44Å; A86-I91 WeakPolarHBondContact O-CB 3.39Å; A86-I91 PolarHBondContact O-N 3.31Å; I91-K107 HydrophobicContact CG2-CB 4.01Å; I91-K107 HydrophobicContact CG2-CD 4.36Å; I91-S109 VanDerWaalsContact CD1-O 3.27Å; I91-S109 WeakPolarHBondContact CD1-O 3.15Å
92	Y	95.3	Very high	86.2	Confident	84 Å²	84	67.7 Å²	67.7	33%	0.329	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-83.6	149.3	-173	-56.3	-58.5	0	0	0	113.9	I87 G90 E94 T186	I87-Y92 HydrophobicContact CG2-CD1 4.34Å; I87-Y92 HydrophobicContact CG2-CE1 4.38Å; I87-Y92 WeakPolarHBondContact O-CE1 3.08Å; G90-Y92 WeakPolarHBondContact O-CD2 3.22Å; G90-Y92 WeakPolarHBondContact O-CE2 3.41Å; G90-Y92 PolarHBondContact O-N 3.38Å; Y92-E94 PolarHBondContact O-N 3Å; Y92-T186 VanDerWaalsContact CB-CG2 3.48Å; Y92-T186 HydrophobicContact CD2-CG2 4.4Å; Y92-T186 HydrophobicContact CG-CG2 4.14Å
93	P	96.4	Very high	85.9	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.006	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-53.5	132.8	167.2	-28.3	33.2	0	0	0	113.3	I87 Y104 F105 V106 T186 F187	I87-P93 HydrophobicContact CD1-CG 4.06Å; I87-P93 HydrophobicContact CG1-CG 4.27Å; P93-Y104 HydrophobicContact CB-CD1 4.48Å; P93-F105 CarbonylContact C-O 3.59Å; P93-F105 WeakPolarHBondContact CA-O 3.33Å; P93-V106 HydrophobicContact CB-CG2 4.15Å; P93-V106 HydrophobicContact CG-CB 4.44Å; P93-V106 HydrophobicContact CG-CG1 4.23Å; P93-V106 HydrophobicContact CG-CG2 4.07Å; P93-T186 VanDerWaalsContact O-CB 3.3Å; P93-T186 WeakPolarHBondContact O-CB 3.22Å; P93-T186 PolarHBondContact O-OG1 3.37Å; P93-F187 HydrophobicContact CB-CE1 3.94Å; P93-F187 HydrophobicContact CB-CZ 4.45Å; P93-F187 HydrophobicContact CG-CE1 4.12Å; P93-F187 HydrophobicContact CG-CZ 4.15Å
94	E	94.4	Very high	85.8	Confident	100 Å²	100	64.5 Å²	64.5	47%	0.467	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	140.1	-178.6	-81.8	168.3	-164.9	0	0	111.4	Y92 Y104 F105 K107	Y92-E94 PolarHBondContact O-N 3Å; E94-Y104 CarbonylContact O-C 3.41Å; E94-Y104 WeakPolarHBondContact O-CA 3.24Å; E94-F105 PolarHBondContact N-O 2.96Å; E94-F105 PolarHBondContact O-N 3.08Å; E94-K107 IonicContact OE1-NZ 3.49Å; E94-K107 PolarHBondContact OE1-NZ 2.88Å; E94-K107 VanDerWaalsContact OE2-CE 3.25Å; E94-K107 WeakPolarHBondContact OE2-CE 3.5Å; E94-K107 IonicContact OE2-NZ 3.67Å; E94-K107 PolarHBondContact OE2-NZ 2.76Å
95	R	90.6	Very high	85.9	Confident	73 Å²	73	64.2 Å²	64.2	28%	0.275	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	132.7	-176.4	-173.4	175.7	173.2	-162.3	-5.2	111.4	Y97 Y104	R95-Y97 VanDerWaalsContact O-CD2 3.28Å; R95-Y97 WeakPolarHBondContact O-CD2 3.26Å; R95-Y97 WeakPolarHBondContact O-CE2 3.5Å; R95-Y97 PolarHBondContact O-N 3.16Å; R95-Y104 HydrophobicContact CB-CD1 4.05Å; R95-Y104 HydrophobicContact CB-CE1 3.83Å; R95-Y104 HydrophobicContact CG-CE1 4.15Å
96	I	89.1	Confident	86.1	Confident	29 Å²	29	58.6 Å²	58.6	15%	0.149	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	118	172.5	-43.7	-177.9	0	0	0	108.4	Q98 S103 F105 V116	I96-Q98 VanDerWaalsContact CG2-O 3.25Å; I96-Q98 WeakPolarHBondContact CG2-O 3.13Å; I96-S103 PolarHBondContact N-O 2.77Å; I96-F105 HydrophobicContact CB-CE2 4.46Å; I96-F105 HydrophobicContact CD1-CD1 3.78Å; I96-F105 HydrophobicContact CD1-CD2 4.13Å; I96-F105 HydrophobicContact CD1-CE1 3.61Å; I96-F105 HydrophobicContact CD1-CE2 3.98Å; I96-F105 HydrophobicContact CD1-CG 4.02Å; I96-F105 HydrophobicContact CD1-CZ 3.72Å; I96-F105 HydrophobicContact CG1-CD1 4.24Å; I96-F105 HydrophobicContact CG1-CD2 3.71Å; I96-F105 HydrophobicContact CG1-CE1 4.27Å; I96-F105 HydrophobicContact CG1-CE2 3.74Å; I96-F105 HydrophobicContact CG1-CG 3.96Å; I96-F105 HydrophobicContact CG1-CZ 4.02Å; I96-F105 HydrophobicContact CG2-CE2 4.13Å; I96-F105 HydrophobicContact CG2-CZ 4.29Å; I96-V116 HydrophobicContact CD1-CG1 3.92Å; I96-V116 HydrophobicContact CD1-CG2 4.41Å
97	Y	74.8	Confident	86.1	Confident	182 Å²	182	60.1 Å²	60.1	71%	0.714	30%	0.3	S	S	*	.			trans	-86.1	-34.7	-177.7	-69.1	-86.1	0	0	0	112.9	R95 G99	R95-Y97 VanDerWaalsContact O-CD2 3.28Å; R95-Y97 WeakPolarHBondContact O-CD2 3.26Å; R95-Y97 WeakPolarHBondContact O-CE2 3.5Å; R95-Y97 PolarHBondContact O-N 3.16Å; Y97-G99 PolarHBondContact O-N 2.78Å
98	Q	67.4	Low	86.2	Confident	182 Å²	182	59.8 Å²	59.8	85%	0.85	30%	0.299	S	S	*	.	S	Bend	trans	-76	111.7	169.6	-69.6	166.3	-36.4	0	0	108.3	I96	I96-Q98 VanDerWaalsContact CG2-O 3.25Å; I96-Q98 WeakPolarHBondContact CG2-O 3.13Å
99	G	62.4	Low	86.5	Confident	48 Å²	48	54 Å²	54	50%	0.495	28%	0.277	S	S	.	.	S	Bend	trans	140.6	168.2	-175.9	0	0	0	0	0	114	Y97 K131	Y97-G99 PolarHBondContact O-N 2.78Å; G99-K131 PolarHBondContact O-NZ 2.82Å
100	S	53.6	Low	86.6	Confident	50 Å²	50	57.2 Å²	57.2	35%	0.35	29%	0.291	S	S	.	.	S	Bend	trans	-90.6	-5.6	-164.6	87.4	0	0	0	0	116	K134	S100-K134 PolarHBondContact O-NZ 3.32Å
101	S	63.1	Low	86.7	Confident	15 Å²	15	57 Å²	57	11%	0.105	29%	0.289	C	S	.	.	S	Bend	trans	-154.7	-171	-167	66.4	0	0	0	0	113.6	S103	S101-S103 PolarHBondContact O-N 2.84Å
102	G	80.3	Confident	86.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.01	30%	0.298	C	S	.	.			trans	-78.5	91.6	169.8	0	0	0	0	0	112.2	P119 E122	G102-P119 WeakPolarHBondContact O-CD 3.42Å; G102-E122 PolarHBondContact N-O 2.86Å
103	S	90.8	Very high	86.9	Confident	14 Å²	14	57.5 Å²	57.5	10%	0.098	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	149.2	172.1	-59.4	0	0	0	0	110.4	I96 S101	I96-S103 PolarHBondContact N-O 2.77Å; S101-S103 PolarHBondContact O-N 2.84Å
104	Y	95.1	Very high	86.9	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132	-173.6	-64.6	-93.7	0	0	0	112.3	P93 E94 R95 V106 V116 F117 P119 E122 T186 F187	P93-Y104 HydrophobicContact CB-CD1 4.48Å; E94-Y104 CarbonylContact O-C 3.41Å; E94-Y104 WeakPolarHBondContact O-CA 3.24Å; R95-Y104 HydrophobicContact CB-CD1 4.05Å; R95-Y104 HydrophobicContact CB-CE1 3.83Å; R95-Y104 HydrophobicContact CG-CE1 4.15Å; Y104-V106 PolarHBondContact O-N 2.88Å; Y104-V116 CarbonylContact O-C 3.53Å; Y104-V116 WeakPolarHBondContact O-CA 3.45Å; Y104-F117 PolarHBondContact N-O 3.14Å; Y104-F117 PolarHBondContact O-N 3.33Å; Y104-P119 HydrophobicContact CD2-CG 4.27Å; Y104-P119 HydrophobicContact CE2-CG 4.05Å; Y104-E122 PolarHBondContact OH-OE2 3.16Å; Y104-T186 WeakPolarHBondContact CE1-O 3.32Å; Y104-T186 PolarHBondContact OH-O 3.5Å; Y104-F187 AromaticContact CD1-CD1 3.89Å; Y104-F187 HydrophobicContact CD1-CD1 3.89Å; Y104-F187 HydrophobicContact CD1-CE1 4.02Å; Y104-F187 AromaticContact CD2-CD1 3.88Å; Y104-F187 HydrophobicContact CD2-CD1 3.88Å; Y104-F187 AromaticContact CD2-CE1 3.95Å; Y104-F187 HydrophobicContact CD2-CE1 3.95Å; Y104-F187 AromaticContact CE1-CD1 3.81Å; Y104-F187 HydrophobicContact CE1-CD1 3.81Å; Y104-F187 HydrophobicContact CE1-CE1 4.41Å; Y104-F187 AromaticContact CE2-CD1 3.82Å; Y104-F187 HydrophobicContact CE2-CD1 3.82Å; Y104-F187 HydrophobicContact CE2-CE1 4.36Å; Y104-F187 AromaticContact CG-CD1 3.93Å; Y104-F187 HydrophobicContact CG-CD1 3.93Å; Y104-F187 AromaticContact CG-CE1 3.78Å; Y104-F187 HydrophobicContact CG-CE1 3.78Å; Y104-F187 AromaticContact CZ-CD1 3.79Å
105	F	96.7	Very high	87	Confident	60 Å²	60	53.6 Å²	53.6	26%	0.263	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	115.4	163.5	-71	-52.6	0	0	0	109.1	P93 E94 I96 I113 V116 F229	P93-F105 CarbonylContact C-O 3.59Å; P93-F105 WeakPolarHBondContact CA-O 3.33Å; E94-F105 PolarHBondContact N-O 2.96Å; E94-F105 PolarHBondContact O-N 3.08Å; I96-F105 HydrophobicContact CB-CE2 4.46Å; I96-F105 HydrophobicContact CD1-CD1 3.78Å; I96-F105 HydrophobicContact CD1-CD2 4.13Å; I96-F105 HydrophobicContact CD1-CE1 3.61Å; I96-F105 HydrophobicContact CD1-CE2 3.98Å; I96-F105 HydrophobicContact CD1-CG 4.02Å; I96-F105 HydrophobicContact CD1-CZ 3.72Å; I96-F105 HydrophobicContact CG1-CD1 4.24Å; I96-F105 HydrophobicContact CG1-CD2 3.71Å; I96-F105 HydrophobicContact CG1-CE1 4.27Å; I96-F105 HydrophobicContact CG1-CE2 3.74Å; I96-F105 HydrophobicContact CG1-CG 3.96Å; I96-F105 HydrophobicContact CG1-CZ 4.02Å; I96-F105 HydrophobicContact CG2-CE2 4.13Å; I96-F105 HydrophobicContact CG2-CZ 4.29Å; F105-I113 HydrophobicContact CB-CD1 4.15Å; F105-I113 HydrophobicContact CB-CG1 4.28Å; F105-I113 HydrophobicContact CB-CG2 4.07Å; F105-I113 HydrophobicContact CD1-CD1 4.09Å; F105-I113 HydrophobicContact CD1-CG2 3.78Å; F105-I113 HydrophobicContact CD2-CD1 4.17Å; F105-I113 HydrophobicContact CG-CD1 3.9Å; F105-I113 HydrophobicContact CG-CG2 4.22Å; F105-V116 HydrophobicContact CD1-CG2 3.98Å; F105-V116 HydrophobicContact CE1-CG2 4.01Å; F105-F229 HydrophobicContact CD1-CE2 4.44Å; F105-F229 HydrophobicContact CE1-CD2 4.36Å; F105-F229 AromaticContact CE1-CE2 3.98Å; F105-F229 HydrophobicContact CE1-CE2 3.98Å
106	V	97.6	Very high	87.3	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	136.2	175.2	-176	0	0	0	0	109.3	A83 P93 Y104 I113 I114 G115 F117 L182 F226	A83-V106 HydrophobicContact CB-CG1 3.41Å; A83-V106 VanDerWaalsContact CB-CG1 3.41Å; P93-V106 HydrophobicContact CB-CG2 4.15Å; P93-V106 HydrophobicContact CG-CB 4.44Å; P93-V106 HydrophobicContact CG-CG1 4.23Å; P93-V106 HydrophobicContact CG-CG2 4.07Å; Y104-V106 PolarHBondContact O-N 2.88Å; V106-I113 WeakPolarHBondContact O-CA 3.41Å; V106-I114 HydrophobicContact CG1-CD1 4.49Å; V106-I114 HydrophobicContact CG1-CG1 4.39Å; V106-I114 WeakPolarHBondContact O-CG1 2.9Å; V106-I114 PolarHBondContact O-N 3.43Å; V106-G115 PolarHBondContact N-O 3.01Å; V106-G115 PolarHBondContact O-N 2.84Å; V106-F117 HydrophobicContact CG2-CB 3.53Å; V106-L182 HydrophobicContact CG2-CD1 4.3Å; V106-F226 HydrophobicContact CB-CE2 3.84Å; V106-F226 HydrophobicContact CB-CZ 4.49Å; V106-F226 HydrophobicContact CG1-CE2 3.89Å; V106-F226 HydrophobicContact CG2-CD2 4.3Å; V106-F226 HydrophobicContact CG2-CE2 3.89Å
107	K	97.4	Very high	87.7	Confident	31 Å²	31	49.8 Å²	49.8	14%	0.135	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	159.2	-175.1	-64.2	-179.5	175.1	-170.9	0	111.7	A86 I91 E94 G111 K112	A86-K107 VanDerWaalsContact CB-O 3.28Å; A86-K107 WeakPolarHBondContact CB-O 3.43Å; I91-K107 HydrophobicContact CG2-CB 4.01Å; I91-K107 HydrophobicContact CG2-CD 4.36Å; E94-K107 IonicContact OE1-NZ 3.49Å; E94-K107 PolarHBondContact OE1-NZ 2.88Å; E94-K107 VanDerWaalsContact OE2-CE 3.25Å; E94-K107 WeakPolarHBondContact OE2-CE 3.5Å; E94-K107 IonicContact OE2-NZ 3.67Å; E94-K107 PolarHBondContact OE2-NZ 2.76Å; K107-G111 WeakPolarHBondContact CD-O 3.25Å; K107-K112 CarbonylContact C-O 3.49Å; K107-K112 WeakPolarHBondContact CA-O 3.33Å
108	D	96.4	Very high	88.6	Confident	18 Å²	18	42.4 Å²	42.4	10%	0.096	23%	0.233	C	C	.	.			trans	-91	179.3	164.5	66	17.2	0	0	0	112.1	K82 A86 Q110 G111 K112 I114	K82-D108 HydrophobicContact CB-CB 4.28Å; A86-D108 VanDerWaalsContact CB-C 3.42Å; D108-Q110 PolarHBondContact O-N 3.03Å; D108-Q110 WeakPolarHBondContact OD1-CA 3.36Å; D108-Q110 WeakPolarHBondContact OD1-CB 3.26Å; D108-Q110 PolarHBondContact OD1-N 3.35Å; D108-G111 PolarHBondContact O-N 2.96Å; D108-G111 PolarHBondContact OD1-N 3.28Å; D108-K112 PolarHBondContact N-O 2.94Å; D108-K112 PolarHBondContact OD1-N 2.68Å; D108-I114 HydrophobicContact CB-CD1 4.18Å; D108-I114 HydrophobicContact CB-CG2 3.93Å
109	S	95.6	Very high	89.9	Confident	43 Å²	43	33.8 Å²	33.8	30%	0.301	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-14.6	176.2	-59.7	0	0	0	0	115	E89 I91	E89-S109 WeakPolarHBondContact OE2-CB 3.34Å; E89-S109 PolarHBondContact OE2-OG 3.47Å; I91-S109 VanDerWaalsContact CD1-O 3.27Å; I91-S109 WeakPolarHBondContact CD1-O 3.15Å
110	Q	95.6	Very high	91.3	Very high	178 Å²	178	32.9 Å²	32.9	83%	0.832	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99	0.4	176.4	-58.5	-172.3	-43.6	0	0	112.1	D108 K112	D108-Q110 PolarHBondContact O-N 3.03Å; D108-Q110 WeakPolarHBondContact OD1-CA 3.36Å; D108-Q110 WeakPolarHBondContact OD1-CB 3.26Å; D108-Q110 PolarHBondContact OD1-N 3.35Å; Q110-K112 VanDerWaalsContact C-N 3.28Å; Q110-K112 PolarHBondContact O-N 2.78Å
111	G	93.4	Very high	92.9	Very high	30 Å²	30	32.9 Å²	32.9	31%	0.309	17%	0.171	S	C	.	.	S	Bend	trans	78.7	4.7	-175.6	0	0	0	0	0	114.2	K107 D108	K107-G111 WeakPolarHBondContact CD-O 3.25Å; D108-G111 PolarHBondContact O-N 2.96Å; D108-G111 PolarHBondContact OD1-N 3.28Å
112	K	96.4	Very high	94	Very high	104 Å²	104	32.2 Å²	32.2	45%	0.452	17%	0.166	S	C	.	.			trans	-72.8	136.7	176.2	-171.5	-170.1	170.2	-176.1	0	109.3	K107 D108 Q110 I114 D231	K107-K112 CarbonylContact C-O 3.49Å; K107-K112 WeakPolarHBondContact CA-O 3.33Å; D108-K112 PolarHBondContact N-O 2.94Å; D108-K112 PolarHBondContact OD1-N 2.68Å; Q110-K112 VanDerWaalsContact C-N 3.28Å; Q110-K112 PolarHBondContact O-N 2.78Å; K112-I114 PolarHBondContact O-N 2.98Å; K112-D231 WeakPolarHBondContact CE-OD2 3.16Å; K112-D231 IonicContact NZ-OD1 2.89Å; K112-D231 IonicContact NZ-OD2 2.69Å; K112-D231 PolarHBondContact NZ-OD2 3.39Å
113	I	97.2	Very high	93.9	Very high	44 Å²	44	33 Å²	33	23%	0.226	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	126.1	171.9	-54.5	174.1	0	0	0	109.3	F105 V106 F229	F105-I113 HydrophobicContact CB-CD1 4.15Å; F105-I113 HydrophobicContact CB-CG1 4.28Å; F105-I113 HydrophobicContact CB-CG2 4.07Å; F105-I113 HydrophobicContact CD1-CD1 4.09Å; F105-I113 HydrophobicContact CD1-CG2 3.78Å; F105-I113 HydrophobicContact CD2-CD1 4.17Å; F105-I113 HydrophobicContact CG-CD1 3.9Å; F105-I113 HydrophobicContact CG-CG2 4.22Å; V106-I113 WeakPolarHBondContact O-CA 3.41Å; I113-F229 HydrophobicContact CB-CD1 4.28Å; I113-F229 HydrophobicContact CB-CE1 4.48Å; I113-F229 HydrophobicContact CB-CG 4.3Å; I113-F229 HydrophobicContact CG2-CB 4.01Å; I113-F229 HydrophobicContact CG2-CD1 4.11Å; I113-F229 HydrophobicContact CG2-CD2 3.59Å; I113-F229 HydrophobicContact CG2-CE2 4.05Å; I113-F229 HydrophobicContact CG2-CG 3.63Å; I113-F229 HydrophobicContact CG2-CZ 4.49Å
114	I	97.5	Very high	92.7	Very high	19 Å²	19	33.7 Å²	33.7	10%	0.097	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-17.4	-179.3	54.7	169	0	0	0	113.2	I79 K82 A83 V106 D108 K112 F229	I79-I114 HydrophobicContact CG2-CB 4.29Å; I79-I114 HydrophobicContact CG2-CD1 4.21Å; K82-I114 HydrophobicContact CB-CD1 4.09Å; A83-I114 HydrophobicContact CB-CD1 3.92Å; V106-I114 HydrophobicContact CG1-CD1 4.49Å; V106-I114 HydrophobicContact CG1-CG1 4.39Å; V106-I114 WeakPolarHBondContact O-CG1 2.9Å; V106-I114 PolarHBondContact O-N 3.43Å; D108-I114 HydrophobicContact CB-CD1 4.18Å; D108-I114 HydrophobicContact CB-CG2 3.93Å; K112-I114 PolarHBondContact O-N 2.98Å; I114-F229 PolarHBondContact O-N 3.36Å
115	G	97.1	Very high	91.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	170.1	176.7	0	0	0	0	0	114.4	V106 Q227	V106-G115 PolarHBondContact N-O 3.01Å; V106-G115 PolarHBondContact O-N 2.84Å; G115-Q227 CarbonylContact C-O 3.48Å; G115-Q227 WeakPolarHBondContact CA-O 3.43Å
116	V	96.7	Very high	89.6	Confident	21 Å²	21	35 Å²	35	13%	0.127	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.4	169.6	179.8	0	0	0	0	108.2	I96 Y104 F105 K118 F226 Q227 F229	I96-V116 HydrophobicContact CD1-CG1 3.92Å; I96-V116 HydrophobicContact CD1-CG2 4.41Å; Y104-V116 CarbonylContact O-C 3.53Å; Y104-V116 WeakPolarHBondContact O-CA 3.45Å; F105-V116 HydrophobicContact CD1-CG2 3.98Å; F105-V116 HydrophobicContact CE1-CG2 4.01Å; V116-K118 HydrophobicContact CG1-CG 4.39Å; V116-F226 WeakPolarHBondContact O-CA 3.3Å; V116-Q227 PolarHBondContact N-O 3.17Å; V116-Q227 PolarHBondContact O-N 3.24Å; V116-F229 HydrophobicContact CG2-CD2 4.48Å
117	F	96.9	Very high	87.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.2	177.7	-176.5	-113.4	0	0	0	111.4	Y104 V106 P119 V180 L182 F187 S225 F226	Y104-F117 PolarHBondContact N-O 3.14Å; Y104-F117 PolarHBondContact O-N 3.33Å; V106-F117 HydrophobicContact CG2-CB 3.53Å; F117-P119 HydrophobicContact CD1-CB 4.49Å; F117-P119 HydrophobicContact CD1-CG 4.36Å; F117-P119 HydrophobicContact CE1-CB 3.79Å; F117-P119 HydrophobicContact CE1-CG 4.1Å; F117-P119 HydrophobicContact CZ-CB 4.25Å; F117-V180 HydrophobicContact CE2-CB 4.48Å; F117-L182 HydrophobicContact CB-CD1 4.43Å; F117-L182 HydrophobicContact CD1-CD1 4.25Å; F117-L182 HydrophobicContact CD2-CD1 4Å; F117-L182 HydrophobicContact CE1-CB 4.13Å; F117-L182 HydrophobicContact CE2-CD1 4.3Å; F117-L182 HydrophobicContact CE2-CG 4.43Å; F117-L182 HydrophobicContact CG-CD1 3.98Å; F117-L182 HydrophobicContact CZ-CB 4.11Å; F117-L182 HydrophobicContact CZ-CG 4.5Å; F117-F187 AromaticContact CD1-CE1 3.91Å; F117-F187 HydrophobicContact CD1-CE1 3.91Å; F117-F187 HydrophobicContact CD1-CE2 4.11Å; F117-F187 AromaticContact CD1-CZ 3.49Å; F117-F187 HydrophobicContact CD1-CZ 3.49Å; F117-F187 VanDerWaalsContact CD1-CZ 3.49Å; F117-F187 HydrophobicContact CE1-CE1 4.34Å; F117-F187 AromaticContact CE1-CE2 3.78Å; F117-F187 HydrophobicContact CE1-CE2 3.78Å; F117-F187 AromaticContact CE1-CZ 3.67Å; F117-F187 HydrophobicContact CE1-CZ 3.67Å; F117-S225 VanDerWaalsContact CA-O 3.32Å; F117-S225 WeakPolarHBondContact CA-O 3.43Å; F117-S225 VanDerWaalsContact CD2-O 3.25Å; F117-S225 WeakPolarHBondContact CD2-O 3.41Å; F117-F226 HydrophobicContact CB-CD2 4.39Å; F117-F226 HydrophobicContact CD2-CB 4.19Å; F117-F226 HydrophobicContact CD2-CD2 4.4Å
118	K	94.3	Very high	86.4	Confident	28 Å²	28	45 Å²	45	12%	0.122	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	93	178.5	-58.6	-175.8	178.2	170	0	109.6	V116 E159 G224 S225 D314	V116-K118 HydrophobicContact CG1-CG 4.39Å; K118-E159 IonicContact NZ-OE1 2.68Å; K118-E159 PolarHBondContact NZ-OE1 3.5Å; K118-G224 WeakPolarHBondContact O-CA 3.21Å; K118-S225 PolarHBondContact N-O 3.4Å; K118-S225 PolarHBondContact O-N 3.48Å; K118-S225 VanDerWaalsContact O-N 3.14Å; K118-D314 VanDerWaalsContact NZ-CG 3.3Å; K118-D314 IonicContact NZ-OD1 2.66Å; K118-D314 PolarHBondContact NZ-OD1 3.38Å; K118-D314 IonicContact NZ-OD2 3.52Å
119	P	94.2	Very high	84.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	130.2	179.2	23.3	-31.4	0	0	0	112.6	G102 Y104 F117 N121 E122 K222 V223	G102-P119 WeakPolarHBondContact O-CD 3.42Å; Y104-P119 HydrophobicContact CD2-CG 4.27Å; Y104-P119 HydrophobicContact CE2-CG 4.05Å; F117-P119 HydrophobicContact CD1-CB 4.49Å; F117-P119 HydrophobicContact CD1-CG 4.36Å; F117-P119 HydrophobicContact CE1-CB 3.79Å; F117-P119 HydrophobicContact CE1-CG 4.1Å; F117-P119 HydrophobicContact CZ-CB 4.25Å; P119-N121 PolarHBondContact O-N 2.56Å; P119-N121 VanDerWaalsContact O-N 3.08Å; P119-E122 HydrophobicContact CB-CG 4.49Å; P119-E122 HydrophobicContact CG-CB 4.12Å; P119-E122 HydrophobicContact CG-CG 3.91Å; P119-E122 PolarHBondContact O-N 2.89Å; P119-K222 HydrophobicContact CB-CB 4.08Å; P119-K222 HydrophobicContact CB-CD 3.91Å; P119-K222 HydrophobicContact CG-CD 4.46Å; P119-V223 WeakPolarHBondContact CA-O 3.24Å
120	K	91.4	Very high	83.1	Confident	30 Å²	30	45.4 Å²	45.4	13%	0.13	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-46.2	-44.7	-178.9	177.8	-173.3	-178.6	167.5	0	113.2	E122 E123 N153 Y156 V223 D376	K120-E122 PolarHBondContact O-N 3.17Å; K120-E123 WeakPolarHBondContact O-CB 3.33Å; K120-E123 WeakPolarHBondContact O-CG 3.42Å; K120-E123 PolarHBondContact O-N 2.97Å; K120-N153 WeakPolarHBondContact CE-ND2 3.46Å; K120-N153 VanDerWaalsContact CE-O 3.26Å; K120-N153 WeakPolarHBondContact CE-O 3.22Å; K120-N153 PolarHBondContact O-OD1 3.07Å; K120-Y156 HydrophobicContact CB-CD1 3.76Å; K120-Y156 HydrophobicContact CB-CE1 3.98Å; K120-Y156 HydrophobicContact CB-CG 4.3Å; K120-Y156 HydrophobicContact CD-CD1 4.13Å; K120-Y156 HydrophobicContact CD-CE1 3.48Å; K120-Y156 VanDerWaalsContact CD-CE1 3.48Å; K120-Y156 HydrophobicContact CG-CD1 3.78Å; K120-Y156 HydrophobicContact CG-CE1 3.68Å; K120-V223 HydrophobicContact CB-CG1 3.92Å; K120-V223 HydrophobicContact CD-CG1 4.02Å; K120-V223 PolarHBondContact N-O 2.96Å; K120-D376 WeakPolarHBondContact CE-OD2 3.46Å; K120-D376 IonicContact NZ-OD1 2.63Å; K120-D376 PolarHBondContact NZ-OD1 3.5Å; K120-D376 IonicContact NZ-OD2 3.79Å; K120-D376 PolarHBondContact NZ-OD2 3.39Å
121	N	87	Confident	81.2	Confident	50 Å²	50	40.1 Å²	40.1	27%	0.267	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-77.4	-3.3	-174.1	61.8	10.9	0	0	0	114.9	P119 G126 L128 K222	P119-N121 PolarHBondContact O-N 2.56Å; P119-N121 VanDerWaalsContact O-N 3.08Å; N121-G126 CarbonylContact O-C 3.6Å; N121-L128 CarbonylContact O-C 3.55Å; N121-L128 WeakPolarHBondContact O-CA 3.43Å; N121-L128 WeakPolarHBondContact O-CB 3.3Å; N121-L128 PolarHBondContact O-N 3.16Å; N121-K222 WeakPolarHBondContact OD1-CD 3.17Å; N121-K222 WeakPolarHBondContact OD1-CE 3.46Å; N121-K222 PolarHBondContact OD1-NZ 2.77Å
122	E	85.6	Confident	79.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-112.3	4.8	174.6	-50.3	-169.5	-147.1	0	0	113.7	G102 Y104 P119 K120 N129 N188 K222	G102-E122 PolarHBondContact N-O 2.86Å; Y104-E122 PolarHBondContact OH-OE2 3.16Å; P119-E122 HydrophobicContact CB-CG 4.49Å; P119-E122 HydrophobicContact CG-CB 4.12Å; P119-E122 HydrophobicContact CG-CG 3.91Å; P119-E122 PolarHBondContact O-N 2.89Å; K120-E122 PolarHBondContact O-N 3.17Å; E122-N129 PolarHBondContact O-ND2 3.31Å; E122-N188 VanDerWaalsContact CD-CB 3.47Å; E122-N188 HydrophobicContact CG-CB 4.21Å; E122-N188 PolarHBondContact OE1-N 3.37Å; E122-N188 WeakPolarHBondContact OE2-CB 3.46Å; E122-K222 IonicContact OE1-NZ 2.87Å; E122-K222 PolarHBondContact OE1-NZ 2.78Å
123	E	78.2	Confident	76.9	Confident	17 Å²	17	46.3 Å²	46.3	8%	0.079	23%	0.225	C	C	.	.	S	Bend	trans	-57.4	162.4	171.2	-76.4	-176.7	-158.4	0	0	112.1	K120 Y125 G126 N129 N153 G155 Y156	K120-E123 WeakPolarHBondContact O-CB 3.33Å; K120-E123 WeakPolarHBondContact O-CG 3.42Å; K120-E123 PolarHBondContact O-N 2.97Å; E123-Y125 PolarHBondContact O-N 3.05Å; E123-G126 PolarHBondContact O-N 3.35Å; E123-N129 PolarHBondContact O-ND2 3.03Å; E123-N153 WeakPolarHBondContact OE2-CA 3.39Å; E123-G155 PolarHBondContact OE1-N 2.83Å; E123-G155 PolarHBondContact OE2-N 2.88Å; E123-Y156 PolarHBondContact OE1-N 3.22Å
124	P	67.1	Low	74.7	Confident	29 Å²	29	47.3 Å²	47.3	19%	0.188	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-29.2	178.4	-33	40	0	0	0	116.4	N129 K134	P124-N129 WeakPolarHBondContact CA-ND2 3.38Å; P124-K134 HydrophobicContact CB-CD 4.08Å
125	Y	62.4	Low	72.4	Confident	83 Å²	83	53.6 Å²	53.6	33%	0.325	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	1.8	178.8	-52.7	-74.8	0	0	0	113.8	E123 L152	E123-Y125 PolarHBondContact O-N 3.05Å; Y125-L152 HydrophobicContact CD1-CD2 4.49Å; Y125-L152 HydrophobicContact CG-CD2 4.37Å
126	G	64.2	Low	69.9	Low	10 Å²	10	57.1 Å²	57.1	10%	0.103	27%	0.269	C	S	.	.	S	Bend	trans	-71.6	147	-179.6	0	0	0	0	0	113	N121 E123 L128 N129 N153	N121-G126 CarbonylContact O-C 3.6Å; E123-G126 PolarHBondContact O-N 3.35Å; G126-L128 PolarHBondContact O-N 2.76Å; G126-N129 PolarHBondContact O-N 3Å; G126-N153 WeakPolarHBondContact CA-OD1 3.48Å; G126-N153 PolarHBondContact N-OD1 2.81Å
127	Q	62.2	Low	67.7	Low	194 Å²	194	60.2 Å²	60.2	91%	0.907	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.4	-175.4	-66.4	175.8	-9.6	0	0	114
128	L	64.4	Low	65.4	Low	46 Å²	46	66.2 Å²	66.2	24%	0.241	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	29.7	-179.2	-57	177.9	0	0	0	111.2	N121 G126 P130 N188	N121-L128 CarbonylContact O-C 3.55Å; N121-L128 WeakPolarHBondContact O-CA 3.43Å; N121-L128 WeakPolarHBondContact O-CB 3.3Å; N121-L128 PolarHBondContact O-N 3.16Å; G126-L128 PolarHBondContact O-N 2.76Å; L128-P130 VanDerWaalsContact O-CD 3.3Å; L128-P130 WeakPolarHBondContact O-CD 3.22Å; L128-N188 WeakPolarHBondContact CD1-O 3.27Å; L128-N188 PolarHBondContact O-ND2 2.87Å
129	N	65.3	Low	63.2	Low	29 Å²	29	70.8 Å²	70.8	16%	0.155	33%	0.333	C	S	.	.			trans	-62	122.2	175.8	-168.6	-53.2	0	0	0	110.8	E122 E123 P124 G126 K131	E122-N129 PolarHBondContact O-ND2 3.31Å; E123-N129 PolarHBondContact O-ND2 3.03Å; P124-N129 WeakPolarHBondContact CA-ND2 3.38Å; G126-N129 PolarHBondContact O-N 3Å; N129-K131 VanDerWaalsContact C-N 3.26Å; N129-K131 PolarHBondContact O-N 2.83Å; N129-K131 WeakPolarHBondContact OD1-CA 3.25Å; N129-K131 WeakPolarHBondContact OD1-CB 3.44Å; N129-K131 PolarHBondContact OD1-N 2.98Å
130	P	57	Low	60.8	Low	41 Å²	41	75 Å²	75	27%	0.266	36%	0.362	S	S	.	.	S	Bend	trans	-74.3	-4.8	-179	30	-36.9	0	0	0	115.2	L128	L128-P130 VanDerWaalsContact O-CD 3.3Å; L128-P130 WeakPolarHBondContact O-CD 3.22Å
131	K	57.6	Low	58.4	Low	68 Å²	68	76 Å²	76	30%	0.296	37%	0.372	S	S	.	.			trans	-102.5	88.4	175	-65.9	-169.7	175.1	-172.2	0	110	G99 N129 T133 K134	G99-K131 PolarHBondContact O-NZ 2.82Å; N129-K131 VanDerWaalsContact C-N 3.26Å; N129-K131 PolarHBondContact O-N 2.83Å; N129-K131 WeakPolarHBondContact OD1-CA 3.25Å; N129-K131 WeakPolarHBondContact OD1-CB 3.44Å; N129-K131 PolarHBondContact OD1-N 2.98Å; K131-T133 PolarHBondContact O-N 2.91Å; K131-K134 PolarHBondContact O-N 3.49Å
132	W	48.8	Very low	56.3	Low	176 Å²	176	78.9 Å²	78.9	67%	0.667	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-27.4	-176.2	-170.5	65.6	0	0	0	114.8	K134 W135 L136	W132-K134 VanDerWaalsContact C-N 3.29Å; W132-K134 PolarHBondContact O-N 3.37Å; W132-W135 AromaticContact NE1-CE3 3.84Å; W132-W135 WeakPolarHBondContact O-CB 3.17Å; W132-W135 PolarHBondContact O-N 2.94Å; W132-L136 PolarHBondContact O-N 3.06Å
133	T	50.6	Low	54.3	Low	87 Å²	87	83.6 Å²	83.6	53%	0.534	43%	0.425	S	S	.	.	H	α-helix	trans	-57.4	-34	179	38.4	0	0	0	0	114.2	K131 W135 L136 Q137	K131-T133 PolarHBondContact O-N 2.91Å; T133-W135 VanDerWaalsContact C-N 3.34Å; T133-L136 PolarHBondContact O-N 3.42Å; T133-Q137 VanDerWaalsContact O-CG 3.27Å; T133-Q137 WeakPolarHBondContact O-CG 3.21Å; T133-Q137 PolarHBondContact O-N 3.15Å
134	K	50	Low	52.5	Low	65 Å²	65	85.9 Å²	85.9	28%	0.283	44%	0.442	S	S	.	.	H	α-helix	trans	-72.3	-26.3	176.6	-74.2	-176.4	174	176.5	0	113	S100 P124 K131 W132 K138	S100-K134 PolarHBondContact O-NZ 3.32Å; P124-K134 HydrophobicContact CB-CD 4.08Å; K131-K134 PolarHBondContact O-N 3.49Å; W132-K134 VanDerWaalsContact C-N 3.29Å; W132-K134 PolarHBondContact O-N 3.37Å; K134-K138 WeakPolarHBondContact O-CB 3.17Å; K134-K138 PolarHBondContact O-N 3.13Å; K134-K138 VanDerWaalsContact O-N 3.1Å
135	W	50	Low	51.4	Low	151 Å²	151	90 Å²	90	57%	0.572	46%	0.458	S	S	*	.	H	α-helix	trans	-72	-41.7	173.8	-178.1	91.1	0	0	0	111.4	W132 T133 K138 L139	W132-W135 AromaticContact NE1-CE3 3.84Å; W132-W135 WeakPolarHBondContact O-CB 3.17Å; W132-W135 PolarHBondContact O-N 2.94Å; T133-W135 VanDerWaalsContact C-N 3.34Å; W135-K138 WeakPolarHBondContact O-CB 3.2Å; W135-K138 PolarHBondContact O-N 2.95Å; W135-L139 HydrophobicContact CH2-CD2 4.46Å; W135-L139 PolarHBondContact O-N 3.27Å
136	L	44.1	Very low	50.9	Low	74 Å²	74	87.1 Å²	87.1	39%	0.387	45%	0.453	S	S	.	.	H	α-helix	trans	-63.2	-43.5	174.4	-171.8	65.6	0	0	0	111.7	W132 T133 K138 L139 C140	W132-L136 PolarHBondContact O-N 3.06Å; T133-L136 PolarHBondContact O-N 3.42Å; L136-K138 VanDerWaalsContact C-N 3.33Å; L136-K138 PolarHBondContact O-N 3.27Å; L136-L139 PolarHBondContact O-N 2.95Å; L136-L139 VanDerWaalsContact O-N 3.12Å; L136-C140 PolarHBondContact O-N 3.14Å; L136-C140 VanDerWaalsContact O-N 3.11Å
137	Q	49.7	Very low	50.9	Low	86 Å²	86	88.3 Å²	88.3	40%	0.402	46%	0.455	S	S	.	.	H	α-helix	trans	-62	-37.2	175.6	-72.8	166.2	-17.9	0	0	112.9	T133 L139 C140 C141	T133-Q137 VanDerWaalsContact O-CG 3.27Å; T133-Q137 WeakPolarHBondContact O-CG 3.21Å; T133-Q137 PolarHBondContact O-N 3.15Å; Q137-L139 PolarHBondContact O-N 3.24Å; Q137-C140 PolarHBondContact O-N 3.35Å; Q137-C141 PolarHBondContact O-N 3.35Å
138	K	49.3	Very low	51.2	Low	126 Å²	126	84.6 Å²	84.6	55%	0.548	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-26.8	175	-170.7	177.4	-176.7	179.1	0	113	K134 W135 L136	K134-K138 WeakPolarHBondContact O-CB 3.17Å; K134-K138 PolarHBondContact O-N 3.13Å; K134-K138 VanDerWaalsContact O-N 3.1Å; W135-K138 WeakPolarHBondContact O-CB 3.2Å; W135-K138 PolarHBondContact O-N 2.95Å; L136-K138 VanDerWaalsContact C-N 3.33Å; L136-K138 PolarHBondContact O-N 3.27Å
139	L	47.7	Very low	52.1	Low	124 Å²	124	82.6 Å²	82.6	65%	0.649	43%	0.431	S	S	*	.	H	α-helix	trans	-87.2	-35.4	179.1	-164.4	67.7	0	0	0	112.5	W135 L136 Q137	W135-L139 HydrophobicContact CH2-CD2 4.46Å; W135-L139 PolarHBondContact O-N 3.27Å; L136-L139 PolarHBondContact O-N 2.95Å; L136-L139 VanDerWaalsContact O-N 3.12Å; Q137-L139 PolarHBondContact O-N 3.24Å
140	C	44.8	Very low	53	Low	90 Å²	90	82.3 Å²	82.3	61%	0.608	43%	0.429	S	S	*	.	H	α-helix	trans	-87.9	-22.4	-172.9	-66.9	0	0	0	0	115.6	L136 Q137	L136-C140 PolarHBondContact O-N 3.14Å; L136-C140 VanDerWaalsContact O-N 3.11Å; Q137-C140 PolarHBondContact O-N 3.35Å
141	C	41.5	Very low	54.2	Low	49 Å²	49	81.5 Å²	81.5	33%	0.331	42%	0.424	S	S	.	.			trans	-148.1	73.3	-176.8	-87.3	0	0	0	0	113.7	Q137 C143 C144 F145	Q137-C141 PolarHBondContact O-N 3.35Å; C141-C143 VanDerWaalsContact C-N 3.27Å; C141-C143 PolarHBondContact O-N 2.62Å; C141-C144 HydrophobicContact CB-CB 4.04Å; C141-C144 PolarHBondContact O-N 3.02Å; C141-C144 VanDerWaalsContact O-N 3.12Å; C141-F145 HydrophobicContact CB-CD2 3.69Å; C141-F145 HydrophobicContact CB-CE2 3.96Å; C141-F145 PolarHBondContact O-N 3.09Å
142	P	42.7	Very low	55.4	Low	111 Å²	111	84 Å²	84	72%	0.721	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.6	-175.6	25.6	-34.7	0	0	0	115
143	C	42.8	Very low	57	Low	99 Å²	99	77.4 Å²	77.4	67%	0.669	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-21.4	174.6	48.3	0	0	0	0	113.7	C141 R328	C141-C143 VanDerWaalsContact C-N 3.27Å; C141-C143 PolarHBondContact O-N 2.62Å; C143-R328 PolarHBondContact O-NH2 2.72Å
144	C	39.8	Very low	58.9	Low	65 Å²	65	73.9 Å²	73.9	44%	0.439	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-13.2	-174	-58	0	0	0	0	114.3	C141 R328	C141-C144 HydrophobicContact CB-CB 4.04Å; C141-C144 PolarHBondContact O-N 3.02Å; C141-C144 VanDerWaalsContact O-N 3.12Å; C144-R328 VanDerWaalsContact CA-NH2 3.35Å; C144-R328 PolarHBondContact O-NH2 2.83Å
145	F	45.1	Very low	60.8	Low	116 Å²	116	71.4 Å²	71.4	51%	0.509	39%	0.388	S	S	.	.	S	Bend	trans	-131.4	125.6	-173.5	-68.7	-83.7	0	0	0	113.3	C141	C141-F145 HydrophobicContact CB-CD2 3.69Å; C141-F145 HydrophobicContact CB-CE2 3.96Å; C141-F145 PolarHBondContact O-N 3.09Å
146	G	51.4	Low	62.9	Low	23 Å²	23	64.4 Å²	64.4	24%	0.237	36%	0.361	C	S	.	.	S	Bend	trans	125.9	130.6	-170.4	0	0	0	0	0	110.6	D148 R328	G146-D148 VanDerWaalsContact C-N 3.34Å; G146-D148 PolarHBondContact O-N 2.98Å; G146-D148 VanDerWaalsContact O-N 3.11Å; G146-R328 PolarHBondContact O-NH1 2.82Å
147	R	65.3	Low	65.4	Low	35 Å²	35	60.9 Å²	60.9	13%	0.132	34%	0.343	C	S	.	.			trans	-79.4	90.5	165.8	-60.3	-158.8	-170	137.5	10.5	107.3	C149 L150 T273 D274 L275 L317 Y330	R147-C149 PolarHBondContact O-N 2.94Å; R147-L150 HydrophobicContact CB-CB 4.34Å; R147-L150 HydrophobicContact CB-CD1 3.92Å; R147-L150 HydrophobicContact CB-CG 3.93Å; R147-L150 HydrophobicContact CG-CD1 4.38Å; R147-L150 PolarHBondContact O-N 2.86Å; R147-T273 WeakPolarHBondContact CD-OG1 3.34Å; R147-T273 VanDerWaalsContact NH1-C 3.26Å; R147-T273 PolarHBondContact NH1-O 2.8Å; R147-T273 PolarHBondContact NH1-OG1 3.05Å; R147-D274 IonicContact CZ-OD1 2.66Å; R147-D274 VanDerWaalsContact NH1-CA 3.35Å; R147-D274 IonicContact NH1-OD1 3.31Å; R147-D274 IonicContact NH2-OD1 3.54Å; R147-D274 PolarHBondContact NH2-OD1 2.93Å; R147-L275 VanDerWaalsContact NH2-N 3.13Å; R147-L317 VanDerWaalsContact NH1-CD1 3.3Å; R147-Y330 HydrophobicContact CB-CE2 4.4Å; R147-Y330 HydrophobicContact CG-CE1 4Å; R147-Y330 HydrophobicContact CG-CE2 4.31Å; R147-Y330 WeakPolarHBondContact CG-OH 3.39Å
148	D	67.8	Low	67.6	Low	115 Å²	115	57.1 Å²	57.1	62%	0.615	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-15.3	-178.7	-176.9	64.7	0	0	0	114.1	G146 K322	G146-D148 VanDerWaalsContact C-N 3.34Å; G146-D148 PolarHBondContact O-N 2.98Å; G146-D148 VanDerWaalsContact O-N 3.11Å; D148-K322 VanDerWaalsContact OD2-CE 3.28Å; D148-K322 WeakPolarHBondContact OD2-CE 3.1Å; D148-K322 IonicContact OD2-NZ 3.49Å; D148-K322 PolarHBondContact OD2-NZ 2.94Å
149	C	82.3	Confident	69.8	Low	4 Å²	4	51.2 Å²	51.2	3%	0.027	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.5	170.5	59.8	0	0	0	0	114.6	R147 P320 L321 K322 Y330	R147-C149 PolarHBondContact O-N 2.94Å; C149-P320 HydrophobicContact CB-CB 4.11Å; C149-P320 CarbonylContact O-C 3.38Å; C149-P320 WeakPolarHBondContact O-CA 3.35Å; C149-P320 VanDerWaalsContact O-CB 3.24Å; C149-P320 WeakPolarHBondContact O-CB 3.48Å; C149-L321 PolarHBondContact O-N 2.85Å; C149-K322 HydrophobicContact CB-CG 3.91Å; C149-K322 WeakPolarHBondContact CB-O 3.35Å; C149-Y330 VanDerWaalsContact SG-CE2 3.58Å
150	L	84.8	Confident	72.2	Confident	24 Å²	24	45.5 Å²	45.5	13%	0.126	27%	0.271	C	S	.	.	S	Bend	trans	-104.4	151.5	-178.7	-64.1	-176.7	0	0	0	112.3	R147 T273 L317 A318 P320	R147-L150 HydrophobicContact CB-CB 4.34Å; R147-L150 HydrophobicContact CB-CD1 3.92Å; R147-L150 HydrophobicContact CB-CG 3.93Å; R147-L150 HydrophobicContact CG-CD1 4.38Å; R147-L150 PolarHBondContact O-N 2.86Å; L150-T273 HydrophobicContact CD2-CG2 4.15Å; L150-L317 HydrophobicContact CD1-CB 3.9Å; L150-L317 HydrophobicContact CD1-CD2 3.8Å; L150-L317 HydrophobicContact CD1-CG 4.46Å; L150-A318 WeakPolarHBondContact CD2-O 3.34Å; L150-P320 HydrophobicContact CD2-CB 3.92Å
151	V	83.3	Confident	74.8	Confident	24 Å²	24	41.2 Å²	41.2	15%	0.145	24%	0.242	C	C	.	.			trans	-70	139.6	168.1	-173.8	0	0	0	0	109.9	Q154 L321 Q383	V151-Q154 HydrophobicContact CG1-CG 3.96Å; V151-L321 HydrophobicContact CG2-CD1 3.92Å; V151-L321 HydrophobicContact CG2-CD2 3.76Å; V151-L321 HydrophobicContact CG2-CG 3.86Å; V151-Q383 VanDerWaalsContact CG1-OE1 3.28Å; V151-Q383 HydrophobicContact CG2-CB 4.45Å
152	L	81.5	Confident	77.5	Confident	120 Å²	120	38.9 Å²	38.9	63%	0.628	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	131.9	178.7	-66.6	177.1	0	0	0	111.8	Y125 Q154	Y125-L152 HydrophobicContact CD1-CD2 4.49Å; Y125-L152 HydrophobicContact CG-CD2 4.37Å; L152-Q154 VanDerWaalsContact C-N 3.34Å; L152-Q154 PolarHBondContact O-N 3.2Å
153	N	83.4	Confident	80.1	Confident	37 Å²	37	33.7 Å²	33.7	20%	0.198	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	37.5	164.4	-164	74.3	0	0	0	114.3	K120 E123 G126	K120-N153 WeakPolarHBondContact CE-ND2 3.46Å; K120-N153 VanDerWaalsContact CE-O 3.26Å; K120-N153 WeakPolarHBondContact CE-O 3.22Å; K120-N153 PolarHBondContact O-OD1 3.07Å; E123-N153 WeakPolarHBondContact OE2-CA 3.39Å; G126-N153 WeakPolarHBondContact CA-OD1 3.48Å; G126-N153 PolarHBondContact N-OD1 2.81Å
154	Q	88.9	Confident	82.8	Confident	14 Å²	14	30.6 Å²	30.6	7%	0.065	17%	0.169	C	C	.	.			trans	-122.6	22.2	174.2	-68.1	-174.6	-4.1	0	0	112	V151 L152 Y156 L157 S158	V151-Q154 HydrophobicContact CG1-CG 3.96Å; L152-Q154 VanDerWaalsContact C-N 3.34Å; L152-Q154 PolarHBondContact O-N 3.2Å; Q154-Y156 VanDerWaalsContact C-N 3.26Å; Q154-Y156 PolarHBondContact O-N 3.33Å; Q154-L157 HydrophobicContact CB-CB 4.48Å; Q154-L157 HydrophobicContact CB-CD1 4.32Å; Q154-L157 HydrophobicContact CG-CD1 4.28Å; Q154-L157 WeakPolarHBondContact O-CB 3.43Å; Q154-L157 PolarHBondContact O-N 3.21Å; Q154-S158 PolarHBondContact O-N 3.41Å; Q154-S158 VanDerWaalsContact O-N 3.14Å
155	G	91.4	Very high	85.6	Confident	13 Å²	13	27.5 Å²	27.5	13%	0.134	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-36.7	-176.2	0	0	0	0	0	112.8	E123 L157 S158 E159 G316	E123-G155 PolarHBondContact OE1-N 2.83Å; E123-G155 PolarHBondContact OE2-N 2.88Å; G155-L157 VanDerWaalsContact C-N 3.26Å; G155-L157 PolarHBondContact O-N 3.48Å; G155-S158 WeakPolarHBondContact O-CB 3.38Å; G155-S158 PolarHBondContact O-N 2.85Å; G155-S158 VanDerWaalsContact O-N 3.08Å; G155-E159 WeakPolarHBondContact O-CG 3.37Å; G155-E159 PolarHBondContact O-N 3.12Å; G155-G316 WeakPolarHBondContact CA-O 3.45Å
156	Y	94.2	Very high	88.1	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.016	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-27.7	172.8	83.9	-76.6	0	0	0	114.6	K120 E123 Q154 A160 V179 V223 D376	K120-Y156 HydrophobicContact CB-CD1 3.76Å; K120-Y156 HydrophobicContact CB-CE1 3.98Å; K120-Y156 HydrophobicContact CB-CG 4.3Å; K120-Y156 HydrophobicContact CD-CD1 4.13Å; K120-Y156 HydrophobicContact CD-CE1 3.48Å; K120-Y156 VanDerWaalsContact CD-CE1 3.48Å; K120-Y156 HydrophobicContact CG-CD1 3.78Å; K120-Y156 HydrophobicContact CG-CE1 3.68Å; E123-Y156 PolarHBondContact OE1-N 3.22Å; Q154-Y156 VanDerWaalsContact C-N 3.26Å; Q154-Y156 PolarHBondContact O-N 3.33Å; Y156-A160 PolarHBondContact O-N 3.49Å; Y156-V179 HydrophobicContact CD2-CG1 4.15Å; Y156-V179 HydrophobicContact CD2-CG2 4.02Å; Y156-V179 HydrophobicContact CE2-CG1 3.8Å; Y156-V179 HydrophobicContact CE2-CG2 3.97Å; Y156-V223 HydrophobicContact CD2-CG2 4.41Å; Y156-V223 HydrophobicContact CE2-CG2 3.86Å; Y156-D376 WeakPolarHBondContact CE1-OD2 3.18Å; Y156-D376 PolarHBondContact OH-OD2 3.43Å
157	L	96.1	Very high	90.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-78.3	-34.8	171.9	-69.5	180	0	0	0	111.7	Q154 G155 E159 A160 G161 V179 L372 F373 D376	Q154-L157 HydrophobicContact CB-CB 4.48Å; Q154-L157 HydrophobicContact CB-CD1 4.32Å; Q154-L157 HydrophobicContact CG-CD1 4.28Å; Q154-L157 WeakPolarHBondContact O-CB 3.43Å; Q154-L157 PolarHBondContact O-N 3.21Å; G155-L157 VanDerWaalsContact C-N 3.26Å; G155-L157 PolarHBondContact O-N 3.48Å; L157-E159 VanDerWaalsContact C-N 3.35Å; L157-A160 PolarHBondContact O-N 3.36Å; L157-G161 WeakPolarHBondContact O-CA 3.1Å; L157-G161 PolarHBondContact O-N 3.36Å; L157-V179 HydrophobicContact CD2-CG2 3.95Å; L157-L372 HydrophobicContact CD2-CD1 4.24Å; L157-L372 HydrophobicContact CD2-CG 4.26Å; L157-F373 HydrophobicContact CB-CD1 4.18Å; L157-F373 HydrophobicContact CB-CE1 4.15Å; L157-F373 HydrophobicContact CD1-CB 4.32Å; L157-F373 HydrophobicContact CD1-CD1 4.44Å; L157-F373 HydrophobicContact CD1-CG 4.32Å; L157-D376 HydrophobicContact CD1-CB 3.81Å
158	S	95.9	Very high	91.9	Very high	7 Å²	7	25.7 Å²	25.7	5%	0.049	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-43.8	172.8	-174.6	0	0	0	0	111.2	Q154 G155 G161 A162 N315 A318	Q154-S158 PolarHBondContact O-N 3.41Å; Q154-S158 VanDerWaalsContact O-N 3.14Å; G155-S158 WeakPolarHBondContact O-CB 3.38Å; G155-S158 PolarHBondContact O-N 2.85Å; G155-S158 VanDerWaalsContact O-N 3.08Å; S158-G161 PolarHBondContact O-N 3.1Å; S158-A162 WeakPolarHBondContact O-CB 3.14Å; S158-A162 PolarHBondContact O-N 2.84Å; S158-N315 CarbonylContact C-O 3.58Å; S158-N315 WeakPolarHBondContact CB-O 3.37Å; S158-N315 PolarHBondContact OG-O 2.79Å; S158-A318 WeakPolarHBondContact OG-CA 3.39Å; S158-A318 WeakPolarHBondContact OG-CB 3.28Å; S158-A318 PolarHBondContact OG-N 2.97Å
159	E	95.9	Very high	93.3	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.009	11%	0.107	C	C	.	.	H	α-helix	trans	-58.7	-49.8	173.9	-70.5	-77.3	-153	0	0	112.8	K118 G155 L157 S163 T177 N315	K118-E159 IonicContact NZ-OE1 2.68Å; K118-E159 PolarHBondContact NZ-OE1 3.5Å; G155-E159 WeakPolarHBondContact O-CG 3.37Å; G155-E159 PolarHBondContact O-N 3.12Å; L157-E159 VanDerWaalsContact C-N 3.35Å; E159-S163 PolarHBondContact O-N 2.7Å; E159-T177 HydrophobicContact CB-CG2 3.94Å; E159-N315 WeakPolarHBondContact OE2-CA 3.4Å; E159-N315 PolarHBondContact OE2-N 3.08Å
160	A	98	Very high	94.1	Very high	4 Å²	4	25.2 Å²	25.2	3%	0.033	13%	0.13	C	C	.	.	H	α-helix	trans	-68.8	-34.5	178.4	0	0	0	0	0	112.2	Y156 L157 S163 L164 V179 L372	Y156-A160 PolarHBondContact O-N 3.49Å; L157-A160 PolarHBondContact O-N 3.36Å; A160-S163 PolarHBondContact O-N 3.45Å; A160-L164 WeakPolarHBondContact O-CB 3.39Å; A160-L164 PolarHBondContact O-N 3.49Å; A160-V179 HydrophobicContact CB-CG2 4Å; A160-L372 HydrophobicContact CB-CD1 4.14Å; A160-L372 HydrophobicContact CB-CD2 4.01Å
161	G	98.2	Very high	94.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-68	-37.6	177.6	0	0	0	0	0	112.4	L157 S158 L164 V165	L157-G161 WeakPolarHBondContact O-CA 3.1Å; L157-G161 PolarHBondContact O-N 3.36Å; S158-G161 PolarHBondContact O-N 3.1Å; G161-L164 WeakPolarHBondContact O-CB 3.49Å; G161-L164 PolarHBondContact O-N 2.91Å; G161-V165 WeakPolarHBondContact O-CG2 3.29Å; G161-V165 PolarHBondContact O-N 3.05Å
162	A	98.1	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.6	-42.7	173	0	0	0	0	0	111.6	S158 L164 V165 D166 I270 N315	S158-A162 WeakPolarHBondContact O-CB 3.14Å; S158-A162 PolarHBondContact O-N 2.84Å; A162-L164 VanDerWaalsContact C-N 3.31Å; A162-L164 PolarHBondContact O-N 3.42Å; A162-V165 PolarHBondContact O-N 2.96Å; A162-D166 WeakPolarHBondContact O-CB 3.41Å; A162-D166 PolarHBondContact O-N 3.03Å; A162-I270 HydrophobicContact CB-CD1 4.05Å; A162-N315 HydrophobicContact CB-CB 3.4Å; A162-N315 VanDerWaalsContact CB-CB 3.4Å
163	S	98.4	Very high	96.1	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.007	12%	0.117	C	C	.	.	H	α-helix	trans	-65.4	-32.4	173.7	-175	0	0	0	0	113	E159 A160 Q167 T177	E159-S163 PolarHBondContact O-N 2.7Å; A160-S163 PolarHBondContact O-N 3.45Å; S163-Q167 WeakPolarHBondContact O-CB 3.42Å; S163-Q167 VanDerWaalsContact O-CG 3.3Å; S163-Q167 WeakPolarHBondContact O-CG 3.44Å; S163-Q167 PolarHBondContact O-N 3.1Å; S163-Q167 VanDerWaalsContact O-N 3.08Å; S163-T177 WeakPolarHBondContact CB-O 3.37Å; S163-T177 PolarHBondContact OG-N 3.04Å
164	L	98.6	Very high	96.8	Very high	34 Å²	34	21.6 Å²	21.6	18%	0.178	11%	0.11	C	C	.	.	H	α-helix	trans	-68.9	-47	176	-174.3	161.5	0	0	0	111	A160 G161 A162 Q167 K168 L365 D368 L369 L372	A160-L164 WeakPolarHBondContact O-CB 3.39Å; A160-L164 PolarHBondContact O-N 3.49Å; G161-L164 WeakPolarHBondContact O-CB 3.49Å; G161-L164 PolarHBondContact O-N 2.91Å; A162-L164 VanDerWaalsContact C-N 3.31Å; A162-L164 PolarHBondContact O-N 3.42Å; L164-Q167 PolarHBondContact O-N 2.87Å; L164-K168 WeakPolarHBondContact O-CB 3.28Å; L164-K168 PolarHBondContact O-N 3.32Å; L164-L365 HydrophobicContact CD2-CD1 3.79Å; L164-D368 HydrophobicContact CD1-CB 4.15Å; L164-D368 HydrophobicContact CD2-CB 3.92Å; L164-D368 HydrophobicContact CG-CB 4.48Å; L164-L369 HydrophobicContact CD1-CD2 4.48Å; L164-L369 HydrophobicContact CD2-CD2 4.13Å; L164-L369 HydrophobicContact CD2-CG 4.21Å; L164-L372 HydrophobicContact CD1-CB 4.2Å; L164-L372 HydrophobicContact CD1-CD2 3.9Å
165	V	98.6	Very high	97.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-44.5	175.6	171.4	0	0	0	0	111	G161 A162 K168 L169 L266 I269 I270 F319 L365 L369	G161-V165 WeakPolarHBondContact O-CG2 3.29Å; G161-V165 PolarHBondContact O-N 3.05Å; A162-V165 PolarHBondContact O-N 2.96Å; V165-K168 PolarHBondContact O-N 3.43Å; V165-L169 HydrophobicContact CG1-CD1 3.72Å; V165-L169 WeakPolarHBondContact O-CB 3.46Å; V165-L169 WeakPolarHBondContact O-CG 3.34Å; V165-L169 PolarHBondContact O-N 2.8Å; V165-L266 HydrophobicContact CB-CD1 4.27Å; V165-L266 HydrophobicContact CG1-CD1 3.93Å; V165-I269 HydrophobicContact CG1-CG2 4.17Å; V165-I270 HydrophobicContact CB-CG2 4.21Å; V165-I270 HydrophobicContact CG1-CG2 4.08Å; V165-I270 HydrophobicContact CG2-CG2 4.05Å; V165-F319 HydrophobicContact CG2-CE1 4.28Å; V165-F319 HydrophobicContact CG2-CZ 4.07Å; V165-L365 HydrophobicContact CG2-CD1 4.03Å; V165-L369 HydrophobicContact CG2-CD1 4.42Å; V165-L369 HydrophobicContact CG2-CD2 4.45Å
166	D	98.5	Very high	97.5	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-56.6	-49.5	175.4	178.6	102.9	0	0	0	112.1	A162 L169 E170 L171 N172 I173 V174 L266	A162-D166 WeakPolarHBondContact O-CB 3.41Å; A162-D166 PolarHBondContact O-N 3.03Å; D166-L169 PolarHBondContact O-N 2.73Å; D166-E170 WeakPolarHBondContact O-CA 3.31Å; D166-E170 PolarHBondContact O-N 3.46Å; D166-L171 PolarHBondContact O-N 3.41Å; D166-L171 WeakPolarHBondContact OD1-CB 3.5Å; D166-N172 PolarHBondContact OD1-N 2.89Å; D166-N172 VanDerWaalsContact OD2-CA 3.26Å; D166-N172 WeakPolarHBondContact OD2-CA 3.38Å; D166-N172 PolarHBondContact OD2-N 3.44Å; D166-I173 WeakPolarHBondContact OD1-CG1 3.36Å; D166-I173 PolarHBondContact OD1-N 3.21Å; D166-V174 HydrophobicContact CB-CB 3.83Å; D166-V174 HydrophobicContact CB-CG2 3.69Å; D166-V174 PolarHBondContact OD1-N 3.32Å; D166-L266 HydrophobicContact CB-CD1 4.41Å
167	Q	98	Very high	97.6	Very high	88 Å²	88	23.7 Å²	23.7	41%	0.411	12%	0.116	S	C	.	.	H	α-helix	trans	-64.4	-45.7	178.9	-75.6	-175.1	-52.7	0	0	112.1	S163 L164 L169 E170	S163-Q167 WeakPolarHBondContact O-CB 3.42Å; S163-Q167 VanDerWaalsContact O-CG 3.3Å; S163-Q167 WeakPolarHBondContact O-CG 3.44Å; S163-Q167 PolarHBondContact O-N 3.1Å; S163-Q167 VanDerWaalsContact O-N 3.08Å; L164-Q167 PolarHBondContact O-N 2.87Å; Q167-L169 VanDerWaalsContact C-N 3.29Å; Q167-L169 PolarHBondContact O-N 2.99Å; Q167-E170 PolarHBondContact O-N 2.97Å; Q167-E170 VanDerWaalsContact O-N 3.12Å
168	K	97.9	Very high	97.7	Very high	46 Å²	46	25 Å²	25	20%	0.2	12%	0.122	C	C	.	.	H	α-helix	trans	-67.2	-30.6	-178.2	-151.6	-176.3	-179.7	114.1	0	112.3	L164 V165 F361 D364 L365 D368	L164-K168 WeakPolarHBondContact O-CB 3.28Å; L164-K168 PolarHBondContact O-N 3.32Å; V165-K168 PolarHBondContact O-N 3.43Å; K168-F361 HydrophobicContact CB-CZ 4.36Å; K168-F361 HydrophobicContact CD-CE2 4.23Å; K168-F361 HydrophobicContact CD-CZ 4.17Å; K168-F361 HydrophobicContact CG-CE2 3.83Å; K168-F361 HydrophobicContact CG-CZ 3.89Å; K168-F361 WeakPolarHBondContact O-CE2 3.25Å; K168-F361 WeakPolarHBondContact O-CZ 3.46Å; K168-D364 PolarHBondContact NZ-O 2.87Å; K168-L365 HydrophobicContact CB-CD1 4.47Å; K168-L365 HydrophobicContact CD-CB 3.8Å; K168-L365 HydrophobicContact CD-CD1 3.71Å; K168-L365 HydrophobicContact CD-CG 4.32Å; K168-D368 IonicContact NZ-OD2 3.65Å; K168-D368 PolarHBondContact NZ-OD2 3.16Å
169	L	97.9	Very high	97.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-87	-9.9	174	-69.5	170.6	0	0	0	113.9	V165 D166 Q167 L171 V265 I269 K355 L356 F361	V165-L169 HydrophobicContact CG1-CD1 3.72Å; V165-L169 WeakPolarHBondContact O-CB 3.46Å; V165-L169 WeakPolarHBondContact O-CG 3.34Å; V165-L169 PolarHBondContact O-N 2.8Å; D166-L169 PolarHBondContact O-N 2.73Å; Q167-L169 VanDerWaalsContact C-N 3.29Å; Q167-L169 PolarHBondContact O-N 2.99Å; L169-L171 VanDerWaalsContact C-N 3.3Å; L169-L171 HydrophobicContact CB-CD1 4.13Å; L169-L171 HydrophobicContact CB-CD2 4.24Å; L169-L171 HydrophobicContact CB-CG 3.74Å; L169-L171 HydrophobicContact CD1-CD1 4.12Å; L169-V265 HydrophobicContact CD1-CG1 4.35Å; L169-I269 HydrophobicContact CD1-CD1 3.51Å; L169-K355 VanDerWaalsContact C-NZ 3.27Å; L169-K355 HydrophobicContact CD2-CB 4.42Å; L169-K355 HydrophobicContact CD2-CD 4.28Å; L169-K355 PolarHBondContact O-NZ 3.41Å; L169-L356 HydrophobicContact CD2-CD2 3.83Å; L169-L356 HydrophobicContact CD2-CG 4.22Å; L169-F361 HydrophobicContact CD2-CE1 3.77Å; L169-F361 HydrophobicContact CD2-CZ 3.72Å; L169-F361 HydrophobicContact CG-CZ 4.34Å
170	E	98.2	Very high	97.8	Very high	108 Å²	108	25.5 Å²	25.5	51%	0.505	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	33.7	-173.9	-61.2	163.8	-117	0	0	113.7	D166 Q167 N172 L351 K355	D166-E170 WeakPolarHBondContact O-CA 3.31Å; D166-E170 PolarHBondContact O-N 3.46Å; Q167-E170 PolarHBondContact O-N 2.97Å; Q167-E170 VanDerWaalsContact O-N 3.12Å; E170-N172 PolarHBondContact O-ND2 3.48Å; E170-L351 HydrophobicContact CB-CD1 4.38Å; E170-K355 IonicContact OE1-NZ 3.01Å; E170-K355 PolarHBondContact OE1-NZ 2.56Å
171	L	97.6	Very high	97.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.134	C	C	.	.			trans	-70	-38.1	177.4	-58.2	177.7	0	0	0	111.1	D166 L169 I173 R262 V265 L266 I348 L351 V352	D166-L171 PolarHBondContact O-N 3.41Å; D166-L171 WeakPolarHBondContact OD1-CB 3.5Å; L169-L171 VanDerWaalsContact C-N 3.3Å; L169-L171 HydrophobicContact CB-CD1 4.13Å; L169-L171 HydrophobicContact CB-CD2 4.24Å; L169-L171 HydrophobicContact CB-CG 3.74Å; L169-L171 HydrophobicContact CD1-CD1 4.12Å; L171-I173 VanDerWaalsContact C-N 3.29Å; L171-I173 HydrophobicContact CB-CG1 4.17Å; L171-I173 PolarHBondContact O-N 3.34Å; L171-R262 HydrophobicContact CB-CB 4.34Å; L171-R262 HydrophobicContact CD2-CB 4.16Å; L171-R262 HydrophobicContact CD2-CG 4.12Å; L171-R262 WeakPolarHBondContact O-CD 3.46Å; L171-R262 PolarHBondContact O-NH1 3.32Å; L171-V265 HydrophobicContact CD1-CG1 4.1Å; L171-V265 HydrophobicContact CD2-CG1 4.2Å; L171-L266 HydrophobicContact CD1-CB 3.81Å; L171-L266 HydrophobicContact CD1-CD1 4.43Å; L171-I348 HydrophobicContact CD2-CD1 4.49Å; L171-L351 HydrophobicContact CD2-CD2 4.42Å; L171-V352 HydrophobicContact CD2-CG1 4.08Å
172	N	97.3	Very high	97.5	Very high	116 Å²	116	28.4 Å²	28.4	62%	0.62	14%	0.135	S	C	*	.			trans	57.3	37.4	175.2	-62.7	-81.6	0	0	0	113.6	D166 E170	D166-N172 PolarHBondContact OD1-N 2.89Å; D166-N172 VanDerWaalsContact OD2-CA 3.26Å; D166-N172 WeakPolarHBondContact OD2-CA 3.38Å; D166-N172 PolarHBondContact OD2-N 3.44Å; E170-N172 PolarHBondContact O-ND2 3.48Å
173	I	96.9	Very high	97.3	Very high	4 Å²	4	30 Å²	30	2%	0.021	15%	0.148	C	C	.	.			trans	-114.5	-23.4	177.3	57.6	168.5	0	0	0	112.9	D166 L171 P175 R262 L263 L266 L310 A311 A312	D166-I173 WeakPolarHBondContact OD1-CG1 3.36Å; D166-I173 PolarHBondContact OD1-N 3.21Å; L171-I173 VanDerWaalsContact C-N 3.29Å; L171-I173 HydrophobicContact CB-CG1 4.17Å; L171-I173 PolarHBondContact O-N 3.34Å; I173-P175 WeakPolarHBondContact O-CD 3.02Å; I173-R262 VanDerWaalsContact CD1-C 3.46Å; I173-R262 HydrophobicContact CD1-CB 3.98Å; I173-R262 HydrophobicContact CG2-CB 4.1Å; I173-L263 VanDerWaalsContact CD1-CA 3.44Å; I173-L263 HydrophobicContact CD1-CB 4.14Å; I173-L263 HydrophobicContact CD1-CD1 4.15Å; I173-L266 HydrophobicContact CD1-CB 4.35Å; I173-L266 HydrophobicContact CD1-CD2 4.06Å; I173-L266 HydrophobicContact CG1-CD2 4.34Å; I173-L310 HydrophobicContact CB-CD2 4.13Å; I173-L310 HydrophobicContact CD1-CD2 4.27Å; I173-L310 HydrophobicContact CG2-CD2 4.33Å; I173-A311 CarbonylContact O-C 3.4Å; I173-A311 VanDerWaalsContact O-CA 3.29Å; I173-A311 WeakPolarHBondContact O-CA 3.27Å; I173-A312 HydrophobicContact CD1-CB 4.12Å; I173-A312 HydrophobicContact CG1-CB 4.21Å; I173-A312 PolarHBondContact O-N 3.08Å
174	V	97.6	Very high	97.1	Very high	9 Å²	9	30 Å²	30	6%	0.055	15%	0.149	C	C	.	.	S	Bend	trans	-81.9	122	172.3	-177.9	0	0	0	0	109	D166 R176 L266 A312	D166-V174 HydrophobicContact CB-CB 3.83Å; D166-V174 HydrophobicContact CB-CG2 3.69Å; D166-V174 PolarHBondContact OD1-N 3.32Å; V174-R176 PolarHBondContact O-N 2.7Å; V174-L266 HydrophobicContact CG2-CD1 4.46Å; V174-L266 HydrophobicContact CG2-CD2 3.33Å; V174-A312 HydrophobicContact CG2-CB 4.01Å
175	P	97.6	Very high	96.7	Very high	14 Å²	14	32.6 Å²	32.6	9%	0.091	16%	0.16	C	C	.	.			trans	-59.4	128.2	170.4	-19.9	32.4	0	0	0	109.5	I173 T177 Q227 M228 V230 A311 A312 I313	I173-P175 WeakPolarHBondContact O-CD 3.02Å; P175-T177 PolarHBondContact O-N 3.15Å; P175-T177 VanDerWaalsContact O-N 3.1Å; P175-T177 PolarHBondContact O-OG1 2.85Å; P175-Q227 HydrophobicContact CB-CG 4Å; P175-M228 VanDerWaalsContact CB-O 3.27Å; P175-M228 WeakPolarHBondContact CB-O 3.46Å; P175-V230 HydrophobicContact CB-CG1 3.89Å; P175-V230 HydrophobicContact CG-CG1 3.75Å; P175-V230 HydrophobicContact CG-CG2 4.42Å; P175-A311 HydrophobicContact CG-CB 4.23Å; P175-A312 WeakPolarHBondContact CD-O 3.43Å; P175-I313 HydrophobicContact CG-CG2 4.3Å
176	R	97.5	Very high	96.3	Very high	59 Å²	59	35.5 Å²	35.5	22%	0.223	18%	0.178	C	C	.	.			trans	-43.5	120.1	-172.8	-82.2	-179.3	-71.3	-168.3	-13.7	111.6	D73 E75 F76 V174 M228	D73-R176 IonicContact OD1-NH1 3.43Å; D73-R176 PolarHBondContact OD1-NH1 3.26Å; D73-R176 VanDerWaalsContact OD1-NH1 3.08Å; D73-R176 VanDerWaalsContact OD2-CD 3.29Å; D73-R176 WeakPolarHBondContact OD2-CD 3.25Å; D73-R176 IonicContact OD2-NH1 2.73Å; E75-R176 IonicContact OE1-NH2 2.62Å; E75-R176 PolarHBondContact OE1-NH2 3.29Å; E75-R176 IonicContact OE2-CZ 2.6Å; E75-R176 VanDerWaalsContact OE2-CZ 3.23Å; E75-R176 IonicContact OE2-NH1 2.73Å; E75-R176 PolarHBondContact OE2-NH1 2.96Å; E75-R176 IonicContact OE2-NH2 3.95Å; E75-R176 PolarHBondContact OE2-NH2 3.01Å; F76-R176 HydrophobicContact CD2-CB 4.26Å; V174-R176 PolarHBondContact O-N 2.7Å; R176-M228 HydrophobicContact CB-CG 4.26Å; R176-M228 HydrophobicContact CB-SD 3.88Å; R176-M228 PolarHBondContact NE-SD 2.92Å; R176-M228 VanDerWaalsContact NE-SD 3.42Å; R176-M228 PolarHBondContact O-N 3.06Å
177	T	98.1	Very high	96.1	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.018	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.8	-174.9	-56.6	0	0	0	0	110.5	E159 S163 P175 F226 Q227	E159-T177 HydrophobicContact CB-CG2 3.94Å; S163-T177 WeakPolarHBondContact CB-O 3.37Å; S163-T177 PolarHBondContact OG-N 3.04Å; P175-T177 PolarHBondContact O-N 3.15Å; P175-T177 VanDerWaalsContact O-N 3.1Å; P175-T177 PolarHBondContact O-OG1 2.85Å; T177-F226 VanDerWaalsContact CA-O 3.27Å; T177-F226 WeakPolarHBondContact CA-O 3.39Å; T177-Q227 HydrophobicContact CG2-CB 4.01Å; T177-Q227 WeakPolarHBondContact OG1-CA 3.38Å; T177-Q227 VanDerWaalsContact OG1-CB 3.29Å; T177-Q227 WeakPolarHBondContact OG1-CB 3.37Å; T177-Q227 VanDerWaalsContact OG1-CG 3.24Å; T177-Q227 WeakPolarHBondContact OG1-CG 3.5Å; T177-Q227 PolarHBondContact OG1-NE2 3.19Å
178	K	97.8	Very high	95.7	Very high	27 Å²	27	33.8 Å²	33.8	12%	0.117	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	163.6	178.8	-59.4	-169.9	173.7	-176	0	111.8	F70 E72 D73 F76 S225 F226	F70-K178 HydrophobicContact CD1-CD 3.75Å; F70-K178 HydrophobicContact CE1-CB 4.16Å; F70-K178 HydrophobicContact CE1-CD 3.99Å; F70-K178 HydrophobicContact CG-CD 4.42Å; E72-K178 IonicContact OE1-NZ 2.74Å; E72-K178 PolarHBondContact OE1-NZ 3.27Å; D73-K178 IonicContact OD2-NZ 3.03Å; F76-K178 HydrophobicContact CD1-CD 3.93Å; F76-K178 HydrophobicContact CD1-CG 4.4Å; F76-K178 HydrophobicContact CE1-CB 3.72Å; F76-K178 HydrophobicContact CE1-CD 4.01Å; F76-K178 HydrophobicContact CE1-CG 4.07Å; F76-K178 HydrophobicContact CE2-CB 4.33Å; F76-K178 HydrophobicContact CE2-CG 4.26Å; F76-K178 HydrophobicContact CG-CD 4.26Å; F76-K178 HydrophobicContact CZ-CB 3.63Å; F76-K178 HydrophobicContact CZ-CD 4.4Å; F76-K178 HydrophobicContact CZ-CG 3.99Å; K178-S225 WeakPolarHBondContact O-CA 3.47Å; K178-F226 PolarHBondContact N-O 2.84Å; K178-F226 PolarHBondContact O-N 2.66Å
179	V	97	Very high	95.2	Very high	20 Å²	20	32.1 Å²	32.1	12%	0.121	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.3	171.6	-179.5	0	0	0	0	109	Y156 L157 A160 V223 G224 L372	Y156-V179 HydrophobicContact CD2-CG1 4.15Å; Y156-V179 HydrophobicContact CD2-CG2 4.02Å; Y156-V179 HydrophobicContact CE2-CG1 3.8Å; Y156-V179 HydrophobicContact CE2-CG2 3.97Å; L157-V179 HydrophobicContact CD2-CG2 3.95Å; A160-V179 HydrophobicContact CB-CG2 4Å; V179-V223 HydrophobicContact CG1-CG2 3.5Å; V179-G224 WeakPolarHBondContact CA-O 3.41Å; V179-L372 HydrophobicContact CG2-CD1 3.9Å
180	V	96.7	Very high	94.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151	-174.7	-179.3	0	0	0	0	109.8	N68 F70 F76 I80 F117 L182 V223 G224 F226	N68-V180 WeakPolarHBondContact OD1-CG1 3.43Å; F70-V180 HydrophobicContact CE2-CG2 4.41Å; F70-V180 HydrophobicContact CZ-CG2 3.96Å; F76-V180 HydrophobicContact CE1-CG2 3.86Å; F76-V180 HydrophobicContact CZ-CG2 3.98Å; I80-V180 HydrophobicContact CD1-CG1 4.09Å; I80-V180 HydrophobicContact CD1-CG2 3.94Å; I80-V180 HydrophobicContact CG1-CG1 4.36Å; I80-V180 HydrophobicContact CG1-CG2 4.24Å; I80-V180 HydrophobicContact CG2-CG1 3.91Å; F117-V180 HydrophobicContact CE2-CB 4.48Å; V180-L182 HydrophobicContact CG1-CD2 4.25Å; V180-L182 HydrophobicContact CG1-CG 3.98Å; V180-V223 WeakPolarHBondContact O-CA 3.28Å; V180-G224 PolarHBondContact N-O 3.47Å; V180-G224 PolarHBondContact O-N 3Å; V180-F226 HydrophobicContact CB-CB 3.89Å; V180-F226 HydrophobicContact CG2-CB 3.49Å; V180-F226 VanDerWaalsContact CG2-CB 3.49Å; V180-F226 HydrophobicContact CG2-CG 4.32Å
181	Y	95.5	Very high	94	Very high	61 Å²	61	32.4 Å²	32.4	24%	0.239	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.3	170.6	-66.1	-92.3	0	0	0	110.6	P65 H66 N68 K222 V223	P65-Y181 WeakPolarHBondContact O-CE2 3.4Å; P65-Y181 PolarHBondContact O-OH 3.42Å; H66-Y181 HydrophobicContact CB-CD1 4.1Å; H66-Y181 HydrophobicContact CB-CD2 4.31Å; H66-Y181 HydrophobicContact CB-CG 3.93Å; H66-Y181 AromaticContact ND1-CD1 3.39Å; H66-Y181 WeakPolarHBondContact ND1-CD1 3.5Å; H66-Y181 AromaticContact ND1-CE1 3.37Å; H66-Y181 WeakPolarHBondContact ND1-CE1 3.45Å; N68-Y181 PolarHBondContact ND2-O 2.73Å; N68-Y181 PolarHBondContact OD1-N 2.93Å; Y181-K222 VanDerWaalsContact CA-O 3.31Å; Y181-K222 WeakPolarHBondContact CA-O 3.23Å; Y181-V223 HydrophobicContact CD1-CB 3.94Å; Y181-V223 HydrophobicContact CD1-CG2 4.4Å; Y181-V223 HydrophobicContact CE1-CB 3.6Å; Y181-V223 HydrophobicContact CE1-CG2 3.9Å; Y181-V223 HydrophobicContact CE2-CG2 4.46Å
182	L	94.9	Very high	93.3	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146.5	174.9	-67.9	177.7	0	0	0	111.1	E84 I87 V106 F117 V180 F187 P221 K222 F226	E84-L182 HydrophobicContact CG-CD2 4.16Å; I87-L182 HydrophobicContact CD1-CD2 4.49Å; V106-L182 HydrophobicContact CG2-CD1 4.3Å; F117-L182 HydrophobicContact CB-CD1 4.43Å; F117-L182 HydrophobicContact CD1-CD1 4.25Å; F117-L182 HydrophobicContact CD2-CD1 4Å; F117-L182 HydrophobicContact CE1-CB 4.13Å; F117-L182 HydrophobicContact CE2-CD1 4.3Å; F117-L182 HydrophobicContact CE2-CG 4.43Å; F117-L182 HydrophobicContact CG-CD1 3.98Å; F117-L182 HydrophobicContact CZ-CB 4.11Å; F117-L182 HydrophobicContact CZ-CG 4.5Å; V180-L182 HydrophobicContact CG1-CD2 4.25Å; V180-L182 HydrophobicContact CG1-CG 3.98Å; L182-F187 HydrophobicContact CB-CE2 3.82Å; L182-F187 HydrophobicContact CB-CZ 4.1Å; L182-P221 CarbonylContact O-C 3.36Å; L182-P221 WeakPolarHBondContact O-CA 3.27Å; L182-K222 PolarHBondContact N-O 2.94Å; L182-K222 PolarHBondContact O-N 3.13Å; L182-F226 HydrophobicContact CD1-CD2 4.13Å; L182-F226 HydrophobicContact CD1-CE2 4.47Å
183	A	93.2	Very high	92.7	Very high	32 Å²	32	34.1 Å²	34.1	26%	0.264	19%	0.19	S	C	.	.			trans	-119.4	131.7	168.8	0	0	0	0	0	109	I87 P221	I87-A183 WeakPolarHBondContact CG2-O 3.1Å; A183-P221 HydrophobicContact CB-CG 4.36Å
184	S	93.1	Very high	92.1	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.021	20%	0.203	C	C	.	.			trans	-148.6	142.9	176.8	174.1	0	0	0	0	110.5	T186 F187 Y189	S184-T186 PolarHBondContact O-N 3.13Å; S184-T186 VanDerWaalsContact O-N 3.12Å; S184-T186 PolarHBondContact OG-N 3.32Å; S184-T186 PolarHBondContact OG-OG1 2.9Å; S184-F187 PolarHBondContact O-N 2.87Å; S184-Y189 VanDerWaalsContact O-CE2 3.31Å; S184-Y189 WeakPolarHBondContact O-CE2 3.34Å
185	E	90.1	Very high	91.4	Very high	88 Å²	88	42.1 Å²	42.1	41%	0.411	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.3	176.2	-62.3	-149.7	171.6	0	0	113.3	R194 R201 L219	E185-R194 PolarHBondContact O-NH1 3.11Å; E185-R194 VanDerWaalsContact O-NH1 3.08Å; E185-R194 PolarHBondContact O-NH2 3.32Å; E185-R201 IonicContact OE1-NH1 2.64Å; E185-L219 HydrophobicContact CB-CD1 4.44Å; E185-L219 HydrophobicContact CG-CD1 4.11Å
186	T	91.5	Very high	90.6	Very high	61 Å²	61	47.5 Å²	47.5	37%	0.374	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.8	178.6	57.6	0	0	0	0	115.1	Y92 P93 Y104 S184	Y92-T186 VanDerWaalsContact CB-CG2 3.48Å; Y92-T186 HydrophobicContact CD2-CG2 4.4Å; Y92-T186 HydrophobicContact CG-CG2 4.14Å; P93-T186 VanDerWaalsContact O-CB 3.3Å; P93-T186 WeakPolarHBondContact O-CB 3.22Å; P93-T186 PolarHBondContact O-OG1 3.37Å; Y104-T186 WeakPolarHBondContact CE1-O 3.32Å; Y104-T186 PolarHBondContact OH-O 3.5Å; S184-T186 PolarHBondContact O-N 3.13Å; S184-T186 VanDerWaalsContact O-N 3.12Å; S184-T186 PolarHBondContact OG-N 3.32Å; S184-T186 PolarHBondContact OG-OG1 2.9Å
187	F	93.1	Very high	89.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-74	156	176.7	-57.6	-27.3	0	0	0	112	P93 Y104 F117 L182 S184 Y189 R194 K222	P93-F187 HydrophobicContact CB-CE1 3.94Å; P93-F187 HydrophobicContact CB-CZ 4.45Å; P93-F187 HydrophobicContact CG-CE1 4.12Å; P93-F187 HydrophobicContact CG-CZ 4.15Å; Y104-F187 AromaticContact CD1-CD1 3.89Å; Y104-F187 HydrophobicContact CD1-CD1 3.89Å; Y104-F187 HydrophobicContact CD1-CE1 4.02Å; Y104-F187 AromaticContact CD2-CD1 3.88Å; Y104-F187 HydrophobicContact CD2-CD1 3.88Å; Y104-F187 AromaticContact CD2-CE1 3.95Å; Y104-F187 HydrophobicContact CD2-CE1 3.95Å; Y104-F187 AromaticContact CE1-CD1 3.81Å; Y104-F187 HydrophobicContact CE1-CD1 3.81Å; Y104-F187 HydrophobicContact CE1-CE1 4.41Å; Y104-F187 AromaticContact CE2-CD1 3.82Å; Y104-F187 HydrophobicContact CE2-CD1 3.82Å; Y104-F187 HydrophobicContact CE2-CE1 4.36Å; Y104-F187 AromaticContact CG-CD1 3.93Å; Y104-F187 HydrophobicContact CG-CD1 3.93Å; Y104-F187 AromaticContact CG-CE1 3.78Å; Y104-F187 HydrophobicContact CG-CE1 3.78Å; Y104-F187 AromaticContact CZ-CD1 3.79Å; F117-F187 AromaticContact CD1-CE1 3.91Å; F117-F187 HydrophobicContact CD1-CE1 3.91Å; F117-F187 HydrophobicContact CD1-CE2 4.11Å; F117-F187 AromaticContact CD1-CZ 3.49Å; F117-F187 HydrophobicContact CD1-CZ 3.49Å; F117-F187 VanDerWaalsContact CD1-CZ 3.49Å; F117-F187 HydrophobicContact CE1-CE1 4.34Å; F117-F187 AromaticContact CE1-CE2 3.78Å; F117-F187 HydrophobicContact CE1-CE2 3.78Å; F117-F187 AromaticContact CE1-CZ 3.67Å; F117-F187 HydrophobicContact CE1-CZ 3.67Å; L182-F187 HydrophobicContact CB-CE2 3.82Å; L182-F187 HydrophobicContact CB-CZ 4.1Å; S184-F187 PolarHBondContact O-N 2.87Å; F187-Y189 HydrophobicContact CB-CD2 4.18Å; F187-Y189 HydrophobicContact CB-CE2 3.71Å; F187-Y189 HydrophobicContact CD2-CE2 4.39Å; F187-Y189 WeakPolarHBondContact O-CD2 3.26Å; F187-Y189 PolarHBondContact O-N 3.25Å; F187-Y189 VanDerWaalsContact O-N 3.1Å; F187-R194 PolarHBondContact O-NH2 2.88Å; F187-K222 HydrophobicContact CB-CD 3.91Å; F187-K222 HydrophobicContact CD2-CD 3.99Å; F187-K222 HydrophobicContact CG-CD 4.25Å
188	N	89.8	Confident	88.9	Confident	54 Å²	54	52.7 Å²	52.7	29%	0.289	27%	0.274	S	S	.	.			trans	-79.4	96.9	-178.2	-166.3	19.5	0	0	0	112.2	E122 L128 K222	E122-N188 VanDerWaalsContact CD-CB 3.47Å; E122-N188 HydrophobicContact CG-CB 4.21Å; E122-N188 PolarHBondContact OE1-N 3.37Å; E122-N188 WeakPolarHBondContact OE2-CB 3.46Å; L128-N188 WeakPolarHBondContact CD1-O 3.27Å; L128-N188 PolarHBondContact O-ND2 2.87Å; N188-K222 WeakPolarHBondContact O-CE 3.47Å; N188-K222 PolarHBondContact O-NZ 3.28Å
189	Y	88.4	Confident	87.9	Confident	12 Å²	12	53.3 Å²	53.3	5%	0.047	29%	0.288	C	S	.	.			trans	-103.8	152.2	177.4	-73.4	-79.6	0	0	0	112.5	S184 F187 D193 L219 P220 K222	S184-Y189 VanDerWaalsContact O-CE2 3.31Å; S184-Y189 WeakPolarHBondContact O-CE2 3.34Å; F187-Y189 HydrophobicContact CB-CD2 4.18Å; F187-Y189 HydrophobicContact CB-CE2 3.71Å; F187-Y189 HydrophobicContact CD2-CE2 4.39Å; F187-Y189 WeakPolarHBondContact O-CD2 3.26Å; F187-Y189 PolarHBondContact O-N 3.25Å; F187-Y189 VanDerWaalsContact O-N 3.1Å; Y189-D193 HydrophobicContact CD1-CB 4.34Å; Y189-L219 HydrophobicContact CD1-CD2 4.41Å; Y189-L219 HydrophobicContact CD2-CD1 3.91Å; Y189-L219 HydrophobicContact CD2-CD2 4.03Å; Y189-L219 HydrophobicContact CD2-CG 4.4Å; Y189-L219 HydrophobicContact CE1-CB 4.4Å; Y189-L219 HydrophobicContact CE2-CB 4.03Å; Y189-L219 HydrophobicContact CE2-CD1 3.8Å; Y189-L219 HydrophobicContact CE2-CD2 4.34Å; Y189-L219 HydrophobicContact CE2-CG 4.27Å; Y189-L219 HydrophobicContact CG-CD2 4.05Å; Y189-P220 HydrophobicContact CD1-CG 4.17Å; Y189-P220 HydrophobicContact CE1-CG 3.8Å; Y189-P220 WeakPolarHBondContact CE1-O 3.49Å; Y189-P220 VanDerWaalsContact CZ-O 3.3Å; Y189-P220 PolarHBondContact OH-O 3.26Å; Y189-K222 HydrophobicContact CE1-CD 4.25Å; Y189-K222 HydrophobicContact CE1-CG 3.95Å
190	S	86.3	Confident	86.9	Confident	34 Å²	34	55.7 Å²	55.7	24%	0.238	30%	0.297	C	S	.	.			trans	-60.8	153	171.9	81.4	0	0	0	0	111.3	I192 D193 R194	S190-I192 PolarHBondContact O-N 3.07Å; S190-I192 PolarHBondContact OG-N 3.07Å; S190-D193 WeakPolarHBondContact CB-OD2 3.43Å; S190-D193 PolarHBondContact O-N 3.17Å; S190-D193 VanDerWaalsContact O-N 3.14Å; S190-D193 PolarHBondContact OG-N 3.35Å; S190-D193 VanDerWaalsContact OG-N 3.09Å; S190-D193 PolarHBondContact OG-OD2 3.45Å; S190-R194 PolarHBondContact O-N 2.95Å; S190-R194 VanDerWaalsContact O-N 3.11Å
191	A	83.7	Confident	85.9	Confident	79 Å²	79	61.4 Å²	61.4	65%	0.653	32%	0.318	S	S	*	.	H	α-helix	trans	-56.4	-36.4	174.1	0	0	0	0	0	111.7	R194 V195	A191-R194 PolarHBondContact O-N 3.18Å; A191-V195 WeakPolarHBondContact O-CG2 3.48Å; A191-V195 PolarHBondContact O-N 3.11Å
192	I	82.9	Confident	84.8	Confident	107 Å²	107	62.5 Å²	62.5	55%	0.549	33%	0.328	S	S	.	.	H	α-helix	trans	-62.9	-44.6	178	-60.7	173.7	0	0	0	110.8	S190 V195 K196	S190-I192 PolarHBondContact O-N 3.07Å; S190-I192 PolarHBondContact OG-N 3.07Å; I192-V195 PolarHBondContact O-N 3.34Å; I192-K196 HydrophobicContact CG2-CD 3.89Å; I192-K196 VanDerWaalsContact CG2-CE 3.44Å; I192-K196 HydrophobicContact CG2-CG 4.4Å; I192-K196 WeakPolarHBondContact O-CB 3.49Å; I192-K196 VanDerWaalsContact O-CG 3.27Å; I192-K196 WeakPolarHBondContact O-CG 3.43Å; I192-K196 PolarHBondContact O-N 3.44Å
193	D	84.8	Confident	83.8	Confident	46 Å²	46	63.6 Å²	63.6	25%	0.246	34%	0.337	C	S	.	.	H	α-helix	trans	-68	-39.9	179.7	-61.4	-48.1	0	0	0	111.8	Y189 S190 V195 K196 S197 P220	Y189-D193 HydrophobicContact CD1-CB 4.34Å; S190-D193 WeakPolarHBondContact CB-OD2 3.43Å; S190-D193 PolarHBondContact O-N 3.17Å; S190-D193 VanDerWaalsContact O-N 3.14Å; S190-D193 PolarHBondContact OG-N 3.35Å; S190-D193 VanDerWaalsContact OG-N 3.09Å; S190-D193 PolarHBondContact OG-OD2 3.45Å; D193-V195 PolarHBondContact O-N 3.39Å; D193-K196 PolarHBondContact O-N 3.35Å; D193-S197 WeakPolarHBondContact O-CB 3.25Å; D193-S197 PolarHBondContact O-N 3.31Å; D193-S197 PolarHBondContact O-OG 2.76Å; D193-P220 HydrophobicContact CB-CG 4.44Å
194	R	84.9	Confident	82.8	Confident	78 Å²	78	65 Å²	65	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-65	-35.3	175.2	-69.4	-173.3	175.6	-88.9	-1	112.6	E185 F187 S190 A191 S197 R198 L219	E185-R194 PolarHBondContact O-NH1 3.11Å; E185-R194 VanDerWaalsContact O-NH1 3.08Å; E185-R194 PolarHBondContact O-NH2 3.32Å; F187-R194 PolarHBondContact O-NH2 2.88Å; S190-R194 PolarHBondContact O-N 2.95Å; S190-R194 VanDerWaalsContact O-N 3.11Å; A191-R194 PolarHBondContact O-N 3.18Å; R194-S197 PolarHBondContact O-OG 3.41Å; R194-S197 VanDerWaalsContact O-OG 3.12Å; R194-R198 WeakPolarHBondContact O-CD 3.27Å; R194-R198 VanDerWaalsContact O-CG 3.27Å; R194-R198 WeakPolarHBondContact O-CG 3.46Å; R194-R198 PolarHBondContact O-N 3.12Å; R194-L219 HydrophobicContact CG-CD2 4.33Å
195	V	81.9	Confident	82	Confident	103 Å²	103	70.5 Å²	70.5	62%	0.624	37%	0.366	S	S	*	.	H	α-helix	trans	-72.9	-43.5	173.9	171.2	0	0	0	0	111.1	A191 I192 D193 S197 R198 G199	A191-V195 WeakPolarHBondContact O-CG2 3.48Å; A191-V195 PolarHBondContact O-N 3.11Å; I192-V195 PolarHBondContact O-N 3.34Å; D193-V195 PolarHBondContact O-N 3.39Å; V195-S197 PolarHBondContact O-N 3.3Å; V195-R198 PolarHBondContact O-N 2.89Å; V195-G199 PolarHBondContact O-N 2.74Å
196	K	81.3	Confident	81.5	Confident	127 Å²	127	74.1 Å²	74.1	55%	0.552	38%	0.38	S	S	*	.	H	α-helix	trans	-62.2	-41.9	178.2	-76.9	173.6	179.1	170.9	0	112.6	I192 D193 G199 K200	I192-K196 HydrophobicContact CG2-CD 3.89Å; I192-K196 VanDerWaalsContact CG2-CE 3.44Å; I192-K196 HydrophobicContact CG2-CG 4.4Å; I192-K196 WeakPolarHBondContact O-CB 3.49Å; I192-K196 VanDerWaalsContact O-CG 3.27Å; I192-K196 WeakPolarHBondContact O-CG 3.43Å; I192-K196 PolarHBondContact O-N 3.44Å; D193-K196 PolarHBondContact O-N 3.35Å; K196-G199 PolarHBondContact O-N 2.89Å; K196-K200 WeakPolarHBondContact O-CG 3.12Å; K196-K200 PolarHBondContact O-N 2.83Å
197	S	81.3	Confident	80.9	Confident	15 Å²	15	74.8 Å²	74.8	11%	0.105	38%	0.384	C	S	.	.	H	α-helix	trans	-64.1	-45.9	178.4	64.2	0	0	0	0	111.7	D193 R194 V195 K200 R201 G218 L219	D193-S197 WeakPolarHBondContact O-CB 3.25Å; D193-S197 PolarHBondContact O-N 3.31Å; D193-S197 PolarHBondContact O-OG 2.76Å; R194-S197 PolarHBondContact O-OG 3.41Å; R194-S197 VanDerWaalsContact O-OG 3.12Å; V195-S197 PolarHBondContact O-N 3.3Å; S197-K200 PolarHBondContact O-N 3.12Å; S197-R201 PolarHBondContact O-N 3.22Å; S197-G218 VanDerWaalsContact CB-C 3.49Å; S197-G218 VanDerWaalsContact CB-O 3.24Å; S197-G218 WeakPolarHBondContact CB-O 3.5Å; S197-L219 WeakPolarHBondContact OG-CD2 3.4Å
198	R	78.8	Confident	79.8	Confident	156 Å²	156	78.1 Å²	78.1	59%	0.589	41%	0.405	S	S	*	.	H	α-helix	trans	-59.7	-46.8	174.4	-70.8	173.9	175.2	-170.9	-0.3	112.2	R194 V195 K200 R201 L202	R194-R198 WeakPolarHBondContact O-CD 3.27Å; R194-R198 VanDerWaalsContact O-CG 3.27Å; R194-R198 WeakPolarHBondContact O-CG 3.46Å; R194-R198 PolarHBondContact O-N 3.12Å; V195-R198 PolarHBondContact O-N 2.89Å; R198-K200 PolarHBondContact O-N 2.69Å; R198-R201 PolarHBondContact O-N 2.79Å; R198-L202 WeakPolarHBondContact O-CG 3.41Å; R198-L202 PolarHBondContact O-N 3.31Å
199	G	76.3	Confident	78.6	Confident	40 Å²	40	83.8 Å²	83.8	41%	0.412	43%	0.427	S	S	.	.	H	α-helix	trans	-60.7	-42.4	178.4	0	0	0	0	0	112.9	V195 K196 A203	V195-G199 PolarHBondContact O-N 2.74Å; K196-G199 PolarHBondContact O-N 2.89Å; G199-A203 VanDerWaalsContact O-CB 3.3Å; G199-A203 WeakPolarHBondContact O-CB 3.27Å; G199-A203 PolarHBondContact O-N 2.98Å
200	K	76.7	Confident	77.4	Confident	69 Å²	69	86.3 Å²	86.3	30%	0.3	44%	0.444	S	S	.	.	H	α-helix	trans	-65.7	-40.9	174.7	-73.7	-179	172.5	-170.5	0	113.1	K196 S197 R198 A203 L204 F214 R216	K196-K200 WeakPolarHBondContact O-CG 3.12Å; K196-K200 PolarHBondContact O-N 2.83Å; S197-K200 PolarHBondContact O-N 3.12Å; R198-K200 PolarHBondContact O-N 2.69Å; K200-A203 PolarHBondContact O-N 2.85Å; K200-L204 PolarHBondContact O-N 3.37Å; K200-F214 HydrophobicContact CB-CD2 4.26Å; K200-F214 HydrophobicContact CB-CE2 4.4Å; K200-F214 HydrophobicContact CD-CG 4.42Å; K200-F214 HydrophobicContact CG-CD1 4.46Å; K200-F214 HydrophobicContact CG-CD2 4.17Å; K200-F214 HydrophobicContact CG-CE2 4.23Å; K200-F214 HydrophobicContact CG-CG 4.31Å; K200-F214 HydrophobicContact CG-CZ 4.4Å; K200-R216 WeakPolarHBondContact CD-O 3.26Å; K200-R216 PolarHBondContact NZ-O 3.33Å
201	R	74.9	Confident	76.1	Confident	121 Å²	121	84.7 Å²	84.7	46%	0.457	43%	0.433	S	S	.	.	H	α-helix	trans	-62.4	-49.3	177.4	-168.6	171.6	77.4	-160.2	4	110.9	E185 S197 R198 A203 L204 E205	E185-R201 IonicContact OE1-NH1 2.64Å; S197-R201 PolarHBondContact O-N 3.22Å; R198-R201 PolarHBondContact O-N 2.79Å; R201-A203 VanDerWaalsContact C-N 3.3Å; R201-A203 PolarHBondContact O-N 3.43Å; R201-L204 WeakPolarHBondContact O-CB 3.49Å; R201-L204 PolarHBondContact O-N 2.98Å; R201-L204 VanDerWaalsContact O-N 3.14Å; R201-E205 WeakPolarHBondContact CG-OE1 3.44Å; R201-E205 IonicContact NE-OE1 2.67Å; R201-E205 WeakPolarHBondContact O-CG 3.32Å; R201-E205 PolarHBondContact O-N 3.39Å
202	L	72.9	Confident	75	Confident	83 Å²	83	88.4 Å²	88.4	44%	0.435	44%	0.437	S	S	.	.	H	α-helix	trans	-60.7	-36.2	174.9	-71.8	167.5	0	0	0	112.9	R198 K206	R198-L202 WeakPolarHBondContact O-CG 3.41Å; R198-L202 PolarHBondContact O-N 3.31Å; L202-K206 VanDerWaalsContact O-CB 3.29Å; L202-K206 WeakPolarHBondContact O-CB 3.44Å; L202-K206 WeakPolarHBondContact O-CG 3.01Å; L202-K206 PolarHBondContact O-N 2.87Å
203	A	73.4	Confident	74	Confident	27 Å²	27	92.7 Å²	92.7	22%	0.223	45%	0.446	C	S	.	.	H	α-helix	trans	-70.2	-32.5	176.4	0	0	0	0	0	112.8	G199 K200 R201 V207 F214	G199-A203 VanDerWaalsContact O-CB 3.3Å; G199-A203 WeakPolarHBondContact O-CB 3.27Å; G199-A203 PolarHBondContact O-N 2.98Å; K200-A203 PolarHBondContact O-N 2.85Å; R201-A203 VanDerWaalsContact C-N 3.3Å; R201-A203 PolarHBondContact O-N 3.43Å; A203-V207 CarbonylContact O-C 3.39Å; A203-V207 VanDerWaalsContact O-C 3.24Å; A203-V207 WeakPolarHBondContact O-CA 3.39Å; A203-V207 PolarHBondContact O-N 2.86Å; A203-F214 HydrophobicContact CB-CE2 3.81Å; A203-F214 HydrophobicContact CB-CZ 4.36Å
204	L	73.4	Confident	72.8	Confident	62 Å²	62	93.8 Å²	93.8	33%	0.325	45%	0.448	S	S	.	.	H	α-helix	trans	-66.8	-50.4	169.7	-178.6	76.5	0	0	0	111.4	K200 R201 K206 P208 I217	K200-L204 PolarHBondContact O-N 3.37Å; R201-L204 WeakPolarHBondContact O-CB 3.49Å; R201-L204 PolarHBondContact O-N 2.98Å; R201-L204 VanDerWaalsContact O-N 3.14Å; L204-K206 PolarHBondContact O-N 3.05Å; L204-P208 WeakPolarHBondContact O-CA 3.47Å; L204-I217 HydrophobicContact CB-CD1 4.28Å; L204-I217 HydrophobicContact CD1-CD1 3.82Å; L204-I217 HydrophobicContact CD2-CD1 3.71Å; L204-I217 HydrophobicContact CG-CD1 4.13Å
205	E	76.8	Confident	71.3	Confident	119 Å²	119	98.9 Å²	98.9	56%	0.556	48%	0.475	S	S	*	.	H	α-helix	trans	-60.4	-43.5	-178.9	-70.6	164.8	-174.3	0	0	112	R201	R201-E205 WeakPolarHBondContact CG-OE1 3.44Å; R201-E205 IonicContact NE-OE1 2.67Å; R201-E205 WeakPolarHBondContact O-CG 3.32Å; R201-E205 PolarHBondContact O-N 3.39Å
206	K	78.4	Confident	70.3	Confident	164 Å²	164	98.4 Å²	98.4	71%	0.713	46%	0.462	S	S	*	.	H	α-helix	trans	-88.9	-31.1	-175.6	-64.9	-175.6	177.2	-171.9	0	114.3	L202 L204	L202-K206 VanDerWaalsContact O-CB 3.29Å; L202-K206 WeakPolarHBondContact O-CB 3.44Å; L202-K206 WeakPolarHBondContact O-CG 3.01Å; L202-K206 PolarHBondContact O-N 2.87Å; L204-K206 PolarHBondContact O-N 3.05Å
207	V	78.6	Confident	69.6	Low	75 Å²	75	96 Å²	96	46%	0.455	46%	0.455	S	S	.	.			trans	-140.3	78.9	-178.3	-167.3	0	0	0	0	110.3	A203 K209 V210 G211	A203-V207 CarbonylContact O-C 3.39Å; A203-V207 VanDerWaalsContact O-C 3.24Å; A203-V207 WeakPolarHBondContact O-CA 3.39Å; A203-V207 PolarHBondContact O-N 2.86Å; V207-K209 PolarHBondContact O-N 2.9Å; V207-V210 HydrophobicContact CB-CB 4.24Å; V207-V210 HydrophobicContact CB-CG2 4.34Å; V207-V210 HydrophobicContact CG1-CB 4.01Å; V207-V210 HydrophobicContact CG1-CG2 3.64Å; V207-V210 PolarHBondContact O-N 3.44Å; V207-G211 PolarHBondContact O-N 3.26Å
208	P	69.4	Low	69.5	Low	70 Å²	70	97 Å²	97	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-53	-35.6	-175	-29.8	35.6	0	0	0	114.4	L204 V210 G211 Q212	L204-P208 WeakPolarHBondContact O-CA 3.47Å; P208-V210 PolarHBondContact O-N 3.27Å; P208-G211 PolarHBondContact O-N 3.21Å; P208-Q212 WeakPolarHBondContact O-CB 3.49Å; P208-Q212 VanDerWaalsContact O-CG 3.29Å; P208-Q212 WeakPolarHBondContact O-CG 3.27Å; P208-Q212 PolarHBondContact O-N 3.36Å
209	K	65.6	Low	69.8	Low	172 Å²	172	90.7 Å²	90.7	75%	0.748	45%	0.445	S	S	*	.	H	α-helix	trans	-63.9	-22.5	176.8	-64.4	-177.1	179.1	179.5	0	114.4	V207	V207-K209 PolarHBondContact O-N 2.9Å
210	V	62.3	Low	70.4	Confident	66 Å²	66	91.6 Å²	91.6	40%	0.4	44%	0.444	S	S	.	.	H	α-helix	trans	-93.5	-40.9	172.8	175	0	0	0	0	109.9	V207 P208 Q212 R213 F214	V207-V210 HydrophobicContact CB-CB 4.24Å; V207-V210 HydrophobicContact CB-CG2 4.34Å; V207-V210 HydrophobicContact CG1-CB 4.01Å; V207-V210 HydrophobicContact CG1-CG2 3.64Å; V207-V210 PolarHBondContact O-N 3.44Å; P208-V210 PolarHBondContact O-N 3.27Å; V210-Q212 VanDerWaalsContact C-N 3.34Å; V210-Q212 PolarHBondContact O-N 2.64Å; V210-R213 WeakPolarHBondContact O-CB 3.39Å; V210-R213 PolarHBondContact O-N 3.23Å; V210-F214 HydrophobicContact CG1-CE2 4.45Å; V210-F214 HydrophobicContact CG1-CZ 4.24Å
211	G	59.9	Low	71.1	Confident	0 Å²	0	90.3 Å²	90.3	0%	0	44%	0.443	C	S	.	.	H	α-helix	trans	-56	-42.9	175.5	0	0	0	0	0	114.1	V207 P208 R213 F214	V207-G211 PolarHBondContact O-N 3.26Å; P208-G211 PolarHBondContact O-N 3.21Å; G211-R213 PolarHBondContact O-N 2.64Å; G211-R213 VanDerWaalsContact O-N 3.12Å; G211-F214 WeakPolarHBondContact O-CB 3.44Å; G211-F214 WeakPolarHBondContact O-CD2 3.35Å; G211-F214 PolarHBondContact O-N 2.67Å
212	Q	61.5	Low	72	Confident	157 Å²	157	84.9 Å²	84.9	73%	0.734	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.2	176.7	-74	171.8	-4.9	0	0	114.2	P208 V210	P208-Q212 WeakPolarHBondContact O-CB 3.49Å; P208-Q212 VanDerWaalsContact O-CG 3.29Å; P208-Q212 WeakPolarHBondContact O-CG 3.27Å; P208-Q212 PolarHBondContact O-N 3.36Å; V210-Q212 VanDerWaalsContact C-N 3.34Å; V210-Q212 PolarHBondContact O-N 2.64Å
213	R	59.9	Low	73.1	Confident	197 Å²	197	82.3 Å²	82.3	74%	0.743	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-10.2	173.5	-59.6	-179.1	179.9	-173.7	-3.5	112.9	V210 G211 H215	V210-R213 WeakPolarHBondContact O-CB 3.39Å; V210-R213 PolarHBondContact O-N 3.23Å; G211-R213 PolarHBondContact O-N 2.64Å; G211-R213 VanDerWaalsContact O-N 3.12Å; R213-H215 PolarHBondContact O-N 3.07Å
214	F	60.5	Low	74.2	Confident	68 Å²	68	81 Å²	81	30%	0.298	40%	0.399	S	S	.	.			trans	-83.3	108.8	175.3	-59.9	-50.6	0	0	0	110.5	K200 A203 V210 G211 R216 I217	K200-F214 HydrophobicContact CB-CD2 4.26Å; K200-F214 HydrophobicContact CB-CE2 4.4Å; K200-F214 HydrophobicContact CD-CG 4.42Å; K200-F214 HydrophobicContact CG-CD1 4.46Å; K200-F214 HydrophobicContact CG-CD2 4.17Å; K200-F214 HydrophobicContact CG-CE2 4.23Å; K200-F214 HydrophobicContact CG-CG 4.31Å; K200-F214 HydrophobicContact CG-CZ 4.4Å; A203-F214 HydrophobicContact CB-CE2 3.81Å; A203-F214 HydrophobicContact CB-CZ 4.36Å; V210-F214 HydrophobicContact CG1-CE2 4.45Å; V210-F214 HydrophobicContact CG1-CZ 4.24Å; G211-F214 WeakPolarHBondContact O-CB 3.44Å; G211-F214 WeakPolarHBondContact O-CD2 3.35Å; G211-F214 PolarHBondContact O-N 2.67Å; F214-R216 PolarHBondContact O-N 2.84Å; F214-I217 HydrophobicContact CB-CG1 4.28Å
215	H	52.5	Low	75.3	Confident	185 Å²	185	78.2 Å²	78.2	86%	0.856	39%	0.385	S	S	*	.	S	Bend	trans	-53.5	-21.9	172.6	-62.6	86.7	0	0	0	114.2	R213	R213-H215 PolarHBondContact O-N 3.07Å
216	R	61.7	Low	76.3	Confident	94 Å²	94	72.5 Å²	72.5	36%	0.355	36%	0.358	S	S	.	.			trans	-145.9	136.5	170.9	-64.6	-169.7	-170.3	141.5	18.3	112.3	E64 H66 K200 F214	E64-R216 IonicContact OE1-CZ 3.47Å; E64-R216 IonicContact OE1-NE 3.27Å; E64-R216 PolarHBondContact OE1-NE 3.11Å; E64-R216 IonicContact OE1-NH2 2.78Å; E64-R216 PolarHBondContact OE1-NH2 2.96Å; H66-R216 PolarHBondContact CD2-NH1 3.14Å; H66-R216 PolarHBondContact CD2-NH2 3.01Å; H66-R216 PolarHBondContact NE2-NH1 2.78Å; K200-R216 WeakPolarHBondContact CD-O 3.26Å; K200-R216 PolarHBondContact NZ-O 3.33Å; F214-R216 PolarHBondContact O-N 2.84Å
217	I	65.8	Low	77.2	Confident	76 Å²	76	65.4 Å²	65.4	39%	0.39	33%	0.328	S	S	.	.			trans	-118.1	140.7	176.9	-49.8	-174.4	0	0	0	107.2	L204 F214	L204-I217 HydrophobicContact CB-CD1 4.28Å; L204-I217 HydrophobicContact CD1-CD1 3.82Å; L204-I217 HydrophobicContact CD2-CD1 3.71Å; L204-I217 HydrophobicContact CG-CD1 4.13Å; F214-I217 HydrophobicContact CB-CG1 4.28Å
218	G	79.6	Confident	78.1	Confident	36 Å²	36	63.4 Å²	63.4	37%	0.371	31%	0.313	S	S	.	.	S	Bend	trans	97.4	-166.3	-172.4	0	0	0	0	0	114.2	S197	S197-G218 VanDerWaalsContact CB-C 3.49Å; S197-G218 VanDerWaalsContact CB-O 3.24Å; S197-G218 WeakPolarHBondContact CB-O 3.5Å
219	L	86	Confident	79.4	Confident	24 Å²	24	63.6 Å²	63.6	13%	0.126	31%	0.307	C	S	.	.	S	Bend	trans	-79.7	149.5	179	-72.2	164.1	0	0	0	111	E185 Y189 R194 S197	E185-L219 HydrophobicContact CB-CD1 4.44Å; E185-L219 HydrophobicContact CG-CD1 4.11Å; Y189-L219 HydrophobicContact CD1-CD2 4.41Å; Y189-L219 HydrophobicContact CD2-CD1 3.91Å; Y189-L219 HydrophobicContact CD2-CD2 4.03Å; Y189-L219 HydrophobicContact CD2-CG 4.4Å; Y189-L219 HydrophobicContact CE1-CB 4.4Å; Y189-L219 HydrophobicContact CE2-CB 4.03Å; Y189-L219 HydrophobicContact CE2-CD1 3.8Å; Y189-L219 HydrophobicContact CE2-CD2 4.34Å; Y189-L219 HydrophobicContact CE2-CG 4.27Å; Y189-L219 HydrophobicContact CG-CD2 4.05Å; R194-L219 HydrophobicContact CG-CD2 4.33Å; S197-L219 WeakPolarHBondContact OG-CD2 3.4Å
220	P	89.1	Confident	80.8	Confident	58 Å²	58	57.1 Å²	57.1	38%	0.377	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-69.6	131.7	179.3	25	-28.9	0	0	0	111.1	Y189 D193 K222	Y189-P220 HydrophobicContact CD1-CG 4.17Å; Y189-P220 HydrophobicContact CE1-CG 3.8Å; Y189-P220 WeakPolarHBondContact CE1-O 3.49Å; Y189-P220 VanDerWaalsContact CZ-O 3.3Å; Y189-P220 PolarHBondContact OH-O 3.26Å; D193-P220 HydrophobicContact CB-CG 4.44Å; P220-K222 PolarHBondContact O-N 3.28Å
221	P	91.9	Very high	82.2	Confident	43 Å²	43	57.9 Å²	57.9	28%	0.279	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-58.1	132.4	175.1	-25.2	34.4	0	0	0	112.2	L182 A183	L182-P221 CarbonylContact O-C 3.36Å; L182-P221 WeakPolarHBondContact O-CA 3.27Å; A183-P221 HydrophobicContact CB-CG 4.36Å
222	K	93.8	Very high	83.7	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.026	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	135.3	172.7	-69.3	-178	169.7	-138.3	0	109.5	P119 N121 E122 Y181 L182 F187 N188 Y189 P220	P119-K222 HydrophobicContact CB-CB 4.08Å; P119-K222 HydrophobicContact CB-CD 3.91Å; P119-K222 HydrophobicContact CG-CD 4.46Å; N121-K222 WeakPolarHBondContact OD1-CD 3.17Å; N121-K222 WeakPolarHBondContact OD1-CE 3.46Å; N121-K222 PolarHBondContact OD1-NZ 2.77Å; E122-K222 IonicContact OE1-NZ 2.87Å; E122-K222 PolarHBondContact OE1-NZ 2.78Å; Y181-K222 VanDerWaalsContact CA-O 3.31Å; Y181-K222 WeakPolarHBondContact CA-O 3.23Å; L182-K222 PolarHBondContact N-O 2.94Å; L182-K222 PolarHBondContact O-N 3.13Å; F187-K222 HydrophobicContact CB-CD 3.91Å; F187-K222 HydrophobicContact CD2-CD 3.99Å; F187-K222 HydrophobicContact CG-CD 4.25Å; N188-K222 WeakPolarHBondContact O-CE 3.47Å; N188-K222 PolarHBondContact O-NZ 3.28Å; Y189-K222 HydrophobicContact CE1-CD 4.25Å; Y189-K222 HydrophobicContact CE1-CG 3.95Å; P220-K222 PolarHBondContact O-N 3.28Å
223	V	95.1	Very high	85.2	Confident	30 Å²	30	55.7 Å²	55.7	18%	0.182	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	140.5	166.2	69	0	0	0	0	109.9	P119 K120 Y156 V179 V180 Y181	P119-V223 WeakPolarHBondContact CA-O 3.24Å; K120-V223 HydrophobicContact CB-CG1 3.92Å; K120-V223 HydrophobicContact CD-CG1 4.02Å; K120-V223 PolarHBondContact N-O 2.96Å; Y156-V223 HydrophobicContact CD2-CG2 4.41Å; Y156-V223 HydrophobicContact CE2-CG2 3.86Å; V179-V223 HydrophobicContact CG1-CG2 3.5Å; V180-V223 WeakPolarHBondContact O-CA 3.28Å; Y181-V223 HydrophobicContact CD1-CB 3.94Å; Y181-V223 HydrophobicContact CD1-CG2 4.4Å; Y181-V223 HydrophobicContact CE1-CB 3.6Å; Y181-V223 HydrophobicContact CE1-CG2 3.9Å; Y181-V223 HydrophobicContact CE2-CG2 4.46Å
224	G	95.4	Very high	86.7	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	178.2	175.5	0	0	0	0	0	111.7	K118 V179 V180	K118-G224 WeakPolarHBondContact O-CA 3.21Å; V179-G224 WeakPolarHBondContact CA-O 3.41Å; V180-G224 PolarHBondContact N-O 3.47Å; V180-G224 PolarHBondContact O-N 3Å
225	S	97	Very high	88.2	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.014	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	135.2	168.8	48.3	0	0	0	0	108.6	F117 K118 K178	F117-S225 VanDerWaalsContact CA-O 3.32Å; F117-S225 WeakPolarHBondContact CA-O 3.43Å; F117-S225 VanDerWaalsContact CD2-O 3.25Å; F117-S225 WeakPolarHBondContact CD2-O 3.41Å; K118-S225 PolarHBondContact N-O 3.4Å; K118-S225 PolarHBondContact O-N 3.48Å; K118-S225 VanDerWaalsContact O-N 3.14Å; K178-S225 WeakPolarHBondContact O-CA 3.47Å
226	F	98.1	Very high	90	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	114.7	168.1	-175.3	-76.2	0	0	0	107.8	F76 I79 I80 A83 V106 V116 F117 T177 K178 V180 L182	F76-F226 AromaticContact CE2-CD1 3.91Å; F76-F226 HydrophobicContact CE2-CD1 3.91Å; F76-F226 HydrophobicContact CZ-CB 4.23Å; F76-F226 AromaticContact CZ-CD1 3.77Å; F76-F226 HydrophobicContact CZ-CD1 3.77Å; F76-F226 HydrophobicContact CZ-CG 4.37Å; I79-F226 HydrophobicContact CG2-CE1 3.83Å; I79-F226 HydrophobicContact CG2-CZ 3.91Å; I80-F226 HydrophobicContact CD1-CB 4.2Å; I80-F226 HydrophobicContact CD1-CD1 3.47Å; I80-F226 VanDerWaalsContact CD1-CD1 3.47Å; I80-F226 HydrophobicContact CD1-CD2 3.68Å; I80-F226 HydrophobicContact CD1-CE1 3.62Å; I80-F226 HydrophobicContact CD1-CE2 3.8Å; I80-F226 HydrophobicContact CD1-CG 3.51Å; I80-F226 HydrophobicContact CD1-CZ 3.78Å; A83-F226 HydrophobicContact CB-CE2 4.38Å; V106-F226 HydrophobicContact CB-CE2 3.84Å; V106-F226 HydrophobicContact CB-CZ 4.49Å; V106-F226 HydrophobicContact CG1-CE2 3.89Å; V106-F226 HydrophobicContact CG2-CD2 4.3Å; V106-F226 HydrophobicContact CG2-CE2 3.89Å; V116-F226 WeakPolarHBondContact O-CA 3.3Å; F117-F226 HydrophobicContact CB-CD2 4.39Å; F117-F226 HydrophobicContact CD2-CB 4.19Å; F117-F226 HydrophobicContact CD2-CD2 4.4Å; T177-F226 VanDerWaalsContact CA-O 3.27Å; T177-F226 WeakPolarHBondContact CA-O 3.39Å; K178-F226 PolarHBondContact N-O 2.84Å; K178-F226 PolarHBondContact O-N 2.66Å; V180-F226 HydrophobicContact CB-CB 3.89Å; V180-F226 HydrophobicContact CG2-CB 3.49Å; V180-F226 VanDerWaalsContact CG2-CB 3.49Å; V180-F226 HydrophobicContact CG2-CG 4.32Å; L182-F226 HydrophobicContact CD1-CD2 4.13Å; L182-F226 HydrophobicContact CD1-CE2 4.47Å
227	Q	98.1	Very high	91.3	Very high	15 Å²	15	40.8 Å²	40.8	7%	0.07	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.6	176.3	177.2	161.3	96.6	0	0	109.1	G115 V116 P175 T177	G115-Q227 CarbonylContact C-O 3.48Å; G115-Q227 WeakPolarHBondContact CA-O 3.43Å; V116-Q227 PolarHBondContact N-O 3.17Å; V116-Q227 PolarHBondContact O-N 3.24Å; P175-Q227 HydrophobicContact CB-CG 4Å; T177-Q227 HydrophobicContact CG2-CB 4.01Å; T177-Q227 WeakPolarHBondContact OG1-CA 3.38Å; T177-Q227 VanDerWaalsContact OG1-CB 3.29Å; T177-Q227 WeakPolarHBondContact OG1-CB 3.37Å; T177-Q227 VanDerWaalsContact OG1-CG 3.24Å; T177-Q227 WeakPolarHBondContact OG1-CG 3.5Å; T177-Q227 PolarHBondContact OG1-NE2 3.19Å
228	M	97.8	Very high	92.5	Very high	32 Å²	32	40.8 Å²	40.8	16%	0.158	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	137	173.8	-70.8	-174.4	66.7	0	0	111.2	F76 I79 P175 R176	F76-M228 HydrophobicContact CD2-CG 4.06Å; F76-M228 HydrophobicContact CD2-SD 4.19Å; F76-M228 HydrophobicContact CE2-CG 4.22Å; I79-M228 HydrophobicContact CG1-CE 4.16Å; P175-M228 VanDerWaalsContact CB-O 3.27Å; P175-M228 WeakPolarHBondContact CB-O 3.46Å; R176-M228 HydrophobicContact CB-CG 4.26Å; R176-M228 HydrophobicContact CB-SD 3.88Å; R176-M228 PolarHBondContact NE-SD 2.92Å; R176-M228 VanDerWaalsContact NE-SD 3.42Å; R176-M228 PolarHBondContact O-N 3.06Å
229	F	96.2	Very high	93.1	Very high	74 Å²	74	40.5 Å²	40.5	33%	0.325	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-76.6	147.6	176.9	-172.9	-99.3	0	0	0	110.9	F105 I113 I114 V116	F105-F229 HydrophobicContact CD1-CE2 4.44Å; F105-F229 HydrophobicContact CE1-CD2 4.36Å; F105-F229 AromaticContact CE1-CE2 3.98Å; F105-F229 HydrophobicContact CE1-CE2 3.98Å; I113-F229 HydrophobicContact CB-CD1 4.28Å; I113-F229 HydrophobicContact CB-CE1 4.48Å; I113-F229 HydrophobicContact CB-CG 4.3Å; I113-F229 HydrophobicContact CG2-CB 4.01Å; I113-F229 HydrophobicContact CG2-CD1 4.11Å; I113-F229 HydrophobicContact CG2-CD2 3.59Å; I113-F229 HydrophobicContact CG2-CE2 4.05Å; I113-F229 HydrophobicContact CG2-CG 3.63Å; I113-F229 HydrophobicContact CG2-CZ 4.49Å; I114-F229 PolarHBondContact O-N 3.36Å; V116-F229 HydrophobicContact CG2-CD2 4.48Å
230	V	94.1	Very high	93.3	Very high	36 Å²	36	39.9 Å²	39.9	22%	0.218	22%	0.216	C	C	.	.			trans	-121.7	114	-177.5	-69.3	0	0	0	0	112	P175 Y233 L283 A311	P175-V230 HydrophobicContact CB-CG1 3.89Å; P175-V230 HydrophobicContact CG-CG1 3.75Å; P175-V230 HydrophobicContact CG-CG2 4.42Å; V230-Y233 HydrophobicContact CB-CD2 3.59Å; V230-Y233 HydrophobicContact CB-CE2 3.7Å; V230-Y233 HydrophobicContact CB-CG 4.37Å; V230-Y233 HydrophobicContact CG1-CE2 4.45Å; V230-Y233 HydrophobicContact CG2-CD2 3.67Å; V230-Y233 HydrophobicContact CG2-CE2 4.13Å; V230-Y233 HydrophobicContact CG2-CG 3.95Å; V230-L283 HydrophobicContact CG2-CD1 4.33Å; V230-A311 HydrophobicContact CG2-CB 4.07Å
231	D	92.3	Very high	93.3	Very high	82 Å²	82	44.7 Å²	44.7	44%	0.439	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	134.9	-175.9	-66	-60.8	0	0	0	113.4	K112 K285	K112-D231 WeakPolarHBondContact CE-OD2 3.16Å; K112-D231 IonicContact NZ-OD1 2.89Å; K112-D231 IonicContact NZ-OD2 2.69Å; K112-D231 PolarHBondContact NZ-OD2 3.39Å; D231-K285 PolarHBondContact O-NZ 3.26Å
232	G	91	Very high	93.3	Very high	58 Å²	58	48.9 Å²	48.9	60%	0.598	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.8	11.2	172.2	0	0	0	0	0	115.6
233	Y	93.7	Very high	93.2	Very high	53 Å²	53	49.9 Å²	49.9	21%	0.208	24%	0.241	C	C	.	.			trans	-86.6	155.7	173.8	-75.1	-100.6	0	0	0	111.6	V230 L283 K285 K309 A311	V230-Y233 HydrophobicContact CB-CD2 3.59Å; V230-Y233 HydrophobicContact CB-CE2 3.7Å; V230-Y233 HydrophobicContact CB-CG 4.37Å; V230-Y233 HydrophobicContact CG1-CE2 4.45Å; V230-Y233 HydrophobicContact CG2-CD2 3.67Å; V230-Y233 HydrophobicContact CG2-CE2 4.13Å; V230-Y233 HydrophobicContact CG2-CG 3.95Å; Y233-L283 HydrophobicContact CD1-CB 3.91Å; Y233-L283 HydrophobicContact CG-CB 4.28Å; Y233-K285 HydrophobicContact CD1-CB 3.52Å; Y233-K285 HydrophobicContact CD2-CB 3.92Å; Y233-K285 HydrophobicContact CD2-CD 4Å; Y233-K285 HydrophobicContact CE1-CB 3.5Å; Y233-K285 HydrophobicContact CE2-CB 3.91Å; Y233-K285 HydrophobicContact CE2-CD 3.77Å; Y233-K285 HydrophobicContact CE2-CG 4.49Å; Y233-K285 HydrophobicContact CG-CB 3.74Å; Y233-K309 HydrophobicContact CE1-CB 4.17Å; Y233-K309 WeakPolarHBondContact OH-CB 3.27Å; Y233-A311 HydrophobicContact CD1-CB 3.77Å; Y233-A311 HydrophobicContact CE1-CB 3.67Å; Y233-A311 HydrophobicContact CG-CB 4.45Å
234	K	92.1	Very high	92.8	Very high	100 Å²	100	56 Å²	56	44%	0.435	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	159.1	169.4	-62.1	-176	173.6	-172	0	110	A236 F238 L283 L284	K234-A236 PolarHBondContact O-N 3.4Å; K234-F238 HydrophobicContact CB-CD1 4.15Å; K234-F238 HydrophobicContact CD-CD1 3.56Å; K234-F238 HydrophobicContact CD-CE1 3.47Å; K234-F238 VanDerWaalsContact CD-CE1 3.47Å; K234-F238 HydrophobicContact CD-CG 4.23Å; K234-F238 HydrophobicContact CD-CZ 4.06Å; K234-L283 CarbonylContact O-C 3.43Å; K234-L283 VanDerWaalsContact O-CA 3.26Å; K234-L283 WeakPolarHBondContact O-CA 3.44Å; K234-L283 WeakPolarHBondContact O-CB 3.3Å; K234-L284 PolarHBondContact N-O 3.18Å; K234-L284 PolarHBondContact O-N 3.4Å; K234-L284 VanDerWaalsContact O-O 3.12Å
235	D	90.7	Very high	92.6	Very high	85 Å²	85	59.9 Å²	59.9	46%	0.455	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-42.7	133.1	173.4	-47.4	-1	0	0	0	110.7	D237 F238	D235-D237 PolarHBondContact O-N 3.45Å; D235-F238 WeakPolarHBondContact O-CB 3.24Å; D235-F238 PolarHBondContact O-N 3.28Å; D235-F238 VanDerWaalsContact O-N 3.16Å
236	A	90.6	Very high	92.2	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-32.8	-178.8	0	0	0	0	0	112.1	K234 F238 W239 L240 N279 W282 L284	K234-A236 PolarHBondContact O-N 3.4Å; A236-F238 VanDerWaalsContact C-N 3.29Å; A236-F238 PolarHBondContact O-N 3.04Å; A236-W239 PolarHBondContact O-N 3.36Å; A236-L240 HydrophobicContact CB-CD1 4.36Å; A236-L240 WeakPolarHBondContact O-CB 3.37Å; A236-L240 VanDerWaalsContact O-CG 3.29Å; A236-L240 WeakPolarHBondContact O-CG 3.4Å; A236-L240 PolarHBondContact O-N 3.31Å; A236-N279 CarbonylContact C-O 3.49Å; A236-N279 WeakPolarHBondContact CA-O 3.43Å; A236-N279 WeakPolarHBondContact CB-O 3.34Å; A236-N279 PolarHBondContact N-O 3.45Å; A236-W282 HydrophobicContact CB-CD2 3.4Å; A236-W282 VanDerWaalsContact CB-CE2 3.49Å; A236-W282 HydrophobicContact CB-CE3 3.36Å; A236-W282 HydrophobicContact CB-CG 4.16Å; A236-W282 HydrophobicContact CB-CH2 3.6Å; A236-W282 HydrophobicContact CB-CZ2 3.6Å; A236-W282 HydrophobicContact CB-CZ3 3.48Å; A236-W282 VanDerWaalsContact CB-CZ3 3.48Å; A236-W282 VanDerWaalsContact CB-O 3.25Å; A236-W282 WeakPolarHBondContact CB-O 3.43Å; A236-W282 PolarHBondContact N-O 3.46Å; A236-L284 HydrophobicContact CB-CD1 3.92Å; A236-L284 HydrophobicContact CB-CG 3.99Å
237	D	89.2	Confident	91.9	Very high	46 Å²	46	72.4 Å²	72.4	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-56	-41.7	176.3	-159	58.3	0	0	0	112.6	D235 W239 R241 N279	D235-D237 PolarHBondContact O-N 3.45Å; D237-W239 VanDerWaalsContact C-N 3.27Å; D237-W239 PolarHBondContact O-N 3.02Å; D237-R241 WeakPolarHBondContact O-CB 3.4Å; D237-R241 VanDerWaalsContact O-CG 3.28Å; D237-R241 WeakPolarHBondContact O-CG 3.44Å; D237-R241 PolarHBondContact O-N 3.1Å; D237-R241 VanDerWaalsContact O-N 3.11Å; D237-R241 IonicContact OD1-NE 3.75Å; D237-R241 IonicContact OD1-NH2 3.64Å; D237-R241 IonicContact OD2-CZ 3.14Å; D237-R241 IonicContact OD2-NE 2.73Å; D237-R241 PolarHBondContact OD2-NE 2.82Å; D237-R241 IonicContact OD2-NH2 2.71Å; D237-R241 PolarHBondContact OD2-NH2 2.72Å; D237-N279 HydrophobicContact CB-CB 3.53Å; D237-N279 PolarHBondContact N-O 2.89Å; D237-N279 PolarHBondContact OD1-ND2 3.35Å
238	F	90.8	Very high	91.5	Very high	76 Å²	76	72.6 Å²	72.6	33%	0.333	37%	0.369	S	S	.	.	H	α-helix	trans	-61.1	-38.1	177.2	169.3	-88.4	0	0	0	111.7	K234 D235 A236 R242	K234-F238 HydrophobicContact CB-CD1 4.15Å; K234-F238 HydrophobicContact CD-CD1 3.56Å; K234-F238 HydrophobicContact CD-CE1 3.47Å; K234-F238 VanDerWaalsContact CD-CE1 3.47Å; K234-F238 HydrophobicContact CD-CG 4.23Å; K234-F238 HydrophobicContact CD-CZ 4.06Å; D235-F238 WeakPolarHBondContact O-CB 3.24Å; D235-F238 PolarHBondContact O-N 3.28Å; D235-F238 VanDerWaalsContact O-N 3.16Å; A236-F238 VanDerWaalsContact C-N 3.29Å; A236-F238 PolarHBondContact O-N 3.04Å; F238-R242 WeakPolarHBondContact O-CG 3.43Å
239	W	91.8	Very high	91.1	Very high	30 Å²	30	74.6 Å²	74.6	11%	0.114	38%	0.384	C	S	.	.	H	α-helix	trans	-83.1	-41.4	-179.9	-76.1	115.6	0	0	0	112.7	A236 D237 R241 R242 F243 L284 Y286	A236-W239 PolarHBondContact O-N 3.36Å; D237-W239 VanDerWaalsContact C-N 3.27Å; D237-W239 PolarHBondContact O-N 3.02Å; W239-R241 PolarHBondContact O-N 3.02Å; W239-R242 WeakPolarHBondContact O-CA 3.39Å; W239-R242 WeakPolarHBondContact O-CB 3.46Å; W239-R242 PolarHBondContact O-N 3Å; W239-F243 HydrophobicContact CB-CD2 4.48Å; W239-F243 HydrophobicContact CB-CE2 3.78Å; W239-F243 HydrophobicContact CB-CZ 3.87Å; W239-F243 HydrophobicContact CD2-CZ 4.24Å; W239-F243 AromaticContact CE3-CE1 3.88Å; W239-F243 HydrophobicContact CE3-CE1 3.88Å; W239-F243 AromaticContact CE3-CZ 3.85Å; W239-F243 HydrophobicContact CE3-CZ 3.85Å; W239-F243 HydrophobicContact CG-CZ 4.32Å; W239-F243 VanDerWaalsContact O-CD2 3.29Å; W239-F243 WeakPolarHBondContact O-CD2 3.45Å; W239-F243 WeakPolarHBondContact O-CG 3.14Å; W239-F243 PolarHBondContact O-N 3.32Å; W239-L284 HydrophobicContact CB-CB 4.22Å; W239-L284 HydrophobicContact CB-CD1 4.01Å; W239-L284 VanDerWaalsContact CD1-O 3.3Å; W239-L284 HydrophobicContact CG-CB 4.1Å; W239-L284 PolarHBondContact NE1-O 3.01Å; W239-Y286 HydrophobicContact CE3-CD1 4.2Å; W239-Y286 AromaticContact CH2-CD1 4Å; W239-Y286 HydrophobicContact CH2-CD1 4Å; W239-Y286 AromaticContact CZ3-CD1 3.66Å; W239-Y286 HydrophobicContact CZ3-CD1 3.66Å; W239-Y286 HydrophobicContact CZ3-CG 4.41Å
240	L	90.4	Very high	90.8	Very high	12 Å²	12	77.5 Å²	77.5	6%	0.063	40%	0.399	C	S	.	.	H	α-helix	trans	-59.6	-46	178.2	-70.8	170	0	0	0	111.5	A236 R242 F243 E244 N279 W282 L337	A236-L240 HydrophobicContact CB-CD1 4.36Å; A236-L240 WeakPolarHBondContact O-CB 3.37Å; A236-L240 VanDerWaalsContact O-CG 3.29Å; A236-L240 WeakPolarHBondContact O-CG 3.4Å; A236-L240 PolarHBondContact O-N 3.31Å; L240-R242 PolarHBondContact O-N 2.77Å; L240-F243 PolarHBondContact O-N 3.3Å; L240-F243 VanDerWaalsContact O-N 3.08Å; L240-E244 PolarHBondContact O-N 3.31Å; L240-N279 HydrophobicContact CD1-CB 4.25Å; L240-W282 HydrophobicContact CD1-CH2 3.92Å; L240-W282 HydrophobicContact CD1-CZ2 3.83Å; L240-L337 HydrophobicContact CD1-CD1 3.93Å; L240-L337 HydrophobicContact CD1-CD2 4.03Å
241	R	90.3	Very high	90.6	Very high	158 Å²	158	80.8 Å²	80.8	60%	0.596	42%	0.415	S	S	*	.	H	α-helix	trans	-59.5	-31.9	173.9	-68.9	176.4	-163.3	-94.2	-0	113.2	D237 W239	D237-R241 WeakPolarHBondContact O-CB 3.4Å; D237-R241 VanDerWaalsContact O-CG 3.28Å; D237-R241 WeakPolarHBondContact O-CG 3.44Å; D237-R241 PolarHBondContact O-N 3.1Å; D237-R241 VanDerWaalsContact O-N 3.11Å; D237-R241 IonicContact OD1-NE 3.75Å; D237-R241 IonicContact OD1-NH2 3.64Å; D237-R241 IonicContact OD2-CZ 3.14Å; D237-R241 IonicContact OD2-NE 2.73Å; D237-R241 PolarHBondContact OD2-NE 2.82Å; D237-R241 IonicContact OD2-NH2 2.71Å; D237-R241 PolarHBondContact OD2-NH2 2.72Å; W239-R241 PolarHBondContact O-N 3.02Å
242	R	90.7	Very high	90.6	Very high	132 Å²	132	77 Å²	77	50%	0.498	40%	0.395	S	S	.	.	H	α-helix	trans	-72.3	-41.7	174.2	-75.7	175.6	137	-150.9	-11.9	111.2	F238 W239 L240 E244 A245 E246	F238-R242 WeakPolarHBondContact O-CG 3.43Å; W239-R242 WeakPolarHBondContact O-CA 3.39Å; W239-R242 WeakPolarHBondContact O-CB 3.46Å; W239-R242 PolarHBondContact O-N 3Å; L240-R242 PolarHBondContact O-N 2.77Å; R242-E244 VanDerWaalsContact C-N 3.28Å; R242-E244 PolarHBondContact O-N 2.9Å; R242-A245 PolarHBondContact O-N 2.91Å; R242-A245 VanDerWaalsContact O-N 3.12Å; R242-E246 PolarHBondContact O-N 2.7Å
243	F	91.4	Very high	90.7	Very high	27 Å²	27	77 Å²	77	12%	0.118	38%	0.381	C	S	.	.	H	α-helix	trans	-70.8	-20.9	178.7	-53.2	-29.9	0	0	0	113.6	W239 L240 E246 P247 L248 L256 L284 Y286 I308	W239-F243 HydrophobicContact CB-CD2 4.48Å; W239-F243 HydrophobicContact CB-CE2 3.78Å; W239-F243 HydrophobicContact CB-CZ 3.87Å; W239-F243 HydrophobicContact CD2-CZ 4.24Å; W239-F243 AromaticContact CE3-CE1 3.88Å; W239-F243 HydrophobicContact CE3-CE1 3.88Å; W239-F243 AromaticContact CE3-CZ 3.85Å; W239-F243 HydrophobicContact CE3-CZ 3.85Å; W239-F243 HydrophobicContact CG-CZ 4.32Å; W239-F243 VanDerWaalsContact O-CD2 3.29Å; W239-F243 WeakPolarHBondContact O-CD2 3.45Å; W239-F243 WeakPolarHBondContact O-CG 3.14Å; W239-F243 PolarHBondContact O-N 3.32Å; L240-F243 PolarHBondContact O-N 3.3Å; L240-F243 VanDerWaalsContact O-N 3.08Å; F243-E246 WeakPolarHBondContact CA-O 3.5Å; F243-E246 CarbonylContact O-C 3.51Å; F243-P247 WeakPolarHBondContact O-CA 3.36Å; F243-L248 HydrophobicContact CB-CG 4.45Å; F243-L248 HydrophobicContact CD1-CD1 4.12Å; F243-L248 HydrophobicContact CD1-CD2 3.68Å; F243-L248 HydrophobicContact CD1-CG 3.62Å; F243-L248 HydrophobicContact CD2-CD1 3.85Å; F243-L248 HydrophobicContact CD2-CG 4.21Å; F243-L248 HydrophobicContact CE1-CD1 4.09Å; F243-L248 HydrophobicContact CE1-CD2 3.47Å; F243-L248 VanDerWaalsContact CE1-CD2 3.47Å; F243-L248 HydrophobicContact CE1-CG 3.84Å; F243-L248 HydrophobicContact CE2-CD1 3.8Å; F243-L248 HydrophobicContact CE2-CG 4.38Å; F243-L248 HydrophobicContact CG-CD1 4.01Å; F243-L248 HydrophobicContact CG-CD2 4.39Å; F243-L248 HydrophobicContact CG-CG 3.84Å; F243-L248 HydrophobicContact CZ-CD1 3.93Å; F243-L248 HydrophobicContact CZ-CD2 4.01Å; F243-L248 HydrophobicContact CZ-CG 4.21Å; F243-L256 HydrophobicContact CD2-CD2 3.98Å; F243-L256 HydrophobicContact CE2-CD2 4.04Å; F243-L284 HydrophobicContact CE2-CD1 4.39Å; F243-Y286 HydrophobicContact CE1-CD1 4.08Å; F243-Y286 HydrophobicContact CE1-CE1 4.34Å; F243-Y286 HydrophobicContact CZ-CD1 4.27Å; F243-Y286 HydrophobicContact CZ-CG 4.27Å; F243-I308 HydrophobicContact CE2-CD1 3.86Å; F243-I308 HydrophobicContact CZ-CD1 3.88Å
244	E	88.1	Confident	90.7	Very high	157 Å²	157	81.2 Å²	81.2	73%	0.734	40%	0.397	S	S	*	.	H	α-helix	trans	-69.6	-34.3	167.8	-73.4	180	164.5	0	0	112.7	L240 R242	L240-E244 PolarHBondContact O-N 3.31Å; R242-E244 VanDerWaalsContact C-N 3.28Å; R242-E244 PolarHBondContact O-N 2.9Å
245	A	90	Very high	90.8	Very high	82 Å²	82	79 Å²	79	68%	0.678	39%	0.388	S	S	*	.	H	α-helix	trans	-85.9	-40.1	178.1	0	0	0	0	0	112.8	R242	R242-A245 PolarHBondContact O-N 2.91Å; R242-A245 VanDerWaalsContact O-N 3.12Å
246	E	89.5	Confident	91	Very high	158 Å²	158	75 Å²	75	74%	0.738	37%	0.367	S	S	*	.	S	Bend	trans	-126.9	89.3	-179.3	-69.8	175.6	-173.1	0	0	109	R242 F243 L248	R242-E246 PolarHBondContact O-N 2.7Å; F243-E246 WeakPolarHBondContact CA-O 3.5Å; F243-E246 CarbonylContact O-C 3.51Å; E246-L248 PolarHBondContact O-N 3.49Å
247	P	90.3	Very high	91.3	Very high	107 Å²	107	76.1 Å²	76.1	70%	0.695	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-56.1	136	-178.1	-28.2	36.4	0	0	0	113.1	F243	F243-P247 WeakPolarHBondContact O-CA 3.36Å
248	L	89.9	Confident	91.7	Very high	19 Å²	19	76 Å²	76	10%	0.099	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-62.7	146.7	176.8	-74.9	177.3	0	0	0	111.7	F243 E246 T252 N253 L256 Y286 I308	F243-L248 HydrophobicContact CB-CG 4.45Å; F243-L248 HydrophobicContact CD1-CD1 4.12Å; F243-L248 HydrophobicContact CD1-CD2 3.68Å; F243-L248 HydrophobicContact CD1-CG 3.62Å; F243-L248 HydrophobicContact CD2-CD1 3.85Å; F243-L248 HydrophobicContact CD2-CG 4.21Å; F243-L248 HydrophobicContact CE1-CD1 4.09Å; F243-L248 HydrophobicContact CE1-CD2 3.47Å; F243-L248 VanDerWaalsContact CE1-CD2 3.47Å; F243-L248 HydrophobicContact CE1-CG 3.84Å; F243-L248 HydrophobicContact CE2-CD1 3.8Å; F243-L248 HydrophobicContact CE2-CG 4.38Å; F243-L248 HydrophobicContact CG-CD1 4.01Å; F243-L248 HydrophobicContact CG-CD2 4.39Å; F243-L248 HydrophobicContact CG-CG 3.84Å; F243-L248 HydrophobicContact CZ-CD1 3.93Å; F243-L248 HydrophobicContact CZ-CD2 4.01Å; F243-L248 HydrophobicContact CZ-CG 4.21Å; E246-L248 PolarHBondContact O-N 3.49Å; L248-T252 HydrophobicContact CD1-CG2 4.08Å; L248-T252 HydrophobicContact CD2-CG2 4.03Å; L248-T252 HydrophobicContact CG-CG2 4.49Å; L248-N253 HydrophobicContact CB-CB 4.09Å; L248-L256 HydrophobicContact CD1-CB 4.44Å; L248-L256 HydrophobicContact CD1-CD2 3.85Å; L248-Y286 HydrophobicContact CD2-CE1 4.07Å; L248-Y286 HydrophobicContact CD2-CE2 3.95Å; L248-I308 HydrophobicContact CD1-CD1 4.15Å
249	P	90.9	Very high	91.9	Very high	74 Å²	74	73.9 Å²	73.9	48%	0.481	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-54.5	142.5	165.8	-22.9	33.5	0	0	0	111	N251 T252 N253	P249-N251 VanDerWaalsContact C-N 3.28Å; P249-N251 PolarHBondContact O-N 2.96Å; P249-N251 VanDerWaalsContact O-N 3.12Å; P249-T252 WeakPolarHBondContact O-CA 3.42Å; P249-T252 WeakPolarHBondContact O-CB 3.18Å; P249-T252 PolarHBondContact O-N 2.67Å; P249-N253 PolarHBondContact O-N 3.19Å
250	E	89.6	Confident	92.2	Very high	135 Å²	135	72.5 Å²	72.5	63%	0.631	36%	0.357	S	S	*	.	H	α-helix	trans	-53.7	-41	-170	-174.2	57.3	-157.7	0	0	113.6	T252 N253 R254	E250-T252 VanDerWaalsContact C-N 3.34Å; E250-T252 PolarHBondContact O-N 3.39Å; E250-N253 PolarHBondContact O-N 3.06Å; E250-R254 WeakPolarHBondContact O-CB 3.4Å; E250-R254 PolarHBondContact O-N 2.82Å
251	N	90.3	Very high	92.6	Very high	105 Å²	105	72 Å²	72	56%	0.561	35%	0.354	S	S	*	.	H	α-helix	trans	-60.3	-42	176.2	-69.4	-4.7	0	0	0	112.3	P249 Q255	P249-N251 VanDerWaalsContact C-N 3.28Å; P249-N251 PolarHBondContact O-N 2.96Å; P249-N251 VanDerWaalsContact O-N 3.12Å; N251-Q255 WeakPolarHBondContact O-CG 3.28Å; N251-Q255 PolarHBondContact O-N 2.9Å; N251-Q255 VanDerWaalsContact O-N 3.08Å
252	T	91.4	Very high	93	Very high	3 Å²	3	67.7 Å²	67.7	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-73.7	-37.6	177.4	-48.9	0	0	0	0	111.5	L248 P249 E250 R254 Q255 L256 Y286 I308	L248-T252 HydrophobicContact CD1-CG2 4.08Å; L248-T252 HydrophobicContact CD2-CG2 4.03Å; L248-T252 HydrophobicContact CG-CG2 4.49Å; P249-T252 WeakPolarHBondContact O-CA 3.42Å; P249-T252 WeakPolarHBondContact O-CB 3.18Å; P249-T252 PolarHBondContact O-N 2.67Å; E250-T252 VanDerWaalsContact C-N 3.34Å; E250-T252 PolarHBondContact O-N 3.39Å; T252-R254 VanDerWaalsContact C-N 3.32Å; T252-R254 PolarHBondContact O-N 3.39Å; T252-Q255 WeakPolarHBondContact O-CB 3.46Å; T252-Q255 PolarHBondContact O-N 2.88Å; T252-L256 PolarHBondContact O-N 2.95Å; T252-Y286 HydrophobicContact CG2-CD2 4.17Å; T252-Y286 HydrophobicContact CG2-CE2 3.62Å; T252-I308 HydrophobicContact CG2-CB 4.21Å; T252-I308 HydrophobicContact CG2-CG2 4.03Å
253	N	92.8	Very high	93.3	Very high	57 Å²	57	61.4 Å²	61.4	31%	0.305	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-41.2	174.9	-170.4	39.6	0	0	0	111	L248 P249 E250 L256 Q257	L248-N253 HydrophobicContact CB-CB 4.09Å; P249-N253 PolarHBondContact O-N 3.19Å; E250-N253 PolarHBondContact O-N 3.06Å; N253-L256 WeakPolarHBondContact O-CB 3.18Å; N253-L256 PolarHBondContact O-N 2.68Å; N253-Q257 PolarHBondContact O-N 3.45Å
254	R	94	Very high	93.5	Very high	143 Å²	143	60.1 Å²	60.1	54%	0.54	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-42.8	171	-177.1	178.1	171.6	-151.4	1.3	112.4	E250 T252 L256 Q257 L258 E347	E250-R254 WeakPolarHBondContact O-CB 3.4Å; E250-R254 PolarHBondContact O-N 2.82Å; T252-R254 VanDerWaalsContact C-N 3.32Å; T252-R254 PolarHBondContact O-N 3.39Å; R254-L256 VanDerWaalsContact C-N 3.33Å; R254-L256 PolarHBondContact O-N 2.83Å; R254-Q257 PolarHBondContact O-N 3.44Å; R254-L258 HydrophobicContact CG-CD1 4.41Å; R254-L258 WeakPolarHBondContact O-CG 3.35Å; R254-L258 PolarHBondContact O-N 2.91Å; R254-E347 IonicContact CZ-OE1 3.23Å; R254-E347 IonicContact NE-OE1 2.74Å; R254-E347 IonicContact NH2-OE1 2.81Å; R254-E347 PolarHBondContact NH2-OE1 2.71Å
255	Q	94.1	Very high	94	Very high	53 Å²	53	52.6 Å²	52.6	25%	0.248	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-42.7	173.3	-72.1	178.1	30.3	0	0	111.8	N251 T252 L258 Q259 I308	N251-Q255 WeakPolarHBondContact O-CG 3.28Å; N251-Q255 PolarHBondContact O-N 2.9Å; N251-Q255 VanDerWaalsContact O-N 3.08Å; T252-Q255 WeakPolarHBondContact O-CB 3.46Å; T252-Q255 PolarHBondContact O-N 2.88Å; Q255-L258 PolarHBondContact O-N 2.77Å; Q255-Q259 WeakPolarHBondContact O-CG 3.3Å; Q255-Q259 PolarHBondContact O-N 2.83Å; Q255-I308 HydrophobicContact CB-CG2 3.56Å
256	L	95.2	Very high	94.4	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-45.1	175.4	177.3	57.9	0	0	0	111.2	F243 L248 T252 N253 R254 L258 Q259 F260 L284 I308	F243-L256 HydrophobicContact CD2-CD2 3.98Å; F243-L256 HydrophobicContact CE2-CD2 4.04Å; L248-L256 HydrophobicContact CD1-CB 4.44Å; L248-L256 HydrophobicContact CD1-CD2 3.85Å; T252-L256 PolarHBondContact O-N 2.95Å; N253-L256 WeakPolarHBondContact O-CB 3.18Å; N253-L256 PolarHBondContact O-N 2.68Å; R254-L256 VanDerWaalsContact C-N 3.33Å; R254-L256 PolarHBondContact O-N 2.83Å; L256-L258 PolarHBondContact O-N 2.99Å; L256-Q259 PolarHBondContact O-N 2.72Å; L256-F260 VanDerWaalsContact O-CB 3.3Å; L256-F260 WeakPolarHBondContact O-CB 3.24Å; L256-F260 PolarHBondContact O-N 3.12Å; L256-L284 HydrophobicContact CD1-CD1 3.96Å; L256-L284 HydrophobicContact CD1-CD2 3.66Å; L256-L284 HydrophobicContact CD1-CG 4.5Å; L256-I308 HydrophobicContact CB-CD1 4.17Å; L256-I308 HydrophobicContact CB-CG2 4.12Å; L256-I308 HydrophobicContact CD1-CD1 3.9Å; L256-I308 HydrophobicContact CD1-CG1 4.35Å; L256-I308 HydrophobicContact CD2-CD1 4.31Å; L256-I308 HydrophobicContact CG-CD1 4.35Å
257	Q	96.9	Very high	94.7	Very high	23 Å²	23	41.2 Å²	41.2	11%	0.107	21%	0.207	C	C	.	.	H	α-helix	trans	-60.6	-44.3	176.9	-171.3	64.3	31.5	0	0	111.7	N253 R254 Q259 F260 E261 Q339 V342	N253-Q257 PolarHBondContact O-N 3.45Å; R254-Q257 PolarHBondContact O-N 3.44Å; Q257-Q259 VanDerWaalsContact C-N 3.32Å; Q257-Q259 PolarHBondContact O-N 3.1Å; Q257-F260 WeakPolarHBondContact O-CB 3.5Å; Q257-F260 PolarHBondContact O-N 2.95Å; Q257-E261 WeakPolarHBondContact O-CG 3.2Å; Q257-E261 PolarHBondContact O-N 3.26Å; Q257-Q339 PolarHBondContact NE2-O 3Å; Q257-V342 HydrophobicContact CG-CG1 4.34Å
258	L	96.8	Very high	95	Very high	42 Å²	42	36.5 Å²	36.5	22%	0.22	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-35	176.6	-70	172.5	0	0	0	112.9	R254 Q255 L256 R262 S345 E347	R254-L258 HydrophobicContact CG-CD1 4.41Å; R254-L258 WeakPolarHBondContact O-CG 3.35Å; R254-L258 PolarHBondContact O-N 2.91Å; Q255-L258 PolarHBondContact O-N 2.77Å; L256-L258 PolarHBondContact O-N 2.99Å; L258-R262 WeakPolarHBondContact O-CG 3.43Å; L258-S345 WeakPolarHBondContact CD2-OG 3.06Å; L258-E347 HydrophobicContact CD2-CB 3.85Å; L258-E347 HydrophobicContact CD2-CG 4.27Å
259	Q	96.5	Very high	95.4	Very high	32 Å²	32	35.6 Å²	35.6	15%	0.15	17%	0.17	C	C	.	.	H	α-helix	trans	-70.4	-40.3	172.7	-69	-70.6	-72.4	0	0	111.6	Q255 L256 Q257 R262 L263 L310	Q255-Q259 WeakPolarHBondContact O-CG 3.3Å; Q255-Q259 PolarHBondContact O-N 2.83Å; L256-Q259 PolarHBondContact O-N 2.72Å; Q257-Q259 VanDerWaalsContact C-N 3.32Å; Q257-Q259 PolarHBondContact O-N 3.1Å; Q259-R262 WeakPolarHBondContact O-CB 3.45Å; Q259-R262 PolarHBondContact O-N 2.64Å; Q259-L263 PolarHBondContact O-N 2.93Å; Q259-L310 HydrophobicContact CB-CB 3.81Å; Q259-L310 HydrophobicContact CB-CD1 4.29Å; Q259-L310 HydrophobicContact CG-CB 4.41Å
260	F	97.1	Very high	95.6	Very high	1 Å²	1	32.2 Å²	32.2	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-41.7	178.1	-179.8	-99	0	0	0	112.4	L256 Q257 R262 L263 V264 W282 W334 L337 Q339 A340 P408	L256-F260 VanDerWaalsContact O-CB 3.3Å; L256-F260 WeakPolarHBondContact O-CB 3.24Å; L256-F260 PolarHBondContact O-N 3.12Å; Q257-F260 WeakPolarHBondContact O-CB 3.5Å; Q257-F260 PolarHBondContact O-N 2.95Å; F260-R262 VanDerWaalsContact C-N 3.28Å; F260-R262 PolarHBondContact O-N 3.35Å; F260-L263 WeakPolarHBondContact O-CA 3.5Å; F260-L263 VanDerWaalsContact O-CB 3.3Å; F260-L263 WeakPolarHBondContact O-CB 3.47Å; F260-L263 PolarHBondContact O-N 2.92Å; F260-V264 HydrophobicContact CD1-CG2 4.1Å; F260-V264 HydrophobicContact CE1-CG2 3.72Å; F260-V264 HydrophobicContact CZ-CG2 4.05Å; F260-V264 WeakPolarHBondContact O-CG2 3.32Å; F260-V264 PolarHBondContact O-N 2.92Å; F260-W282 HydrophobicContact CD2-CH2 4.2Å; F260-W282 HydrophobicContact CE2-CH2 4.49Å; F260-W334 HydrophobicContact CE2-CB 3.73Å; F260-W334 HydrophobicContact CE2-CG 4.43Å; F260-W334 HydrophobicContact CZ-CB 3.9Å; F260-W334 HydrophobicContact CZ-CD2 4.48Å; F260-W334 HydrophobicContact CZ-CE3 4.17Å; F260-W334 HydrophobicContact CZ-CG 4.43Å; F260-L337 HydrophobicContact CE2-CD1 3.94Å; F260-L337 HydrophobicContact CZ-CD1 4.49Å; F260-Q339 HydrophobicContact CD1-CB 3.76Å; F260-Q339 HydrophobicContact CD2-CB 4.35Å; F260-Q339 HydrophobicContact CE1-CB 3.74Å; F260-Q339 HydrophobicContact CE2-CB 4.32Å; F260-Q339 HydrophobicContact CG-CB 4.07Å; F260-Q339 HydrophobicContact CZ-CB 4.02Å; F260-A340 HydrophobicContact CE1-CB 4.25Å; F260-A340 HydrophobicContact CZ-CB 4.17Å; F260-P408 HydrophobicContact CE1-CG 4.29Å
261	E	98.3	Very high	95.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-60.9	-36.6	176.1	-72.3	174.8	161.4	0	0	112.6	Q257 L263 V264 V265 F344 S345 I348	Q257-E261 WeakPolarHBondContact O-CG 3.2Å; Q257-E261 PolarHBondContact O-N 3.26Å; E261-L263 VanDerWaalsContact C-N 3.35Å; E261-V264 PolarHBondContact O-N 3.43Å; E261-V265 WeakPolarHBondContact O-CG2 3.41Å; E261-V265 PolarHBondContact O-N 2.91Å; E261-F344 HydrophobicContact CB-CD1 4.33Å; E261-F344 HydrophobicContact CG-CD1 4Å; E261-F344 HydrophobicContact CG-CE1 4.45Å; E261-F344 WeakPolarHBondContact OE1-CA 3.45Å; E261-S345 PolarHBondContact OE1-N 2.96Å; E261-S345 WeakPolarHBondContact OE2-CB 3.29Å; E261-S345 PolarHBondContact OE2-OG 2.99Å; E261-I348 HydrophobicContact CB-CB 4.22Å; E261-I348 HydrophobicContact CB-CD1 4.42Å; E261-I348 HydrophobicContact CB-CG1 4.08Å; E261-I348 HydrophobicContact CB-CG2 4.34Å; E261-I348 WeakPolarHBondContact OE2-CG2 3.33Å
262	R	98.4	Very high	95.8	Very high	67 Å²	67	22 Å²	22	25%	0.253	10%	0.096	S	C	.	.	H	α-helix	trans	-64.2	-39.9	172.9	-65	167.5	179.7	-142.2	1.1	111.5	L171 I173 L258 Q259 F260 V265 L266 I348	L171-R262 HydrophobicContact CB-CB 4.34Å; L171-R262 HydrophobicContact CD2-CB 4.16Å; L171-R262 HydrophobicContact CD2-CG 4.12Å; L171-R262 WeakPolarHBondContact O-CD 3.46Å; L171-R262 PolarHBondContact O-NH1 3.32Å; I173-R262 VanDerWaalsContact CD1-C 3.46Å; I173-R262 HydrophobicContact CD1-CB 3.98Å; I173-R262 HydrophobicContact CG2-CB 4.1Å; L258-R262 WeakPolarHBondContact O-CG 3.43Å; Q259-R262 WeakPolarHBondContact O-CB 3.45Å; Q259-R262 PolarHBondContact O-N 2.64Å; F260-R262 VanDerWaalsContact C-N 3.28Å; F260-R262 PolarHBondContact O-N 3.35Å; R262-V265 PolarHBondContact O-N 3.08Å; R262-L266 PolarHBondContact O-N 3.37Å; R262-I348 HydrophobicContact CG-CD1 3.84Å
263	L	96.9	Very high	95.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.8	-46.7	175.1	-174.1	66.1	0	0	0	111	I173 Q259 F260 E261 L266 D267 W282 L310 A312	I173-L263 VanDerWaalsContact CD1-CA 3.44Å; I173-L263 HydrophobicContact CD1-CB 4.14Å; I173-L263 HydrophobicContact CD1-CD1 4.15Å; Q259-L263 PolarHBondContact O-N 2.93Å; F260-L263 WeakPolarHBondContact O-CA 3.5Å; F260-L263 VanDerWaalsContact O-CB 3.3Å; F260-L263 WeakPolarHBondContact O-CB 3.47Å; F260-L263 PolarHBondContact O-N 2.92Å; E261-L263 VanDerWaalsContact C-N 3.35Å; L263-L266 PolarHBondContact O-N 3.45Å; L263-D267 WeakPolarHBondContact O-CB 3.33Å; L263-D267 PolarHBondContact O-N 3Å; L263-W282 HydrophobicContact CD1-CB 4.49Å; L263-W282 HydrophobicContact CD2-CB 4.11Å; L263-W282 HydrophobicContact CD2-CD2 3.57Å; L263-W282 HydrophobicContact CD2-CE3 3.86Å; L263-W282 HydrophobicContact CD2-CG 3.7Å; L263-W282 HydrophobicContact CD2-CZ3 4.47Å; L263-L310 HydrophobicContact CB-CD1 4.08Å; L263-L310 HydrophobicContact CB-CD2 4.17Å; L263-L310 HydrophobicContact CD1-CD2 3.9Å; L263-L310 HydrophobicContact CD2-CD1 4.12Å; L263-L310 HydrophobicContact CD2-CD2 4.37Å; L263-L310 HydrophobicContact CG-CD2 4.38Å; L263-A312 HydrophobicContact CD1-CB 3.66Å
264	V	96.8	Very high	94.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-58.7	-48.8	177.1	169.5	0	0	0	0	111.4	F260 E261 L266 D267 Y268 W334 F344 P408 L411	F260-V264 HydrophobicContact CD1-CG2 4.1Å; F260-V264 HydrophobicContact CE1-CG2 3.72Å; F260-V264 HydrophobicContact CZ-CG2 4.05Å; F260-V264 WeakPolarHBondContact O-CG2 3.32Å; F260-V264 PolarHBondContact O-N 2.92Å; E261-V264 PolarHBondContact O-N 3.43Å; V264-L266 PolarHBondContact O-N 2.93Å; V264-D267 PolarHBondContact O-N 3.47Å; V264-Y268 VanDerWaalsContact O-CB 3.25Å; V264-Y268 WeakPolarHBondContact O-CB 3.37Å; V264-Y268 PolarHBondContact O-N 3.42Å; V264-W334 HydrophobicContact CB-CH2 4.23Å; V264-W334 HydrophobicContact CB-CZ2 4.34Å; V264-W334 HydrophobicContact CB-CZ3 4.48Å; V264-W334 HydrophobicContact CG1-CH2 3.68Å; V264-W334 HydrophobicContact CG1-CZ2 4.16Å; V264-W334 HydrophobicContact CG1-CZ3 4.08Å; V264-W334 HydrophobicContact CG2-CD2 4.03Å; V264-W334 HydrophobicContact CG2-CE3 3.76Å; V264-W334 HydrophobicContact CG2-CH2 3.96Å; V264-W334 HydrophobicContact CG2-CZ2 4.15Å; V264-W334 HydrophobicContact CG2-CZ3 3.77Å; V264-F344 HydrophobicContact CB-CE1 4.38Å; V264-F344 HydrophobicContact CG1-CE1 3.84Å; V264-F344 HydrophobicContact CG1-CZ 3.66Å; V264-P408 HydrophobicContact CB-CB 4.49Å; V264-P408 HydrophobicContact CG1-CB 3.84Å; V264-P408 HydrophobicContact CG1-CG 4.1Å; V264-P408 HydrophobicContact CG2-CB 3.88Å; V264-P408 HydrophobicContact CG2-CG 4Å; V264-L411 HydrophobicContact CG1-CD2 4.22Å
265	V	98.4	Very high	92.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-58.1	-49.5	178.8	165.9	0	0	0	0	111	L169 L171 E261 R262 I269 I348 V352 L398	L169-V265 HydrophobicContact CD1-CG1 4.35Å; L171-V265 HydrophobicContact CD1-CG1 4.1Å; L171-V265 HydrophobicContact CD2-CG1 4.2Å; E261-V265 WeakPolarHBondContact O-CG2 3.41Å; E261-V265 PolarHBondContact O-N 2.91Å; R262-V265 PolarHBondContact O-N 3.08Å; V265-I269 HydrophobicContact CG1-CD1 3.74Å; V265-I269 WeakPolarHBondContact O-CB 3.48Å; V265-I269 VanDerWaalsContact O-CG1 3.27Å; V265-I269 WeakPolarHBondContact O-CG1 3.44Å; V265-I269 PolarHBondContact O-N 3.37Å; V265-I269 VanDerWaalsContact O-N 3.14Å; V265-I348 HydrophobicContact CG2-CD1 4.19Å; V265-I348 HydrophobicContact CG2-CG1 3.95Å; V265-V352 HydrophobicContact CG1-CG1 4.28Å; V265-V352 HydrophobicContact CG2-CG2 4.44Å; V265-L398 HydrophobicContact CB-CD2 4.5Å; V265-L398 HydrophobicContact CG1-CD2 4.07Å; V265-L398 HydrophobicContact CG2-CD1 4.39Å; V265-L398 HydrophobicContact CG2-CD2 4.33Å
266	L	97.9	Very high	90	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-57.6	-56.7	178.3	177.2	67.9	0	0	0	111.2	V165 D166 L171 I173 V174 R262 L263 V264 Y268 I269 I270 A312	V165-L266 HydrophobicContact CB-CD1 4.27Å; V165-L266 HydrophobicContact CG1-CD1 3.93Å; D166-L266 HydrophobicContact CB-CD1 4.41Å; L171-L266 HydrophobicContact CD1-CB 3.81Å; L171-L266 HydrophobicContact CD1-CD1 4.43Å; I173-L266 HydrophobicContact CD1-CB 4.35Å; I173-L266 HydrophobicContact CD1-CD2 4.06Å; I173-L266 HydrophobicContact CG1-CD2 4.34Å; V174-L266 HydrophobicContact CG2-CD1 4.46Å; V174-L266 HydrophobicContact CG2-CD2 3.33Å; R262-L266 PolarHBondContact O-N 3.37Å; L263-L266 PolarHBondContact O-N 3.45Å; V264-L266 PolarHBondContact O-N 2.93Å; L266-Y268 VanDerWaalsContact C-N 3.29Å; L266-Y268 PolarHBondContact O-N 3.29Å; L266-I269 PolarHBondContact O-N 3.48Å; L266-I270 HydrophobicContact CD1-CD1 4.46Å; L266-I270 HydrophobicContact CD1-CG2 4.25Å; L266-I270 HydrophobicContact CG-CD1 4.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.42Å; L266-I270 PolarHBondContact O-N 3.42Å; L266-I270 VanDerWaalsContact O-N 3.07Å; L266-A312 HydrophobicContact CD2-CB 3.98Å
267	D	95.8	Very high	88	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-60	-39	-174.5	-113.4	7.7	0	0	0	112.7	L263 V264 R271 N272 R277 F332 W334	L263-D267 WeakPolarHBondContact O-CB 3.33Å; L263-D267 PolarHBondContact O-N 3Å; V264-D267 PolarHBondContact O-N 3.47Å; D267-R271 CarbonylContact O-C 3.51Å; D267-R271 VanDerWaalsContact O-CA 3.27Å; D267-R271 WeakPolarHBondContact O-CA 3.45Å; D267-R271 PolarHBondContact O-N 3.01Å; D267-R271 VanDerWaalsContact O-N 3.13Å; D267-N272 HydrophobicContact CB-CB 4.42Å; D267-N272 PolarHBondContact O-N 2.92Å; D267-N272 WeakPolarHBondContact OD1-CB 3.48Å; D267-N272 PolarHBondContact OD1-ND2 3.22Å; D267-R277 IonicContact OD1-CZ 2.62Å; D267-R277 IonicContact OD1-NE 2.68Å; D267-R277 PolarHBondContact OD1-NE 2.95Å; D267-R277 IonicContact OD1-NH1 3.79Å; D267-R277 PolarHBondContact OD1-NH1 2.94Å; D267-R277 IonicContact OD1-NH2 3.62Å; D267-R277 PolarHBondContact OD1-NH2 3.22Å; D267-R277 WeakPolarHBondContact OD2-CD 3.45Å; D267-R277 IonicContact OD2-CZ 3.58Å; D267-R277 IonicContact OD2-NE 3.53Å; D267-R277 IonicContact OD2-NH1 3.89Å; D267-R277 PolarHBondContact OD2-NH1 3.14Å; D267-F332 HydrophobicContact CB-CD1 4.11Å; D267-F332 HydrophobicContact CB-CE1 3.89Å; D267-F332 WeakPolarHBondContact O-CE1 3.27Å; D267-W334 HydrophobicContact CB-CZ2 4.27Å; D267-W334 PolarHBondContact OD2-NE1 3.33Å
268	Y	97	Very high	86.1	Confident	7 Å²	7	18.2 Å²	18.2	3%	0.027	9%	0.092	C	C	.	.	H	α-helix	trans	-69.3	-48.7	-179.1	-161.9	-97.4	0	0	0	110.8	V264 L266 R271 F332 Q394 N397 L398 L411 V412	V264-Y268 VanDerWaalsContact O-CB 3.25Å; V264-Y268 WeakPolarHBondContact O-CB 3.37Å; V264-Y268 PolarHBondContact O-N 3.42Å; L266-Y268 VanDerWaalsContact C-N 3.29Å; L266-Y268 PolarHBondContact O-N 3.29Å; Y268-R271 WeakPolarHBondContact O-CA 3.3Å; Y268-R271 PolarHBondContact O-N 3.34Å; Y268-F332 AromaticContact CD2-CE2 3.94Å; Y268-F332 HydrophobicContact CD2-CE2 3.94Å; Y268-F332 HydrophobicContact CD2-CZ 4.2Å; Y268-F332 HydrophobicContact CE2-CE2 4.41Å; Y268-Q394 HydrophobicContact CD1-CB 3.93Å; Y268-Q394 HydrophobicContact CE1-CB 4.03Å; Y268-Q394 VanDerWaalsContact CE1-O 3.26Å; Y268-Q394 WeakPolarHBondContact CE1-O 3.33Å; Y268-Q394 VanDerWaalsContact O-CB 3.27Å; Y268-Q394 WeakPolarHBondContact O-CB 3.47Å; Y268-Q394 WeakPolarHBondContact O-CG 3.48Å; Y268-N397 HydrophobicContact CE1-CB 3.91Å; Y268-N397 WeakPolarHBondContact OH-CB 3.21Å; Y268-N397 PolarHBondContact OH-ND2 2.97Å; Y268-L398 HydrophobicContact CD1-CB 4Å; Y268-L398 HydrophobicContact CE1-CB 4.23Å; Y268-L411 HydrophobicContact CD1-CD1 4.1Å; Y268-L411 HydrophobicContact CD1-CD2 4.06Å; Y268-L411 HydrophobicContact CD1-CG 4.29Å; Y268-L411 HydrophobicContact CD2-CD1 4.44Å; Y268-L411 HydrophobicContact CD2-CD2 3.89Å; Y268-L411 HydrophobicContact CD2-CG 3.88Å; Y268-L411 HydrophobicContact CE1-CD1 3.52Å; Y268-L411 HydrophobicContact CE1-CD2 4.3Å; Y268-L411 HydrophobicContact CE1-CG 4.02Å; Y268-L411 HydrophobicContact CE2-CD1 3.91Å; Y268-L411 HydrophobicContact CE2-CD2 4.14Å; Y268-L411 HydrophobicContact CE2-CG 3.6Å; Y268-L411 HydrophobicContact CG-CD2 3.84Å; Y268-L411 HydrophobicContact CG-CG 4.21Å; Y268-L411 VanDerWaalsContact CZ-CD1 3.4Å; Y268-L411 PolarHBondContact OH-O 2.92Å; Y268-V412 HydrophobicContact CD2-CG1 4.3Å; Y268-V412 HydrophobicContact CE2-CG1 4.28Å
269	I	97.7	Very high	84.6	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.6	-50.2	179.5	-69.9	171.5	0	0	0	111.4	V165 L169 V265 L266 R271 L356 M391 I395 L398	V165-I269 HydrophobicContact CG1-CG2 4.17Å; L169-I269 HydrophobicContact CD1-CD1 3.51Å; V265-I269 HydrophobicContact CG1-CD1 3.74Å; V265-I269 WeakPolarHBondContact O-CB 3.48Å; V265-I269 VanDerWaalsContact O-CG1 3.27Å; V265-I269 WeakPolarHBondContact O-CG1 3.44Å; V265-I269 PolarHBondContact O-N 3.37Å; V265-I269 VanDerWaalsContact O-N 3.14Å; L266-I269 PolarHBondContact O-N 3.48Å; I269-R271 PolarHBondContact O-N 2.91Å; I269-L356 HydrophobicContact CD1-CD1 3.99Å; I269-L356 HydrophobicContact CD1-CD2 3.91Å; I269-M391 HydrophobicContact CG2-CG 4.04Å; I269-M391 HydrophobicContact CG2-SD 4.47Å; I269-I395 HydrophobicContact CG1-CG1 4.06Å; I269-I395 HydrophobicContact CG2-CD1 4.18Å; I269-I395 HydrophobicContact CG2-CG1 4.12Å; I269-L398 HydrophobicContact CD1-CD2 3.78Å; I269-L398 HydrophobicContact CG1-CD2 3.69Å
270	I	96.3	Very high	83.5	Confident	3 Å²	3	19.8 Å²	19.8	2%	0.015	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-3.9	180	73.2	-177.6	0	0	0	112.7	A162 V165 L266 N272 A318 F319	A162-I270 HydrophobicContact CB-CD1 4.05Å; V165-I270 HydrophobicContact CB-CG2 4.21Å; V165-I270 HydrophobicContact CG1-CG2 4.08Å; V165-I270 HydrophobicContact CG2-CG2 4.05Å; L266-I270 HydrophobicContact CD1-CD1 4.46Å; L266-I270 HydrophobicContact CD1-CG2 4.25Å; L266-I270 HydrophobicContact CG-CD1 4.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.42Å; L266-I270 PolarHBondContact O-N 3.42Å; L266-I270 VanDerWaalsContact O-N 3.07Å; I270-N272 HydrophobicContact CD1-CB 4.26Å; I270-N272 HydrophobicContact CG1-CB 4.09Å; I270-N272 PolarHBondContact O-N 3.31Å; I270-A318 HydrophobicContact CB-CB 4Å; I270-A318 HydrophobicContact CD1-CB 3.65Å; I270-A318 HydrophobicContact CG1-CB 3.65Å; I270-F319 HydrophobicContact CB-CE1 4.09Å; I270-F319 HydrophobicContact CB-CE2 4.08Å; I270-F319 HydrophobicContact CB-CZ 3.86Å; I270-F319 HydrophobicContact CG2-CE1 3.87Å; I270-F319 HydrophobicContact CG2-CE2 4.1Å; I270-F319 HydrophobicContact CG2-CZ 3.49Å; I270-F319 VanDerWaalsContact CG2-CZ 3.49Å; I270-F319 PolarHBondContact O-N 3.25Å
271	R	94.4	Very high	82.7	Confident	23 Å²	23	20.7 Å²	20.7	9%	0.087	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	35.9	65.9	-164.7	-174.5	45	175	124	0.3	111.3	D267 Y268 I269 T273 P320 A329 Y330 F332 V390 Q394	D267-R271 CarbonylContact O-C 3.51Å; D267-R271 VanDerWaalsContact O-CA 3.27Å; D267-R271 WeakPolarHBondContact O-CA 3.45Å; D267-R271 PolarHBondContact O-N 3.01Å; D267-R271 VanDerWaalsContact O-N 3.13Å; Y268-R271 WeakPolarHBondContact O-CA 3.3Å; Y268-R271 PolarHBondContact O-N 3.34Å; I269-R271 PolarHBondContact O-N 2.91Å; R271-T273 WeakPolarHBondContact O-CG2 3.48Å; R271-T273 PolarHBondContact O-N 2.78Å; R271-P320 HydrophobicContact CB-CG 3.87Å; R271-P320 HydrophobicContact CG-CG 3.81Å; R271-P320 WeakPolarHBondContact O-CD 3.43Å; R271-A329 PolarHBondContact NH2-O 2.9Å; R271-Y330 PolarHBondContact NH1-O 2.97Å; R271-Y330 PolarHBondContact NH2-O 3.14Å; R271-F332 VanDerWaalsContact CD-CZ 3.5Å; R271-V390 HydrophobicContact CB-CG1 4.45Å; R271-Q394 HydrophobicContact CB-CG 4.08Å; R271-Q394 VanDerWaalsContact CG-NE2 3.33Å
272	N	89.6	Confident	82.3	Confident	3 Å²	3	20.8 Å²	20.8	2%	0.016	11%	0.106	C	C	.	.			trans	-57.2	131.1	176	-160.3	-13.9	0	0	0	109.5	D267 I270 D274 R277 L317 A318 F332	D267-N272 HydrophobicContact CB-CB 4.42Å; D267-N272 PolarHBondContact O-N 2.92Å; D267-N272 WeakPolarHBondContact OD1-CB 3.48Å; D267-N272 PolarHBondContact OD1-ND2 3.22Å; I270-N272 HydrophobicContact CD1-CB 4.26Å; I270-N272 HydrophobicContact CG1-CB 4.09Å; I270-N272 PolarHBondContact O-N 3.31Å; N272-D274 PolarHBondContact OD1-N 2.85Å; N272-R277 PolarHBondContact ND2-NE 3.19Å; N272-L317 PolarHBondContact OD1-O 3.44Å; N272-A318 HydrophobicContact CB-CB 4.29Å; N272-F332 HydrophobicContact CB-CE1 4.43Å; N272-F332 WeakPolarHBondContact O-CE1 3.49Å
273	T	80.8	Confident	82.1	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.006	10%	0.1	C	C	.	.			trans	-107.7	8.5	-176.3	71	0	0	0	0	112.3	R147 L150 R271 L275 L317 P320 Y330	R147-T273 WeakPolarHBondContact CD-OG1 3.34Å; R147-T273 VanDerWaalsContact NH1-C 3.26Å; R147-T273 PolarHBondContact NH1-O 2.8Å; R147-T273 PolarHBondContact NH1-OG1 3.05Å; L150-T273 HydrophobicContact CD2-CG2 4.15Å; R271-T273 WeakPolarHBondContact O-CG2 3.48Å; R271-T273 PolarHBondContact O-N 2.78Å; T273-L275 PolarHBondContact O-N 3.29Å; T273-L317 PolarHBondContact N-O 3.24Å; T273-L317 PolarHBondContact OG1-O 2.88Å; T273-P320 HydrophobicContact CG2-CB 4.16Å; T273-P320 HydrophobicContact CG2-CG 4.06Å; T273-Y330 HydrophobicContact CG2-CD2 4.45Å
274	D	69.9	Low	82	Confident	7 Å²	7	18.7 Å²	18.7	4%	0.037	10%	0.1	C	C	.	.			trans	-62.4	111.5	-172.1	-135.9	-25.4	0	0	0	113	R147 N272 D276 R277	R147-D274 IonicContact CZ-OD1 2.66Å; R147-D274 VanDerWaalsContact NH1-CA 3.35Å; R147-D274 IonicContact NH1-OD1 3.31Å; R147-D274 IonicContact NH2-OD1 3.54Å; R147-D274 PolarHBondContact NH2-OD1 2.93Å; N272-D274 PolarHBondContact OD1-N 2.85Å; D274-D276 PolarHBondContact O-N 3.41Å; D274-D276 PolarHBondContact OD1-N 3.27Å; D274-R277 HydrophobicContact CB-CB 4.03Å; D274-R277 HydrophobicContact CB-CG 3.78Å; D274-R277 WeakPolarHBondContact O-CB 3.42Å; D274-R277 PolarHBondContact O-N 3.08Å
275	L	49.8	Very low	81.9	Confident	78 Å²	78	21 Å²	21	41%	0.408	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.2	173.7	-131.5	169.3	0	0	0	110.3	R147 T273 Y330 Y333	R147-L275 VanDerWaalsContact NH2-N 3.13Å; T273-L275 PolarHBondContact O-N 3.29Å; L275-Y330 HydrophobicContact CB-CD1 4.4Å; L275-Y330 HydrophobicContact CD1-CD1 3.93Å; L275-Y330 HydrophobicContact CD1-CE1 3.8Å; L275-Y330 HydrophobicContact CG-CD1 3.92Å; L275-Y330 HydrophobicContact CG-CE1 4.31Å; L275-Y333 WeakPolarHBondContact O-CE2 3.38Å; L275-Y333 PolarHBondContact O-OH 2.76Å; L275-Y333 VanDerWaalsContact O-OH 3.1Å
276	D	50.2	Low	81.5	Confident	96 Å²	96	22.7 Å²	22.7	51%	0.513	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	15.4	175.8	-53.2	-27.9	0	0	0	111.3	D274 G278 N281	D274-D276 PolarHBondContact O-N 3.41Å; D274-D276 PolarHBondContact OD1-N 3.27Å; D276-G278 PolarHBondContact O-N 2.87Å; D276-N281 VanDerWaalsContact O-CG 3.25Å; D276-N281 PolarHBondContact O-ND2 3.3Å
277	R	53.8	Low	80.9	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.015	14%	0.138	C	C	.	.			trans	-72.8	55.3	162	-96	-127.5	175.6	-179.6	2.7	110.5	D267 N272 D274 N281 N315 Y333	D267-R277 IonicContact OD1-CZ 2.62Å; D267-R277 IonicContact OD1-NE 2.68Å; D267-R277 PolarHBondContact OD1-NE 2.95Å; D267-R277 IonicContact OD1-NH1 3.79Å; D267-R277 PolarHBondContact OD1-NH1 2.94Å; D267-R277 IonicContact OD1-NH2 3.62Å; D267-R277 PolarHBondContact OD1-NH2 3.22Å; D267-R277 WeakPolarHBondContact OD2-CD 3.45Å; D267-R277 IonicContact OD2-CZ 3.58Å; D267-R277 IonicContact OD2-NE 3.53Å; D267-R277 IonicContact OD2-NH1 3.89Å; D267-R277 PolarHBondContact OD2-NH1 3.14Å; N272-R277 PolarHBondContact ND2-NE 3.19Å; D274-R277 HydrophobicContact CB-CB 4.03Å; D274-R277 HydrophobicContact CB-CG 3.78Å; D274-R277 WeakPolarHBondContact O-CB 3.42Å; D274-R277 PolarHBondContact O-N 3.08Å; R277-N281 HydrophobicContact CG-CB 4.04Å; R277-N315 PolarHBondContact NH2-OD1 3.33Å; R277-Y333 WeakPolarHBondContact O-CB 3.45Å; R277-Y333 WeakPolarHBondContact O-CD2 3.49Å
278	G	57	Low	79.7	Confident	15 Å²	15	29.2 Å²	29.2	16%	0.155	16%	0.155	C	C	.	.	S	Bend	trans	-66.1	-165.4	157.3	0	0	0	0	0	110.4	D276 D280	D276-G278 PolarHBondContact O-N 2.87Å; G278-D280 WeakPolarHBondContact CA-OD1 3.2Å; G278-D280 PolarHBondContact N-OD1 3.2Å; G278-D280 PolarHBondContact O-N 2.82Å; G278-D280 VanDerWaalsContact O-N 3.17Å
279	N	64.1	Low	77.9	Confident	30 Å²	30	32.4 Å²	32.4	16%	0.16	18%	0.177	C	C	.	.	S	Bend	trans	-79	12.6	176.8	-61.8	-30.8	0	0	0	112.9	A236 D237 L240	A236-N279 CarbonylContact C-O 3.49Å; A236-N279 WeakPolarHBondContact CA-O 3.43Å; A236-N279 WeakPolarHBondContact CB-O 3.34Å; A236-N279 PolarHBondContact N-O 3.45Å; D237-N279 HydrophobicContact CB-CB 3.53Å; D237-N279 PolarHBondContact N-O 2.89Å; D237-N279 PolarHBondContact OD1-ND2 3.35Å; L240-N279 HydrophobicContact CD1-CB 4.25Å
280	D	73.3	Confident	75.7	Confident	77 Å²	77	40 Å²	40	41%	0.412	21%	0.214	S	C	.	.	S	Bend	trans	-97.3	-37.3	179.2	49.2	-15.2	0	0	0	113	G278 W282	G278-D280 WeakPolarHBondContact CA-OD1 3.2Å; G278-D280 PolarHBondContact N-OD1 3.2Å; G278-D280 PolarHBondContact O-N 2.82Å; G278-D280 VanDerWaalsContact O-N 3.17Å; D280-W282 PolarHBondContact O-N 2.96Å; D280-W282 VanDerWaalsContact O-N 3.16Å
281	N	80.4	Confident	73.2	Confident	21 Å²	21	47.4 Å²	47.4	11%	0.112	25%	0.254	C	S	.	.	S	Bend	trans	-79.7	11.9	-179.4	-77.1	1.6	0	0	0	115.2	D276 R277 I313	D276-N281 VanDerWaalsContact O-CG 3.25Å; D276-N281 PolarHBondContact O-ND2 3.3Å; R277-N281 HydrophobicContact CG-CB 4.04Å; N281-I313 VanDerWaalsContact O-CG1 3.31Å; N281-I313 WeakPolarHBondContact O-CG1 3.03Å; N281-I313 VanDerWaalsContact O-O 3.13Å
282	W	90.9	Very high	70.7	Confident	3 Å²	3	52.4 Å²	52.4	1%	0.011	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	141.6	165.1	57.3	-72	0	0	0	108.5	A236 L240 F260 L263 D280 L284 L310 A311 L337	A236-W282 HydrophobicContact CB-CD2 3.4Å; A236-W282 VanDerWaalsContact CB-CE2 3.49Å; A236-W282 HydrophobicContact CB-CE3 3.36Å; A236-W282 HydrophobicContact CB-CG 4.16Å; A236-W282 HydrophobicContact CB-CH2 3.6Å; A236-W282 HydrophobicContact CB-CZ2 3.6Å; A236-W282 HydrophobicContact CB-CZ3 3.48Å; A236-W282 VanDerWaalsContact CB-CZ3 3.48Å; A236-W282 VanDerWaalsContact CB-O 3.25Å; A236-W282 WeakPolarHBondContact CB-O 3.43Å; A236-W282 PolarHBondContact N-O 3.46Å; L240-W282 HydrophobicContact CD1-CH2 3.92Å; L240-W282 HydrophobicContact CD1-CZ2 3.83Å; F260-W282 HydrophobicContact CD2-CH2 4.2Å; F260-W282 HydrophobicContact CE2-CH2 4.49Å; L263-W282 HydrophobicContact CD1-CB 4.49Å; L263-W282 HydrophobicContact CD2-CB 4.11Å; L263-W282 HydrophobicContact CD2-CD2 3.57Å; L263-W282 HydrophobicContact CD2-CE3 3.86Å; L263-W282 HydrophobicContact CD2-CG 3.7Å; L263-W282 HydrophobicContact CD2-CZ3 4.47Å; D280-W282 PolarHBondContact O-N 2.96Å; D280-W282 VanDerWaalsContact O-N 3.16Å; W282-L284 HydrophobicContact CE3-CD2 4.48Å; W282-L284 HydrophobicContact CE3-CG 4.27Å; W282-L284 HydrophobicContact CH2-CD1 4.41Å; W282-L284 HydrophobicContact CZ3-CD1 3.91Å; W282-L284 HydrophobicContact CZ3-CD2 4.03Å; W282-L284 HydrophobicContact CZ3-CG 3.89Å; W282-L310 HydrophobicContact CE3-CD1 3.47Å; W282-L310 VanDerWaalsContact CE3-CD1 3.47Å; W282-L310 HydrophobicContact CE3-CD2 4.46Å; W282-L310 HydrophobicContact CE3-CG 3.82Å; W282-L310 HydrophobicContact CZ3-CD1 3.57Å; W282-L310 HydrophobicContact CZ3-CG 4.3Å; W282-A311 WeakPolarHBondContact CA-O 3.4Å; W282-L337 HydrophobicContact CH2-CD1 4.38Å; W282-L337 HydrophobicContact CZ2-CD1 3.86Å
283	L	93.9	Very high	68.8	Low	23 Å²	23	56 Å²	56	12%	0.12	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	146.8	-172.6	-45.4	178.5	0	0	0	110.7	V230 Y233 K234 L310 A311 I313	V230-L283 HydrophobicContact CG2-CD1 4.33Å; Y233-L283 HydrophobicContact CD1-CB 3.91Å; Y233-L283 HydrophobicContact CG-CB 4.28Å; K234-L283 CarbonylContact O-C 3.43Å; K234-L283 VanDerWaalsContact O-CA 3.26Å; K234-L283 WeakPolarHBondContact O-CA 3.44Å; K234-L283 WeakPolarHBondContact O-CB 3.3Å; L283-L310 CarbonylContact O-C 3.59Å; L283-L310 WeakPolarHBondContact O-CA 3.39Å; L283-A311 HydrophobicContact CB-CB 4.31Å; L283-A311 PolarHBondContact N-O 2.79Å; L283-A311 PolarHBondContact O-N 3.15Å; L283-I313 HydrophobicContact CD1-CD1 4.01Å; L283-I313 HydrophobicContact CD1-CG2 4.38Å; L283-I313 HydrophobicContact CD2-CD1 3.81Å; L283-I313 HydrophobicContact CG-CD1 3.8Å; L283-I313 HydrophobicContact CG-CG1 4.22Å
284	L	94.3	Very high	67.1	Low	0 Å²	0	59.6 Å²	59.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.6	168.7	-72.3	171.8	0	0	0	110.3	K234 A236 W239 F243 L256 W282 I308 K309 L310	K234-L284 PolarHBondContact N-O 3.18Å; K234-L284 PolarHBondContact O-N 3.4Å; K234-L284 VanDerWaalsContact O-O 3.12Å; A236-L284 HydrophobicContact CB-CD1 3.92Å; A236-L284 HydrophobicContact CB-CG 3.99Å; W239-L284 HydrophobicContact CB-CB 4.22Å; W239-L284 HydrophobicContact CB-CD1 4.01Å; W239-L284 VanDerWaalsContact CD1-O 3.3Å; W239-L284 HydrophobicContact CG-CB 4.1Å; W239-L284 PolarHBondContact NE1-O 3.01Å; F243-L284 HydrophobicContact CE2-CD1 4.39Å; L256-L284 HydrophobicContact CD1-CD1 3.96Å; L256-L284 HydrophobicContact CD1-CD2 3.66Å; L256-L284 HydrophobicContact CD1-CG 4.5Å; W282-L284 HydrophobicContact CE3-CD2 4.48Å; W282-L284 HydrophobicContact CE3-CG 4.27Å; W282-L284 HydrophobicContact CH2-CD1 4.41Å; W282-L284 HydrophobicContact CZ3-CD1 3.91Å; W282-L284 HydrophobicContact CZ3-CD2 4.03Å; W282-L284 HydrophobicContact CZ3-CG 3.89Å; L284-I308 HydrophobicContact CD2-CG1 4.31Å; L284-K309 WeakPolarHBondContact CA-O 3.45Å; L284-L310 HydrophobicContact CD2-CB 4.06Å; L284-L310 HydrophobicContact CD2-CD1 4.3Å; L284-L310 HydrophobicContact CD2-CG 4.23Å
285	K	94.2	Very high	65.6	Low	49 Å²	49	65.5 Å²	65.5	21%	0.213	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122	165.6	176.1	168.3	-178	178.6	0	107.9	D231 Y233 D287 I308 K309	D231-K285 PolarHBondContact O-NZ 3.26Å; Y233-K285 HydrophobicContact CD1-CB 3.52Å; Y233-K285 HydrophobicContact CD2-CB 3.92Å; Y233-K285 HydrophobicContact CD2-CD 4Å; Y233-K285 HydrophobicContact CE1-CB 3.5Å; Y233-K285 HydrophobicContact CE2-CB 3.91Å; Y233-K285 HydrophobicContact CE2-CD 3.77Å; Y233-K285 HydrophobicContact CE2-CG 4.49Å; Y233-K285 HydrophobicContact CG-CB 3.74Å; K285-D287 WeakPolarHBondContact CE-OD1 3.38Å; K285-D287 WeakPolarHBondContact CE-OD2 3.26Å; K285-D287 IonicContact NZ-OD1 3Å; K285-D287 IonicContact NZ-OD2 3.08Å; K285-I308 CarbonylContact O-C 3.42Å; K285-I308 WeakPolarHBondContact O-CA 3.43Å; K285-K309 PolarHBondContact N-O 3.42Å; K285-K309 PolarHBondContact O-N 2.97Å
286	Y	91.3	Very high	65.5	Low	36 Å²	36	73.6 Å²	73.6	14%	0.141	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	102.3	177.6	176.8	-126	0	0	0	108.8	W239 F243 L248 T252 C288 P306 I308	W239-Y286 HydrophobicContact CE3-CD1 4.2Å; W239-Y286 AromaticContact CH2-CD1 4Å; W239-Y286 HydrophobicContact CH2-CD1 4Å; W239-Y286 AromaticContact CZ3-CD1 3.66Å; W239-Y286 HydrophobicContact CZ3-CD1 3.66Å; W239-Y286 HydrophobicContact CZ3-CG 4.41Å; F243-Y286 HydrophobicContact CE1-CD1 4.08Å; F243-Y286 HydrophobicContact CE1-CE1 4.34Å; F243-Y286 HydrophobicContact CZ-CD1 4.27Å; F243-Y286 HydrophobicContact CZ-CG 4.27Å; L248-Y286 HydrophobicContact CD2-CE1 4.07Å; L248-Y286 HydrophobicContact CD2-CE2 3.95Å; T252-Y286 HydrophobicContact CG2-CD2 4.17Å; T252-Y286 HydrophobicContact CG2-CE2 3.62Å; Y286-C288 HydrophobicContact CD1-CB 4.32Å; Y286-C288 HydrophobicContact CE1-CB 3.75Å; Y286-C288 PolarHBondContact O-N 3.04Å; Y286-P306 HydrophobicContact CE2-CB 3.86Å; Y286-I308 HydrophobicContact CD2-CB 4.21Å; Y286-I308 HydrophobicContact CD2-CD1 4.23Å; Y286-I308 HydrophobicContact CG-CD1 4.5Å
287	D	83.6	Confident	65.1	Low	84 Å²	84	74.8 Å²	74.8	45%	0.449	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	90.2	177.7	-70.9	-22.6	0	0	0	108.4	K285 P289 P306 I307	K285-D287 WeakPolarHBondContact CE-OD1 3.38Å; K285-D287 WeakPolarHBondContact CE-OD2 3.26Å; K285-D287 IonicContact NZ-OD1 3Å; K285-D287 IonicContact NZ-OD2 3.08Å; D287-P289 WeakPolarHBondContact O-CD 3.48Å; D287-P306 WeakPolarHBondContact O-CA 3.5Å; D287-I307 PolarHBondContact N-O 2.88Å; D287-I307 VanDerWaalsContact N-O 3.08Å
288	C	70.6	Confident	64.8	Low	54 Å²	54	81.5 Å²	81.5	37%	0.365	47%	0.472	S	S	.	.			trans	-84	119.6	172.9	-164.7	0	0	0	0	109.9	Y286 M290	Y286-C288 HydrophobicContact CD1-CB 4.32Å; Y286-C288 HydrophobicContact CE1-CB 3.75Å; Y286-C288 PolarHBondContact O-N 3.04Å; C288-M290 PolarHBondContact O-N 3.1Å
289	P	60.9	Low	64.1	Low	73 Å²	73	87.4 Å²	87.4	47%	0.474	50%	0.5	S	S	.	.			trans	-83.2	73.2	174	26.2	-16.9	0	0	0	109.7	D287 K304	D287-P289 WeakPolarHBondContact O-CD 3.48Å; P289-K304 WeakPolarHBondContact CG-O 3.46Å
290	M	50.3	Low	63.3	Low	159 Å²	159	97.6 Å²	97.6	78%	0.783	54%	0.536	S	S	*	.			trans	-111.3	110.3	164.4	-76.3	-172.3	175.8	0	0	109.2	C288	C288-M290 PolarHBondContact O-N 3.1Å
291	D	44.8	Very low	62.1	Low	159 Å²	159	99.5 Å²	99.5	85%	0.85	55%	0.551	S	S	*	*			trans	40.1	74.3	162.9	-62.8	-17.2	0	0	0	117.6	G293	D291-G293 PolarHBondContact O-N 3.46Å
292	S	42.1	Very low	60.7	Low	129 Å²	129	104.7 Å²	104.7	90%	0.902	58%	0.583	S	S	*	*			trans	-62.8	93.7	141.9	-67.9	0	0	0	0	108	G294	S292-G294 PolarHBondContact O-N 2.97Å
293	G	48.3	Very low	59	Low	78 Å²	78	110.1 Å²	110.1	80%	0.804	62%	0.616	S	S	*	*			trans	-56.8	124.4	-171.6	0	0	0	0	0	113.6	D291	D291-G293 PolarHBondContact O-N 3.46Å
294	G	45.8	Very low	57.3	Low	77 Å²	77	115.9 Å²	115.9	79%	0.794	64%	0.64	S	S	*	*			trans	104.9	79.8	167.6	0	0	0	0	0	115.9	S292	S292-G294 PolarHBondContact O-N 2.97Å
295	N	38.8	Very low	55.8	Low	130 Å²	130	121.6 Å²	121.6	70%	0.695	67%	0.667	S	S	*	*				-158.1	137.8	104.2	-161.9	19.7	0	0	0	110.8	D297	N295-D297 PolarHBondContact ND2-OD2 3Å
296	R	46	Very low	54.9	Low	248 Å²	248	120.6 Å²	120.6	94%	0.936	67%	0.665	S	S	*	*			trans	-100.1	76	171.3	-78.5	-174.2	176	178.3	-1	108.8
297	D	42.3	Very low	54.7	Low	122 Å²	122	121.9 Å²	121.9	65%	0.652	67%	0.674	S	S	*	*			trans	-114.6	132.4	165.1	-87.9	-50.2	0	0	0	110.1	N295 D299	N295-D297 PolarHBondContact ND2-OD2 3Å; D297-D299 PolarHBondContact O-N 2.85Å; D297-D299 VanDerWaalsContact O-N 3.16Å
298	T	48.4	Very low	55.1	Low	144 Å²	144	118.1 Å²	118.1	88%	0.883	65%	0.654	S	S	*	*			trans	-81.8	91.4	-175.7	48	0	0	0	0	110.6
299	D	41.5	Very low	56.2	Low	139 Å²	139	120.8 Å²	120.8	74%	0.743	66%	0.659	S	S	*	*	S	Bend	trans	-140.1	152.7	153.4	-122	-29.3	0	0	0	108.4	D297 V301	D297-D299 PolarHBondContact O-N 2.85Å; D297-D299 VanDerWaalsContact O-N 3.16Å; D299-V301 WeakPolarHBondContact O-CG2 3.21Å; D299-V301 PolarHBondContact O-N 3.05Å
300	W	46.8	Very low	57.9	Low	244 Å²	244	117.5 Å²	117.5	92%	0.924	64%	0.638	S	S	*	*			trans	-51.5	97.3	-168.6	-69.8	83.3	0	0	0	112.8	V302	W300-V302 PolarHBondContact O-N 2.93Å
301	V	49.8	Very low	60.1	Low	118 Å²	118	110 Å²	110	72%	0.715	60%	0.601	S	S	*	*			trans	-68.6	98.1	177.7	-176	0	0	0	0	107.5	D299 V303	D299-V301 WeakPolarHBondContact O-CG2 3.21Å; D299-V301 PolarHBondContact O-N 3.05Å; V301-V303 VanDerWaalsContact C-N 3.29Å; V301-V303 PolarHBondContact O-N 2.81Å
302	V	49.7	Very low	62.5	Low	129 Å²	129	102.4 Å²	102.4	78%	0.782	56%	0.561	S	S	*	*			trans	-60.2	99	166.6	178.5	0	0	0	0	106.2	W300 K304	W300-V302 PolarHBondContact O-N 2.93Å; V302-K304 PolarHBondContact O-N 3Å
303	V	54.8	Low	64.9	Low	117 Å²	117	98 Å²	98	71%	0.709	53%	0.527	S	S	*	.			trans	-64	92	172.6	-178.8	0	0	0	0	106.1	V301 E305	V301-V303 VanDerWaalsContact C-N 3.29Å; V301-V303 PolarHBondContact O-N 2.81Å; V303-E305 PolarHBondContact O-N 2.74Å; V303-E305 VanDerWaalsContact O-N 3.14Å
304	K	58.2	Low	66.9	Low	145 Å²	145	96.6 Å²	96.6	63%	0.63	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-57.9	120.2	179.5	-170.7	176.4	-174.7	179	0	106.8	P289 V302	P289-K304 WeakPolarHBondContact CG-O 3.46Å; V302-K304 PolarHBondContact O-N 3Å
305	E	62.7	Low	69.1	Low	119 Å²	119	92.9 Å²	92.9	56%	0.556	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-56.9	136.8	-179	-66	-168.7	155.7	0	0	109.7	V303 I307	V303-E305 PolarHBondContact O-N 2.74Å; V303-E305 VanDerWaalsContact O-N 3.14Å; E305-I307 WeakPolarHBondContact O-CG1 3.29Å; E305-I307 PolarHBondContact O-N 3.31Å; E305-I307 VanDerWaalsContact O-N 3.16Å
306	P	77	Confident	71.6	Confident	28 Å²	28	87.2 Å²	87.2	18%	0.182	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-63	119.6	-179.5	25	-33.9	0	0	0	110	Y286 D287	Y286-P306 HydrophobicContact CE2-CB 3.86Å; D287-P306 WeakPolarHBondContact O-CA 3.5Å
307	I	85.9	Confident	73.7	Confident	64 Å²	64	77.5 Å²	77.5	33%	0.328	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128	-175	-53.6	-178.6	0	0	0	108.9	D287 E305 K309	D287-I307 PolarHBondContact N-O 2.88Å; D287-I307 VanDerWaalsContact N-O 3.08Å; E305-I307 WeakPolarHBondContact O-CG1 3.29Å; E305-I307 PolarHBondContact O-N 3.31Å; E305-I307 VanDerWaalsContact O-N 3.16Å; I307-K309 HydrophobicContact CG2-CG 4.06Å
308	I	92.4	Very high	76.1	Confident	5 Å²	5	72 Å²	72	3%	0.026	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	134.2	168.8	-166.5	152.6	0	0	0	110.9	F243 L248 T252 Q255 L256 L284 K285 Y286	F243-I308 HydrophobicContact CE2-CD1 3.86Å; F243-I308 HydrophobicContact CZ-CD1 3.88Å; L248-I308 HydrophobicContact CD1-CD1 4.15Å; T252-I308 HydrophobicContact CG2-CB 4.21Å; T252-I308 HydrophobicContact CG2-CG2 4.03Å; Q255-I308 HydrophobicContact CB-CG2 3.56Å; L256-I308 HydrophobicContact CB-CD1 4.17Å; L256-I308 HydrophobicContact CB-CG2 4.12Å; L256-I308 HydrophobicContact CD1-CD1 3.9Å; L256-I308 HydrophobicContact CD1-CG1 4.35Å; L256-I308 HydrophobicContact CD2-CD1 4.31Å; L256-I308 HydrophobicContact CG-CD1 4.35Å; L284-I308 HydrophobicContact CD2-CG1 4.31Å; K285-I308 CarbonylContact O-C 3.42Å; K285-I308 WeakPolarHBondContact O-CA 3.43Å; Y286-I308 HydrophobicContact CD2-CB 4.21Å; Y286-I308 HydrophobicContact CD2-CD1 4.23Å; Y286-I308 HydrophobicContact CG-CD1 4.5Å
309	K	94.5	Very high	78.3	Confident	109 Å²	109	65.6 Å²	65.6	47%	0.474	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.5	178.3	-65.2	-167.5	176.7	-169.4	0	111.1	Y233 L284 K285 I307	Y233-K309 HydrophobicContact CE1-CB 4.17Å; Y233-K309 WeakPolarHBondContact OH-CB 3.27Å; L284-K309 WeakPolarHBondContact CA-O 3.45Å; K285-K309 PolarHBondContact N-O 3.42Å; K285-K309 PolarHBondContact O-N 2.97Å; I307-K309 HydrophobicContact CG2-CG 4.06Å
310	L	95.5	Very high	80.8	Confident	4 Å²	4	59 Å²	59	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.6	178.2	-169.8	154.3	0	0	0	110.3	I173 Q259 L263 W282 L283 L284 A312	I173-L310 HydrophobicContact CB-CD2 4.13Å; I173-L310 HydrophobicContact CD1-CD2 4.27Å; I173-L310 HydrophobicContact CG2-CD2 4.33Å; Q259-L310 HydrophobicContact CB-CB 3.81Å; Q259-L310 HydrophobicContact CB-CD1 4.29Å; Q259-L310 HydrophobicContact CG-CB 4.41Å; L263-L310 HydrophobicContact CB-CD1 4.08Å; L263-L310 HydrophobicContact CB-CD2 4.17Å; L263-L310 HydrophobicContact CD1-CD2 3.9Å; L263-L310 HydrophobicContact CD2-CD1 4.12Å; L263-L310 HydrophobicContact CD2-CD2 4.37Å; L263-L310 HydrophobicContact CG-CD2 4.38Å; W282-L310 HydrophobicContact CE3-CD1 3.47Å; W282-L310 VanDerWaalsContact CE3-CD1 3.47Å; W282-L310 HydrophobicContact CE3-CD2 4.46Å; W282-L310 HydrophobicContact CE3-CG 3.82Å; W282-L310 HydrophobicContact CZ3-CD1 3.57Å; W282-L310 HydrophobicContact CZ3-CG 4.3Å; L283-L310 CarbonylContact O-C 3.59Å; L283-L310 WeakPolarHBondContact O-CA 3.39Å; L284-L310 HydrophobicContact CD2-CB 4.06Å; L284-L310 HydrophobicContact CD2-CD1 4.3Å; L284-L310 HydrophobicContact CD2-CG 4.23Å; L310-A312 HydrophobicContact CD2-CB 4.35Å
311	A	96.6	Very high	82.9	Confident	2 Å²	2	49 Å²	49	2%	0.017	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	116.9	170	0	0	0	0	0	110.5	I173 P175 V230 Y233 W282 L283 I313	I173-A311 CarbonylContact O-C 3.4Å; I173-A311 VanDerWaalsContact O-CA 3.29Å; I173-A311 WeakPolarHBondContact O-CA 3.27Å; P175-A311 HydrophobicContact CG-CB 4.23Å; V230-A311 HydrophobicContact CG2-CB 4.07Å; Y233-A311 HydrophobicContact CD1-CB 3.77Å; Y233-A311 HydrophobicContact CE1-CB 3.67Å; Y233-A311 HydrophobicContact CG-CB 4.45Å; W282-A311 WeakPolarHBondContact CA-O 3.4Å; L283-A311 HydrophobicContact CB-CB 4.31Å; L283-A311 PolarHBondContact N-O 2.79Å; L283-A311 PolarHBondContact O-N 3.15Å; A311-I313 PolarHBondContact O-N 3.42Å
312	A	95.6	Very high	84.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	103.3	177.8	0	0	0	0	0	110.1	I173 V174 P175 L263 L266 L310 N315	I173-A312 HydrophobicContact CD1-CB 4.12Å; I173-A312 HydrophobicContact CG1-CB 4.21Å; I173-A312 PolarHBondContact O-N 3.08Å; V174-A312 HydrophobicContact CG2-CB 4.01Å; P175-A312 WeakPolarHBondContact CD-O 3.43Å; L263-A312 HydrophobicContact CD1-CB 3.66Å; L266-A312 HydrophobicContact CD2-CB 3.98Å; L310-A312 HydrophobicContact CD2-CB 4.35Å; A312-N315 PolarHBondContact O-ND2 3.12Å
313	I	92.6	Very high	86.7	Confident	36 Å²	36	40.1 Å²	40.1	19%	0.185	20%	0.203	C	C	.	.			trans	-109.5	176.5	-176.5	64.7	164.3	0	0	0	111.5	P175 N281 L283 A311 N315	P175-I313 HydrophobicContact CG-CG2 4.3Å; N281-I313 VanDerWaalsContact O-CG1 3.31Å; N281-I313 WeakPolarHBondContact O-CG1 3.03Å; N281-I313 VanDerWaalsContact O-O 3.13Å; L283-I313 HydrophobicContact CD1-CD1 4.01Å; L283-I313 HydrophobicContact CD1-CG2 4.38Å; L283-I313 HydrophobicContact CD2-CD1 3.81Å; L283-I313 HydrophobicContact CG-CD1 3.8Å; L283-I313 HydrophobicContact CG-CG1 4.22Å; A311-I313 PolarHBondContact O-N 3.42Å; I313-N315 PolarHBondContact O-N 2.83Å; I313-N315 PolarHBondContact O-OD1 3.27Å
314	D	89.9	Confident	88.1	Confident	48 Å²	48	35.4 Å²	35.4	26%	0.257	18%	0.175	S	C	.	.			trans	44.2	58.8	178.9	-147.4	2.3	0	0	0	114.1	K118 G316	K118-D314 VanDerWaalsContact NZ-CG 3.3Å; K118-D314 IonicContact NZ-OD1 2.66Å; K118-D314 PolarHBondContact NZ-OD1 3.38Å; K118-D314 IonicContact NZ-OD2 3.52Å; D314-G316 PolarHBondContact O-N 3.06Å
315	N	92.9	Very high	88.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.			trans	-91.2	22.7	-179.4	-53.6	-71.2	0	0	0	111.7	S158 E159 A162 R277 A312 I313 L317	S158-N315 CarbonylContact C-O 3.58Å; S158-N315 WeakPolarHBondContact CB-O 3.37Å; S158-N315 PolarHBondContact OG-O 2.79Å; E159-N315 WeakPolarHBondContact OE2-CA 3.4Å; E159-N315 PolarHBondContact OE2-N 3.08Å; A162-N315 HydrophobicContact CB-CB 3.4Å; A162-N315 VanDerWaalsContact CB-CB 3.4Å; R277-N315 PolarHBondContact NH2-OD1 3.33Å; A312-N315 PolarHBondContact O-ND2 3.12Å; I313-N315 PolarHBondContact O-N 2.83Å; I313-N315 PolarHBondContact O-OD1 3.27Å; N315-L317 PolarHBondContact O-N 3.18Å
316	G	90.2	Very high	89	Confident	10 Å²	10	28.8 Å²	28.8	10%	0.103	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-3.9	-172.5	0	0	0	0	0	116	G155 D314	G155-G316 WeakPolarHBondContact CA-O 3.45Å; D314-G316 PolarHBondContact O-N 3.06Å
317	L	89.8	Confident	87.9	Confident	44 Å²	44	35.9 Å²	35.9	23%	0.23	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.9	44.4	-175.3	-58.8	174.7	0	0	0	112.9	R147 L150 N272 T273 N315	R147-L317 VanDerWaalsContact NH1-CD1 3.3Å; L150-L317 HydrophobicContact CD1-CB 3.9Å; L150-L317 HydrophobicContact CD1-CD2 3.8Å; L150-L317 HydrophobicContact CD1-CG 4.46Å; N272-L317 PolarHBondContact OD1-O 3.44Å; T273-L317 PolarHBondContact N-O 3.24Å; T273-L317 PolarHBondContact OG1-O 2.88Å; N315-L317 PolarHBondContact O-N 3.18Å
318	A	92.6	Very high	86.7	Confident	6 Å²	6	35.4 Å²	35.4	5%	0.05	17%	0.174	C	C	.	.			trans	-109.9	-169.3	173.4	0	0	0	0	0	111.8	L150 S158 I270 N272	L150-A318 WeakPolarHBondContact CD2-O 3.34Å; S158-A318 WeakPolarHBondContact OG-CA 3.39Å; S158-A318 WeakPolarHBondContact OG-CB 3.28Å; S158-A318 PolarHBondContact OG-N 2.97Å; I270-A318 HydrophobicContact CB-CB 4Å; I270-A318 HydrophobicContact CD1-CB 3.65Å; I270-A318 HydrophobicContact CG1-CB 3.65Å; N272-A318 HydrophobicContact CB-CB 4.29Å
319	F	95.7	Very high	85.3	Confident	10 Å²	10	37.9 Å²	37.9	4%	0.044	20%	0.195	C	C	.	.			trans	54.5	59.8	-178.6	-55.3	-85.7	0	0	0	114.2	V165 I270 L369 F373 Q387	V165-F319 HydrophobicContact CG2-CE1 4.28Å; V165-F319 HydrophobicContact CG2-CZ 4.07Å; I270-F319 HydrophobicContact CB-CE1 4.09Å; I270-F319 HydrophobicContact CB-CE2 4.08Å; I270-F319 HydrophobicContact CB-CZ 3.86Å; I270-F319 HydrophobicContact CG2-CE1 3.87Å; I270-F319 HydrophobicContact CG2-CE2 4.1Å; I270-F319 HydrophobicContact CG2-CZ 3.49Å; I270-F319 VanDerWaalsContact CG2-CZ 3.49Å; I270-F319 PolarHBondContact O-N 3.25Å; F319-L369 HydrophobicContact CE1-CD1 4.12Å; F319-L369 HydrophobicContact CE1-CD2 4.11Å; F319-L369 HydrophobicContact CZ-CD2 4.25Å; F319-F373 HydrophobicContact CB-CE2 4.22Å; F319-F373 HydrophobicContact CB-CZ 4.22Å; F319-F373 HydrophobicContact CD1-CZ 4.2Å; F319-F373 HydrophobicContact CD2-CZ 4Å; F319-F373 HydrophobicContact CE2-CZ 4.43Å; F319-F373 HydrophobicContact CG-CE2 4.33Å; F319-F373 AromaticContact CG-CZ 3.88Å; F319-F373 HydrophobicContact CG-CZ 3.88Å; F319-Q387 WeakPolarHBondContact O-CG 2.99Å; F319-Q387 PolarHBondContact O-NE2 2.91Å
320	P	93.9	Very high	84.3	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.013	18%	0.175	C	C	.	.			trans	-74.9	150.7	179.4	31.7	-35.3	0	0	0	114	C149 L150 R271 T273 K322 V390	C149-P320 HydrophobicContact CB-CB 4.11Å; C149-P320 CarbonylContact O-C 3.38Å; C149-P320 WeakPolarHBondContact O-CA 3.35Å; C149-P320 VanDerWaalsContact O-CB 3.24Å; C149-P320 WeakPolarHBondContact O-CB 3.48Å; L150-P320 HydrophobicContact CD2-CB 3.92Å; R271-P320 HydrophobicContact CB-CG 3.87Å; R271-P320 HydrophobicContact CG-CG 3.81Å; R271-P320 WeakPolarHBondContact O-CD 3.43Å; T273-P320 HydrophobicContact CG2-CB 4.16Å; T273-P320 HydrophobicContact CG2-CG 4.06Å; P320-K322 VanDerWaalsContact C-N 3.33Å; P320-V390 HydrophobicContact CG-CG1 4.23Å
321	L	91.3	Very high	83.7	Confident	34 Å²	34	35.4 Å²	35.4	18%	0.178	19%	0.189	C	C	.	.	S	Bend	trans	-73.3	-17.7	175.9	-63.5	167.7	0	0	0	114.6	C149 V151 Q383 K386 Q387	C149-L321 PolarHBondContact O-N 2.85Å; V151-L321 HydrophobicContact CG2-CD1 3.92Å; V151-L321 HydrophobicContact CG2-CD2 3.76Å; V151-L321 HydrophobicContact CG2-CG 3.86Å; L321-Q383 HydrophobicContact CD1-CG 4.47Å; L321-Q383 HydrophobicContact CD2-CB 3.59Å; L321-Q383 HydrophobicContact CD2-CG 3.89Å; L321-Q383 VanDerWaalsContact CD2-O 3.26Å; L321-Q383 WeakPolarHBondContact CD2-O 3.29Å; L321-K386 HydrophobicContact CB-CB 4.49Å; L321-K386 HydrophobicContact CD2-CB 4.18Å; L321-K386 WeakPolarHBondContact O-CB 3.28Å; L321-Q387 HydrophobicContact CD2-CG 3.8Å; L321-Q387 HydrophobicContact CG-CG 4.44Å
322	K	90	Very high	83.3	Confident	56 Å²	56	36 Å²	36	24%	0.243	19%	0.191	C	C	.	.	S	Bend	trans	-158.2	156.8	178.6	54	167.8	175.9	170.1	0	108.2	D148 C149 P320 D325	D148-K322 VanDerWaalsContact OD2-CE 3.28Å; D148-K322 WeakPolarHBondContact OD2-CE 3.1Å; D148-K322 IonicContact OD2-NZ 3.49Å; D148-K322 PolarHBondContact OD2-NZ 2.94Å; C149-K322 HydrophobicContact CB-CG 3.91Å; C149-K322 WeakPolarHBondContact CB-O 3.35Å; P320-K322 VanDerWaalsContact C-N 3.33Å; K322-D325 IonicContact NZ-OD2 3.1Å; K322-D325 PolarHBondContact NZ-OD2 2.84Å
323	H	88.7	Confident	83	Confident	4 Å²	4	40 Å²	40	2%	0.019	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-64.7	151.7	166.5	-57.8	-77.4	0	0	0	110	Q394 P416 V417	H323-Q394 PolarHBondContact CE1-NE2 3.06Å; H323-Q394 PolarHBondContact ND1-NE2 3.47Å; H323-P416 HydrophobicContact CB-CB 4.1Å; H323-V417 PolarHBondContact NE2-O 2.84Å
324	P	84.4	Confident	82.9	Confident	18 Å²	18	38.3 Å²	38.3	12%	0.117	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-64.9	139.1	-176.7	-19.5	34.2	0	0	0	111.8	R328 Y330	P324-R328 WeakPolarHBondContact CB-O 3.3Å; P324-Y330 HydrophobicContact CB-CD2 3.54Å; P324-Y330 HydrophobicContact CB-CE2 3.95Å; P324-Y330 HydrophobicContact CB-CG 4.49Å; P324-Y330 HydrophobicContact CG-CD2 3.5Å; P324-Y330 HydrophobicContact CG-CE2 4.28Å; P324-Y330 HydrophobicContact CG-CG 4.37Å
325	D	75.1	Confident	83	Confident	41 Å²	41	36.5 Å²	36.5	22%	0.219	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-66.5	141.6	172.3	-65.5	-70.5	0	0	0	110	K322 W327 R328	K322-D325 IonicContact NZ-OD2 3.1Å; K322-D325 PolarHBondContact NZ-OD2 2.84Å; D325-W327 PolarHBondContact O-N 3.1Å; D325-R328 CarbonylContact O-C 3.56Å; D325-R328 PolarHBondContact O-N 2.66Å
326	S	64.8	Low	82.9	Confident	83 Å²	83	44.8 Å²	44.8	58%	0.58	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-58.1	-17.3	-162.8	-45.2	0	0	0	0	116.6	R328	S326-R328 VanDerWaalsContact C-N 3.32Å
327	W	52.9	Low	82.9	Confident	178 Å²	178	45.4 Å²	45.4	67%	0.674	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-81.5	-8.4	175.7	63.9	-79.7	0	0	0	113.6	D325	D325-W327 PolarHBondContact O-N 3.1Å
328	R	60.4	Low	83.1	Confident	54 Å²	54	47 Å²	47	20%	0.204	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-138.3	73.4	166.4	-67.2	-170	-171.2	143.1	10.4	109.6	C143 C144 G146 P324 D325 S326 Y330	C143-R328 PolarHBondContact O-NH2 2.72Å; C144-R328 VanDerWaalsContact CA-NH2 3.35Å; C144-R328 PolarHBondContact O-NH2 2.83Å; G146-R328 PolarHBondContact O-NH1 2.82Å; P324-R328 WeakPolarHBondContact CB-O 3.3Å; D325-R328 CarbonylContact O-C 3.56Å; D325-R328 PolarHBondContact O-N 2.66Å; S326-R328 VanDerWaalsContact C-N 3.32Å; R328-Y330 HydrophobicContact CB-CE1 4.15Å; R328-Y330 HydrophobicContact CB-CE2 4.19Å; R328-Y330 WeakPolarHBondContact CD-OH 3.39Å; R328-Y330 WeakPolarHBondContact O-CD2 3.31Å; R328-Y330 PolarHBondContact O-N 3.08Å; R328-Y330 VanDerWaalsContact O-N 3.09Å
329	A	62.8	Low	83.1	Confident	57 Å²	57	47.9 Å²	47.9	47%	0.471	24%	0.24	S	C	.	.			trans	-63.5	-17	-170.5	0	0	0	0	0	116.1	R271	R271-A329 PolarHBondContact NH2-O 2.9Å
330	Y	73.8	Confident	83.1	Confident	14 Å²	14	47.4 Å²	47.4	6%	0.055	24%	0.237	C	C	.	.			trans	37.8	69.8	-171.1	-52.6	-56.7	0	0	0	111.9	R147 C149 R271 T273 L275 P324 R328	R147-Y330 HydrophobicContact CB-CE2 4.4Å; R147-Y330 HydrophobicContact CG-CE1 4Å; R147-Y330 HydrophobicContact CG-CE2 4.31Å; R147-Y330 WeakPolarHBondContact CG-OH 3.39Å; C149-Y330 VanDerWaalsContact SG-CE2 3.58Å; R271-Y330 PolarHBondContact NH1-O 2.97Å; R271-Y330 PolarHBondContact NH2-O 3.14Å; T273-Y330 HydrophobicContact CG2-CD2 4.45Å; L275-Y330 HydrophobicContact CB-CD1 4.4Å; L275-Y330 HydrophobicContact CD1-CD1 3.93Å; L275-Y330 HydrophobicContact CD1-CE1 3.8Å; L275-Y330 HydrophobicContact CG-CD1 3.92Å; L275-Y330 HydrophobicContact CG-CE1 4.31Å; P324-Y330 HydrophobicContact CB-CD2 3.54Å; P324-Y330 HydrophobicContact CB-CE2 3.95Å; P324-Y330 HydrophobicContact CB-CG 4.49Å; P324-Y330 HydrophobicContact CG-CD2 3.5Å; P324-Y330 HydrophobicContact CG-CE2 4.28Å; P324-Y330 HydrophobicContact CG-CG 4.37Å; R328-Y330 HydrophobicContact CB-CE1 4.15Å; R328-Y330 HydrophobicContact CB-CE2 4.19Å; R328-Y330 WeakPolarHBondContact CD-OH 3.39Å; R328-Y330 WeakPolarHBondContact O-CD2 3.31Å; R328-Y330 PolarHBondContact O-N 3.08Å; R328-Y330 VanDerWaalsContact O-N 3.09Å
331	P	84.1	Confident	83.3	Confident	47 Å²	47	53.9 Å²	53.9	31%	0.305	27%	0.266	S	S	.	.			trans	-70.8	154.5	-176	32.1	-36	0	0	0	111.3	Y333 W336	P331-Y333 HydrophobicContact CG-CE2 4.47Å; P331-W336 HydrophobicContact CB-CH2 3.53Å; P331-W336 HydrophobicContact CB-CZ3 3.92Å; P331-W336 HydrophobicContact CG-CH2 3.65Å; P331-W336 HydrophobicContact CG-CZ3 3.99Å
332	F	88.7	Confident	83.6	Confident	15 Å²	15	55.6 Å²	55.6	7%	0.066	28%	0.277	C	S	.	.			trans	-82.2	111.7	168.9	-59.2	-76.7	0	0	0	109	D267 Y268 R271 N272 W334 A335 V412	D267-F332 HydrophobicContact CB-CD1 4.11Å; D267-F332 HydrophobicContact CB-CE1 3.89Å; D267-F332 WeakPolarHBondContact O-CE1 3.27Å; Y268-F332 AromaticContact CD2-CE2 3.94Å; Y268-F332 HydrophobicContact CD2-CE2 3.94Å; Y268-F332 HydrophobicContact CD2-CZ 4.2Å; Y268-F332 HydrophobicContact CE2-CE2 4.41Å; R271-F332 VanDerWaalsContact CD-CZ 3.5Å; N272-F332 HydrophobicContact CB-CE1 4.43Å; N272-F332 WeakPolarHBondContact O-CE1 3.49Å; F332-W334 HydrophobicContact CB-CD2 3.96Å; F332-W334 VanDerWaalsContact CB-CE2 3.5Å; F332-W334 HydrophobicContact CB-CE3 4.48Å; F332-W334 HydrophobicContact CB-CG 4.44Å; F332-W334 HydrophobicContact CB-CH2 4.13Å; F332-W334 HydrophobicContact CB-CZ2 3.61Å; F332-W334 AromaticContact CD1-CZ2 3.8Å; F332-W334 HydrophobicContact CD1-CZ2 3.8Å; F332-W334 AromaticContact CD1-NE1 3.89Å; F332-W334 HydrophobicContact CD2-CH2 4.32Å; F332-W334 HydrophobicContact CD2-CZ2 4.06Å; F332-W334 HydrophobicContact CE1-CZ2 4.42Å; F332-W334 AromaticContact CG-CE2 3.9Å; F332-W334 HydrophobicContact CG-CH2 4.21Å; F332-W334 AromaticContact CG-CZ2 3.58Å; F332-W334 HydrophobicContact CG-CZ2 3.58Å; F332-W334 PolarHBondContact O-N 2.95Å; F332-A335 VanDerWaalsContact O-CB 3.22Å; F332-A335 WeakPolarHBondContact O-CB 3.25Å; F332-A335 PolarHBondContact O-N 3.22Å; F332-V412 HydrophobicContact CD2-CB 4.38Å; F332-V412 HydrophobicContact CD2-CG1 3.56Å; F332-V412 HydrophobicContact CE2-CG1 4.03Å; F332-V412 HydrophobicContact CG-CG1 4.48Å
333	Y	87.7	Confident	84	Confident	83 Å²	83	55.3 Å²	55.3	33%	0.325	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-67.1	-28.2	-172.8	-69.7	-112.2	0	0	0	113.5	L275 R277 P331 A335 W336	L275-Y333 WeakPolarHBondContact O-CE2 3.38Å; L275-Y333 PolarHBondContact O-OH 2.76Å; L275-Y333 VanDerWaalsContact O-OH 3.1Å; R277-Y333 WeakPolarHBondContact O-CB 3.45Å; R277-Y333 WeakPolarHBondContact O-CD2 3.49Å; P331-Y333 HydrophobicContact CG-CE2 4.47Å; Y333-A335 PolarHBondContact O-N 3.48Å; Y333-W336 HydrophobicContact CD1-CE3 4.25Å; Y333-W336 HydrophobicContact CD1-CZ3 4.02Å; Y333-W336 HydrophobicContact CG-CE3 4.38Å; Y333-W336 HydrophobicContact CG-CZ3 4.09Å; Y333-W336 PolarHBondContact O-N 3.24Å
334	W	90.4	Very high	84.5	Confident	1 Å²	1	55.3 Å²	55.3	0%	0.004	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-57.7	-19.4	174.1	54.4	-111.7	0	0	0	113.1	F260 V264 D267 F332 W336 L337 A340 P408 V412	F260-W334 HydrophobicContact CE2-CB 3.73Å; F260-W334 HydrophobicContact CE2-CG 4.43Å; F260-W334 HydrophobicContact CZ-CB 3.9Å; F260-W334 HydrophobicContact CZ-CD2 4.48Å; F260-W334 HydrophobicContact CZ-CE3 4.17Å; F260-W334 HydrophobicContact CZ-CG 4.43Å; V264-W334 HydrophobicContact CB-CH2 4.23Å; V264-W334 HydrophobicContact CB-CZ2 4.34Å; V264-W334 HydrophobicContact CB-CZ3 4.48Å; V264-W334 HydrophobicContact CG1-CH2 3.68Å; V264-W334 HydrophobicContact CG1-CZ2 4.16Å; V264-W334 HydrophobicContact CG1-CZ3 4.08Å; V264-W334 HydrophobicContact CG2-CD2 4.03Å; V264-W334 HydrophobicContact CG2-CE3 3.76Å; V264-W334 HydrophobicContact CG2-CH2 3.96Å; V264-W334 HydrophobicContact CG2-CZ2 4.15Å; V264-W334 HydrophobicContact CG2-CZ3 3.77Å; D267-W334 HydrophobicContact CB-CZ2 4.27Å; D267-W334 PolarHBondContact OD2-NE1 3.33Å; F332-W334 HydrophobicContact CB-CD2 3.96Å; F332-W334 VanDerWaalsContact CB-CE2 3.5Å; F332-W334 HydrophobicContact CB-CE3 4.48Å; F332-W334 HydrophobicContact CB-CG 4.44Å; F332-W334 HydrophobicContact CB-CH2 4.13Å; F332-W334 HydrophobicContact CB-CZ2 3.61Å; F332-W334 AromaticContact CD1-CZ2 3.8Å; F332-W334 HydrophobicContact CD1-CZ2 3.8Å; F332-W334 AromaticContact CD1-NE1 3.89Å; F332-W334 HydrophobicContact CD2-CH2 4.32Å; F332-W334 HydrophobicContact CD2-CZ2 4.06Å; F332-W334 HydrophobicContact CE1-CZ2 4.42Å; F332-W334 AromaticContact CG-CE2 3.9Å; F332-W334 HydrophobicContact CG-CH2 4.21Å; F332-W334 AromaticContact CG-CZ2 3.58Å; F332-W334 HydrophobicContact CG-CZ2 3.58Å; F332-W334 PolarHBondContact O-N 2.95Å; W334-W336 PolarHBondContact O-N 3.24Å; W334-L337 HydrophobicContact CB-CD1 4.08Å; W334-L337 WeakPolarHBondContact O-CB 3.45Å; W334-L337 PolarHBondContact O-N 3.37Å; W334-L337 VanDerWaalsContact O-N 3.12Å; W334-A340 HydrophobicContact CE3-CB 4.43Å; W334-A340 VanDerWaalsContact O-CB 3.3Å; W334-A340 WeakPolarHBondContact O-CB 3.48Å; W334-P408 HydrophobicContact CE3-CB 4.35Å; W334-P408 HydrophobicContact CH2-CB 4.49Å; W334-P408 HydrophobicContact CZ3-CB 3.7Å; W334-V412 HydrophobicContact CH2-CG1 3.51Å; W334-V412 HydrophobicContact CZ2-CG1 4.43Å; W334-V412 HydrophobicContact CZ3-CG1 3.95Å
335	A	91.9	Very high	85.1	Confident	10 Å²	10	55.5 Å²	55.5	8%	0.083	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-66	-19.4	176.5	0	0	0	0	0	113.8	F332 Y333 V412	F332-A335 VanDerWaalsContact O-CB 3.22Å; F332-A335 WeakPolarHBondContact O-CB 3.25Å; F332-A335 PolarHBondContact O-N 3.22Å; Y333-A335 PolarHBondContact O-N 3.48Å; A335-V412 HydrophobicContact CB-CG2 3.85Å
336	W	90.8	Very high	86.2	Confident	174 Å²	174	58.8 Å²	58.8	66%	0.659	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-84.9	-10.8	174.2	-72.8	-71.4	0	0	0	114	P331 Y333 W334	P331-W336 HydrophobicContact CB-CH2 3.53Å; P331-W336 HydrophobicContact CB-CZ3 3.92Å; P331-W336 HydrophobicContact CG-CH2 3.65Å; P331-W336 HydrophobicContact CG-CZ3 3.99Å; Y333-W336 HydrophobicContact CD1-CE3 4.25Å; Y333-W336 HydrophobicContact CD1-CZ3 4.02Å; Y333-W336 HydrophobicContact CG-CE3 4.38Å; Y333-W336 HydrophobicContact CG-CZ3 4.09Å; Y333-W336 PolarHBondContact O-N 3.24Å; W334-W336 PolarHBondContact O-N 3.24Å
337	L	91.5	Very high	87.8	Confident	23 Å²	23	58.3 Å²	58.3	12%	0.12	29%	0.291	C	S	.	.	S	Bend	trans	-71.3	156.1	178.6	-61.8	175.9	0	0	0	111.9	L240 F260 W282 W334 Q339 A340	L240-L337 HydrophobicContact CD1-CD1 3.93Å; L240-L337 HydrophobicContact CD1-CD2 4.03Å; F260-L337 HydrophobicContact CE2-CD1 3.94Å; F260-L337 HydrophobicContact CZ-CD1 4.49Å; W282-L337 HydrophobicContact CH2-CD1 4.38Å; W282-L337 HydrophobicContact CZ2-CD1 3.86Å; W334-L337 HydrophobicContact CB-CD1 4.08Å; W334-L337 WeakPolarHBondContact O-CB 3.45Å; W334-L337 PolarHBondContact O-N 3.37Å; W334-L337 VanDerWaalsContact O-N 3.12Å; L337-Q339 VanDerWaalsContact C-N 3.27Å; L337-Q339 PolarHBondContact O-N 2.81Å; L337-A340 PolarHBondContact O-N 3.17Å
338	S	92.8	Very high	89.9	Confident	77 Å²	77	50 Å²	50	54%	0.538	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-62.6	-36.7	175.3	53.5	0	0	0	0	111.8	A340 K341	S338-A340 PolarHBondContact O-N 2.97Å; S338-K341 WeakPolarHBondContact O-CB 3.45Å; S338-K341 PolarHBondContact O-N 3.21Å
339	Q	94.3	Very high	91.7	Very high	24 Å²	24	49 Å²	49	11%	0.112	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.4	-30.2	176	-67.3	80.2	4.7	0	0	113	Q257 F260 L337 K341 V342	Q257-Q339 PolarHBondContact NE2-O 3Å; F260-Q339 HydrophobicContact CD1-CB 3.76Å; F260-Q339 HydrophobicContact CD2-CB 4.35Å; F260-Q339 HydrophobicContact CE1-CB 3.74Å; F260-Q339 HydrophobicContact CE2-CB 4.32Å; F260-Q339 HydrophobicContact CG-CB 4.07Å; F260-Q339 HydrophobicContact CZ-CB 4.02Å; L337-Q339 VanDerWaalsContact C-N 3.27Å; L337-Q339 PolarHBondContact O-N 2.81Å; Q339-K341 PolarHBondContact O-N 2.92Å; Q339-V342 PolarHBondContact O-N 2.99Å
340	A	95.8	Very high	93.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-74.3	-11.6	178	0	0	0	0	0	114.2	F260 W334 L337 S338 S407 P408 L409	F260-A340 HydrophobicContact CE1-CB 4.25Å; F260-A340 HydrophobicContact CZ-CB 4.17Å; W334-A340 HydrophobicContact CE3-CB 4.43Å; W334-A340 VanDerWaalsContact O-CB 3.3Å; W334-A340 WeakPolarHBondContact O-CB 3.48Å; L337-A340 PolarHBondContact O-N 3.17Å; S338-A340 PolarHBondContact O-N 2.97Å; A340-S407 WeakPolarHBondContact O-CB 3.42Å; A340-P408 HydrophobicContact CB-CB 4.08Å; A340-P408 WeakPolarHBondContact O-CD 3.12Å; A340-L409 HydrophobicContact CB-CB 4.42Å; A340-L409 VanDerWaalsContact O-CB 3.22Å; A340-L409 WeakPolarHBondContact O-CB 3.34Å; A340-L409 PolarHBondContact O-N 2.82Å
341	K	97.3	Very high	94.5	Very high	139 Å²	139	53.9 Å²	53.9	60%	0.604	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-86.9	-18.1	176.1	-59.4	175.2	-174.9	171.9	0	112.5	S338 Q339 S407 L409	S338-K341 WeakPolarHBondContact O-CB 3.45Å; S338-K341 PolarHBondContact O-N 3.21Å; Q339-K341 PolarHBondContact O-N 2.92Å; K341-S407 WeakPolarHBondContact O-CB 3.45Å; K341-L409 HydrophobicContact CG-CD2 4.03Å
342	V	97.4	Very high	95.2	Very high	70 Å²	70	51.7 Å²	51.7	42%	0.424	26%	0.257	S	S	.	.	S	Bend	trans	-71.9	135.1	177.5	-175	0	0	0	0	109.4	Q257 Q339 S407 P408	Q257-V342 HydrophobicContact CG-CG1 4.34Å; Q339-V342 PolarHBondContact O-N 2.99Å; V342-S407 WeakPolarHBondContact O-CA 3.42Å; V342-S407 WeakPolarHBondContact O-CB 3.46Å; V342-P408 WeakPolarHBondContact O-CD 3.44Å
343	A	98.3	Very high	95.5	Very high	50 Å²	50	52.6 Å²	52.6	41%	0.413	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-65.5	146.7	175.9	0	0	0	0	0	111.2	S345 G405	A343-S345 PolarHBondContact O-N 3.04Å; A343-G405 WeakPolarHBondContact CB-O 3.43Å
344	F	98.4	Very high	96	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.018	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-55.7	130.8	177.2	-74.4	-65.2	0	0	0	111.7	E261 V264 I348 K349 L398 L402 K406 P408 L411	E261-F344 HydrophobicContact CB-CD1 4.33Å; E261-F344 HydrophobicContact CG-CD1 4Å; E261-F344 HydrophobicContact CG-CE1 4.45Å; E261-F344 WeakPolarHBondContact OE1-CA 3.45Å; V264-F344 HydrophobicContact CB-CE1 4.38Å; V264-F344 HydrophobicContact CG1-CE1 3.84Å; V264-F344 HydrophobicContact CG1-CZ 3.66Å; F344-I348 HydrophobicContact CB-CG2 3.9Å; F344-I348 HydrophobicContact CD1-CG2 3.95Å; F344-I348 HydrophobicContact CG-CG2 4.32Å; F344-K349 WeakPolarHBondContact O-CE 3.45Å; F344-K349 PolarHBondContact O-NZ 2.99Å; F344-L398 HydrophobicContact CE2-CD1 4.45Å; F344-L398 HydrophobicContact CZ-CD1 4.32Å; F344-L402 HydrophobicContact CB-CD2 3.9Å; F344-L402 HydrophobicContact CD1-CD2 4.21Å; F344-L402 HydrophobicContact CD2-CD2 3.77Å; F344-L402 HydrophobicContact CE2-CD2 4.32Å; F344-L402 HydrophobicContact CG-CD2 3.72Å; F344-K406 WeakPolarHBondContact CD2-O 3.4Å; F344-K406 PolarHBondContact N-O 3.12Å; F344-P408 HydrophobicContact CD1-CG 4.45Å; F344-P408 HydrophobicContact CE1-CG 3.88Å; F344-P408 HydrophobicContact CZ-CB 4.47Å; F344-P408 HydrophobicContact CZ-CG 3.98Å; F344-L411 HydrophobicContact CE2-CB 4.4Å; F344-L411 HydrophobicContact CE2-CD2 4.03Å; F344-L411 HydrophobicContact CZ-CD2 3.84Å
345	S	98.1	Very high	96.4	Very high	22 Å²	22	54.2 Å²	54.2	15%	0.154	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-57.3	169	176	71.2	0	0	0	0	113.3	L258 E261 A343 E347 I348 K349	L258-S345 WeakPolarHBondContact CD2-OG 3.06Å; E261-S345 PolarHBondContact OE1-N 2.96Å; E261-S345 WeakPolarHBondContact OE2-CB 3.29Å; E261-S345 PolarHBondContact OE2-OG 2.99Å; A343-S345 PolarHBondContact O-N 3.04Å; S345-E347 WeakPolarHBondContact CB-OE2 3.32Å; S345-I348 WeakPolarHBondContact OG-CG2 3.36Å; S345-I348 PolarHBondContact OG-N 3.2Å; S345-I348 VanDerWaalsContact OG-N 3.07Å; S345-K349 VanDerWaalsContact O-CD 3.22Å; S345-K349 WeakPolarHBondContact O-CD 3.47Å; S345-K349 WeakPolarHBondContact O-CE 3.43Å; S345-K349 VanDerWaalsContact O-CG 3.25Å; S345-K349 WeakPolarHBondContact O-CG 3.43Å
346	M	97.9	Very high	96.5	Very high	110 Å²	110	54.1 Å²	54.1	54%	0.542	28%	0.278	S	S	.	.	H	α-helix	trans	-75.1	-35.6	171.5	-70.8	-58.6	-64	0	0	110.4	I348 K349 E350	M346-I348 PolarHBondContact O-N 2.66Å; M346-K349 WeakPolarHBondContact O-CB 3.35Å; M346-K349 PolarHBondContact O-N 3.08Å; M346-K349 VanDerWaalsContact O-N 3.12Å; M346-K349 HydrophobicContact SD-CD 4.03Å; M346-E350 WeakPolarHBondContact O-CB 3.37Å; M346-E350 WeakPolarHBondContact O-CG 3.48Å; M346-E350 PolarHBondContact O-N 2.69Å
347	E	97.7	Very high	96.7	Very high	72 Å²	72	48.5 Å²	48.5	34%	0.336	27%	0.266	S	S	.	.	H	α-helix	trans	-60.5	-43.3	-178.9	-58.9	93.8	124.6	0	0	112.3	R254 L258 S345 L351	R254-E347 IonicContact CZ-OE1 3.23Å; R254-E347 IonicContact NE-OE1 2.74Å; R254-E347 IonicContact NH2-OE1 2.81Å; R254-E347 PolarHBondContact NH2-OE1 2.71Å; L258-E347 HydrophobicContact CD2-CB 3.85Å; L258-E347 HydrophobicContact CD2-CG 4.27Å; S345-E347 WeakPolarHBondContact CB-OE2 3.32Å; E347-L351 WeakPolarHBondContact O-CB 3.34Å; E347-L351 PolarHBondContact O-N 2.89Å; E347-L351 VanDerWaalsContact O-N 3.1Å
348	I	97.9	Very high	96.9	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-70	-37.2	174.9	-165.1	66.8	0	0	0	111.7	L171 E261 R262 V265 F344 S345 M346 L351 V352 L402	L171-I348 HydrophobicContact CD2-CD1 4.49Å; E261-I348 HydrophobicContact CB-CB 4.22Å; E261-I348 HydrophobicContact CB-CD1 4.42Å; E261-I348 HydrophobicContact CB-CG1 4.08Å; E261-I348 HydrophobicContact CB-CG2 4.34Å; E261-I348 WeakPolarHBondContact OE2-CG2 3.33Å; R262-I348 HydrophobicContact CG-CD1 3.84Å; V265-I348 HydrophobicContact CG2-CD1 4.19Å; V265-I348 HydrophobicContact CG2-CG1 3.95Å; F344-I348 HydrophobicContact CB-CG2 3.9Å; F344-I348 HydrophobicContact CD1-CG2 3.95Å; F344-I348 HydrophobicContact CG-CG2 4.32Å; S345-I348 WeakPolarHBondContact OG-CG2 3.36Å; S345-I348 PolarHBondContact OG-N 3.2Å; S345-I348 VanDerWaalsContact OG-N 3.07Å; M346-I348 PolarHBondContact O-N 2.66Å; I348-L351 HydrophobicContact CD1-CD2 4.38Å; I348-L351 PolarHBondContact O-N 3.04Å; I348-V352 HydrophobicContact CD1-CG1 3.96Å; I348-V352 HydrophobicContact CG1-CG1 4.39Å; I348-V352 WeakPolarHBondContact O-CG2 3.42Å; I348-V352 PolarHBondContact O-N 2.78Å; I348-L402 HydrophobicContact CG2-CD2 4.34Å
349	K	98.1	Very high	96.9	Very high	34 Å²	34	51.1 Å²	51.1	15%	0.148	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-48.3	177.1	-69	164.9	-172.3	153.1	0	110.8	F344 S345 M346 L351 V352 L353 L402	F344-K349 WeakPolarHBondContact O-CE 3.45Å; F344-K349 PolarHBondContact O-NZ 2.99Å; S345-K349 VanDerWaalsContact O-CD 3.22Å; S345-K349 WeakPolarHBondContact O-CD 3.47Å; S345-K349 WeakPolarHBondContact O-CE 3.43Å; S345-K349 VanDerWaalsContact O-CG 3.25Å; S345-K349 WeakPolarHBondContact O-CG 3.43Å; M346-K349 WeakPolarHBondContact O-CB 3.35Å; M346-K349 PolarHBondContact O-N 3.08Å; M346-K349 VanDerWaalsContact O-N 3.12Å; M346-K349 HydrophobicContact SD-CD 4.03Å; K349-L351 VanDerWaalsContact C-N 3.31Å; K349-L351 PolarHBondContact O-N 2.99Å; K349-V352 PolarHBondContact O-N 3.35Å; K349-L353 WeakPolarHBondContact O-CA 3.34Å; K349-L353 WeakPolarHBondContact O-CB 3.41Å; K349-L353 PolarHBondContact O-N 3.4Å; K349-L402 WeakPolarHBondContact CE-O 3.45Å; K349-L402 HydrophobicContact CG-CB 4.23Å; K349-L402 HydrophobicContact CG-CD2 3.82Å
350	E	97.8	Very high	97	Very high	132 Å²	132	54.9 Å²	54.9	62%	0.617	30%	0.3	S	S	*	.	H	α-helix	trans	-63	-36.5	178.2	-72.2	173.7	-173.4	0	0	112	M346 P354	M346-E350 WeakPolarHBondContact O-CB 3.37Å; M346-E350 WeakPolarHBondContact O-CG 3.48Å; M346-E350 PolarHBondContact O-N 2.69Å; E350-P354 VanDerWaalsContact O-CD 3.27Å; E350-P354 WeakPolarHBondContact O-CD 3.4Å; E350-P354 WeakPolarHBondContact O-CG 3.4Å
351	L	97.8	Very high	97.1	Very high	41 Å²	41	56.3 Å²	56.3	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-68	-45.3	176.9	-178.8	63.2	0	0	0	113.4	E170 L171 E347 I348 K349 K355	E170-L351 HydrophobicContact CB-CD1 4.38Å; L171-L351 HydrophobicContact CD2-CD2 4.42Å; E347-L351 WeakPolarHBondContact O-CB 3.34Å; E347-L351 PolarHBondContact O-N 2.89Å; E347-L351 VanDerWaalsContact O-N 3.1Å; I348-L351 HydrophobicContact CD1-CD2 4.38Å; I348-L351 PolarHBondContact O-N 3.04Å; K349-L351 VanDerWaalsContact C-N 3.31Å; K349-L351 PolarHBondContact O-N 2.99Å; L351-K355 WeakPolarHBondContact O-CE 3.15Å
352	V	97.8	Very high	97	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-109.3	-31	-166.4	-44.2	0	0	0	0	114.3	L171 V265 I348 K349 K355 L356 L402	L171-V352 HydrophobicContact CD2-CG1 4.08Å; V265-V352 HydrophobicContact CG1-CG1 4.28Å; V265-V352 HydrophobicContact CG2-CG2 4.44Å; I348-V352 HydrophobicContact CD1-CG1 3.96Å; I348-V352 HydrophobicContact CG1-CG1 4.39Å; I348-V352 WeakPolarHBondContact O-CG2 3.42Å; I348-V352 PolarHBondContact O-N 2.78Å; K349-V352 PolarHBondContact O-N 3.35Å; V352-K355 PolarHBondContact O-N 3.35Å; V352-L356 HydrophobicContact CB-CD1 4.14Å; V352-L356 HydrophobicContact CG2-CD1 3.97Å; V352-L356 WeakPolarHBondContact O-CB 3.35Å; V352-L356 WeakPolarHBondContact O-CG 3.26Å; V352-L356 PolarHBondContact O-N 2.76Å; V352-L402 HydrophobicContact CG2-CD1 3.48Å; V352-L402 VanDerWaalsContact CG2-CD1 3.48Å
353	L	96.6	Very high	96.9	Very high	34 Å²	34	51.8 Å²	51.8	18%	0.178	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-38.3	-174.2	-168.3	63.5	0	0	0	113.8	K349 K355 S357 C399 L402 K403	K349-L353 WeakPolarHBondContact O-CA 3.34Å; K349-L353 WeakPolarHBondContact O-CB 3.41Å; K349-L353 PolarHBondContact O-N 3.4Å; L353-K355 VanDerWaalsContact C-N 3.31Å; L353-K355 PolarHBondContact O-N 2.86Å; L353-S357 WeakPolarHBondContact O-CB 3.45Å; L353-S357 PolarHBondContact O-N 3.13Å; L353-S357 PolarHBondContact O-OG 3.19Å; L353-C399 HydrophobicContact CD1-CB 4.26Å; L353-L402 HydrophobicContact CD1-CB 4.09Å; L353-L402 HydrophobicContact CD1-CD1 4.27Å; L353-K403 HydrophobicContact CD1-CG 4.23Å; L353-K403 HydrophobicContact CD2-CG 3.91Å
354	P	97.6	Very high	96.9	Very high	87 Å²	87	53.2 Å²	53.2	57%	0.565	28%	0.282	S	S	*	.	H	α-helix	trans	-61.9	-39.7	174.5	-23.8	35.3	0	0	0	112.3	E350 D358	E350-P354 VanDerWaalsContact O-CD 3.27Å; E350-P354 WeakPolarHBondContact O-CD 3.4Å; E350-P354 WeakPolarHBondContact O-CG 3.4Å; P354-D358 PolarHBondContact O-N 3.17Å
355	K	97.8	Very high	96.9	Very high	32 Å²	32	53 Å²	53	14%	0.139	28%	0.281	C	S	.	.	H	α-helix	trans	-68.7	-52.2	178.5	-56.5	-178.2	-178	-172.7	0	111.3	L169 E170 L351 V352 L353 S357 D358 F361	L169-K355 VanDerWaalsContact C-NZ 3.27Å; L169-K355 HydrophobicContact CD2-CB 4.42Å; L169-K355 HydrophobicContact CD2-CD 4.28Å; L169-K355 PolarHBondContact O-NZ 3.41Å; E170-K355 IonicContact OE1-NZ 3.01Å; E170-K355 PolarHBondContact OE1-NZ 2.56Å; L351-K355 WeakPolarHBondContact O-CE 3.15Å; V352-K355 PolarHBondContact O-N 3.35Å; L353-K355 VanDerWaalsContact C-N 3.31Å; L353-K355 PolarHBondContact O-N 2.86Å; K355-S357 VanDerWaalsContact C-N 3.25Å; K355-S357 PolarHBondContact O-N 3.37Å; K355-D358 PolarHBondContact O-N 3.49Å; K355-F361 HydrophobicContact CB-CD1 3.86Å; K355-F361 HydrophobicContact CB-CD2 4.06Å; K355-F361 HydrophobicContact CB-CE1 3.83Å; K355-F361 HydrophobicContact CB-CE2 4Å; K355-F361 HydrophobicContact CB-CG 4Å; K355-F361 HydrophobicContact CB-CZ 3.9Å; K355-F361 HydrophobicContact CD-CE2 4.02Å; K355-F361 HydrophobicContact CD-CZ 4.1Å; K355-F361 HydrophobicContact CG-CD2 4.44Å; K355-F361 HydrophobicContact CG-CE2 4.24Å; K355-F361 HydrophobicContact CG-CZ 4.46Å; K355-F361 WeakPolarHBondContact O-CB 3.43Å; K355-F361 WeakPolarHBondContact O-CD1 3.38Å; K355-F361 WeakPolarHBondContact O-CG 3.28Å
356	L	95.8	Very high	96.8	Very high	7 Å²	7	53.1 Å²	53.1	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-72.4	-16.7	-175.9	-64	177.8	0	0	0	114	L169 I269 V352 I362 I395 L398 C399	L169-L356 HydrophobicContact CD2-CD2 3.83Å; L169-L356 HydrophobicContact CD2-CG 4.22Å; I269-L356 HydrophobicContact CD1-CD1 3.99Å; I269-L356 HydrophobicContact CD1-CD2 3.91Å; V352-L356 HydrophobicContact CB-CD1 4.14Å; V352-L356 HydrophobicContact CG2-CD1 3.97Å; V352-L356 WeakPolarHBondContact O-CB 3.35Å; V352-L356 WeakPolarHBondContact O-CG 3.26Å; V352-L356 PolarHBondContact O-N 2.76Å; L356-I362 HydrophobicContact CD2-CD1 4.09Å; L356-I395 HydrophobicContact CB-CG2 4.21Å; L356-I395 HydrophobicContact CD2-CG1 4.29Å; L356-I395 HydrophobicContact CD2-CG2 4.12Å; L356-L398 HydrophobicContact CD1-CD2 3.67Å; L356-L398 HydrophobicContact CD1-CG 4.25Å; L356-C399 WeakPolarHBondContact CB-SG 3.49Å; L356-C399 PolarHBondContact O-SG 3.49Å
357	S	94.3	Very high	96.8	Very high	57 Å²	57	52.6 Å²	52.6	40%	0.399	28%	0.275	S	S	.	.	H	α-helix	trans	-90.2	-12.6	174.2	-57.7	0	0	0	0	113.6	L353 K355 P359	L353-S357 WeakPolarHBondContact O-CB 3.45Å; L353-S357 PolarHBondContact O-N 3.13Å; L353-S357 PolarHBondContact O-OG 3.19Å; K355-S357 VanDerWaalsContact C-N 3.25Å; K355-S357 PolarHBondContact O-N 3.37Å; S357-P359 WeakPolarHBondContact O-CD 3.44Å
358	D	95.9	Very high	96.8	Very high	59 Å²	59	52.6 Å²	52.6	32%	0.316	28%	0.278	S	S	.	.			trans	-87.7	116.8	176.6	172	30.6	0	0	0	111	P354 K355 N360 F361 I362	P354-D358 PolarHBondContact O-N 3.17Å; K355-D358 PolarHBondContact O-N 3.49Å; D358-N360 PolarHBondContact O-N 3.3Å; D358-N360 PolarHBondContact OD1-N 2.91Å; D358-N360 PolarHBondContact OD1-ND2 3.12Å; D358-F361 HydrophobicContact CB-CB 4.11Å; D358-F361 PolarHBondContact O-N 3.27Å; D358-F361 PolarHBondContact OD2-N 3.14Å; D358-I362 WeakPolarHBondContact O-CG1 3.37Å; D358-I362 PolarHBondContact O-N 3.45Å
359	P	93.1	Very high	96.8	Very high	95 Å²	95	52.6 Å²	52.6	62%	0.617	28%	0.278	S	S	*	.	H	α-helix	trans	-59.5	-28	176.5	-23.4	35	0	0	0	113.9	S357 K363	S357-P359 WeakPolarHBondContact O-CD 3.44Å; P359-K363 WeakPolarHBondContact O-CB 3.4Å; P359-K363 PolarHBondContact O-N 2.96Å
360	N	95.6	Very high	96.8	Very high	104 Å²	104	53.9 Å²	53.9	56%	0.556	28%	0.282	S	S	*	.	H	α-helix	trans	-71.4	-49.7	179.9	-52.7	-77	0	0	0	110.6	D358 I362 K363 D364	D358-N360 PolarHBondContact O-N 3.3Å; D358-N360 PolarHBondContact OD1-N 2.91Å; D358-N360 PolarHBondContact OD1-ND2 3.12Å; N360-I362 PolarHBondContact O-N 2.98Å; N360-K363 WeakPolarHBondContact O-CB 3.49Å; N360-K363 PolarHBondContact O-N 3.05Å; N360-K363 VanDerWaalsContact O-N 3.09Å; N360-D364 VanDerWaalsContact O-CG 3.27Å; N360-D364 PolarHBondContact O-N 3.34Å
361	F	97.6	Very high	96.8	Very high	29 Å²	29	51.9 Å²	51.9	13%	0.127	27%	0.273	C	S	.	.	H	α-helix	trans	-52.6	-41.9	172.4	178.3	-88.1	0	0	0	113	K168 L169 K355 D358 D364 L365	K168-F361 HydrophobicContact CB-CZ 4.36Å; K168-F361 HydrophobicContact CD-CE2 4.23Å; K168-F361 HydrophobicContact CD-CZ 4.17Å; K168-F361 HydrophobicContact CG-CE2 3.83Å; K168-F361 HydrophobicContact CG-CZ 3.89Å; K168-F361 WeakPolarHBondContact O-CE2 3.25Å; K168-F361 WeakPolarHBondContact O-CZ 3.46Å; L169-F361 HydrophobicContact CD2-CE1 3.77Å; L169-F361 HydrophobicContact CD2-CZ 3.72Å; L169-F361 HydrophobicContact CG-CZ 4.34Å; K355-F361 HydrophobicContact CB-CD1 3.86Å; K355-F361 HydrophobicContact CB-CD2 4.06Å; K355-F361 HydrophobicContact CB-CE1 3.83Å; K355-F361 HydrophobicContact CB-CE2 4Å; K355-F361 HydrophobicContact CB-CG 4Å; K355-F361 HydrophobicContact CB-CZ 3.9Å; K355-F361 HydrophobicContact CD-CE2 4.02Å; K355-F361 HydrophobicContact CD-CZ 4.1Å; K355-F361 HydrophobicContact CG-CD2 4.44Å; K355-F361 HydrophobicContact CG-CE2 4.24Å; K355-F361 HydrophobicContact CG-CZ 4.46Å; K355-F361 WeakPolarHBondContact O-CB 3.43Å; K355-F361 WeakPolarHBondContact O-CD1 3.38Å; K355-F361 WeakPolarHBondContact O-CG 3.28Å; D358-F361 HydrophobicContact CB-CB 4.11Å; D358-F361 PolarHBondContact O-N 3.27Å; D358-F361 PolarHBondContact OD2-N 3.14Å; F361-D364 PolarHBondContact O-N 3.5Å; F361-L365 WeakPolarHBondContact O-CB 3.45Å; F361-L365 PolarHBondContact O-N 3.13Å
362	I	96.3	Very high	96.8	Very high	18 Å²	18	50.6 Å²	50.6	9%	0.092	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-46	177.1	-63.1	-57.2	0	0	0	111.5	L356 D358 N360 L365 E366 I395	L356-I362 HydrophobicContact CD2-CD1 4.09Å; D358-I362 WeakPolarHBondContact O-CG1 3.37Å; D358-I362 PolarHBondContact O-N 3.45Å; N360-I362 PolarHBondContact O-N 2.98Å; I362-L365 WeakPolarHBondContact O-CB 3.49Å; I362-L365 PolarHBondContact O-N 3.08Å; I362-E366 WeakPolarHBondContact CG2-OE1 3.47Å; I362-E366 WeakPolarHBondContact O-CG 3.31Å; I362-E366 PolarHBondContact O-N 3.02Å; I362-I395 HydrophobicContact CD1-CD1 3.86Å; I362-I395 HydrophobicContact CD1-CG2 3.89Å
363	K	94.9	Very high	96.7	Very high	97 Å²	97	50.9 Å²	50.9	42%	0.422	27%	0.267	S	S	.	.	H	α-helix	trans	-60.4	-46.2	175.4	-178.4	-177.9	169.3	-174.8	0	111.7	P359 N360 L365 E366 E367	P359-K363 WeakPolarHBondContact O-CB 3.4Å; P359-K363 PolarHBondContact O-N 2.96Å; N360-K363 WeakPolarHBondContact O-CB 3.49Å; N360-K363 PolarHBondContact O-N 3.05Å; N360-K363 VanDerWaalsContact O-N 3.09Å; K363-L365 VanDerWaalsContact C-N 3.26Å; K363-L365 PolarHBondContact O-N 3.39Å; K363-E366 WeakPolarHBondContact O-CB 3.45Å; K363-E366 PolarHBondContact O-N 3.48Å; K363-E366 VanDerWaalsContact O-N 3.12Å; K363-E367 WeakPolarHBondContact CE-OE1 3.36Å; K363-E367 IonicContact NZ-OE1 3.96Å; K363-E367 WeakPolarHBondContact O-CG 3.39Å; K363-E367 PolarHBondContact O-N 3.38Å
364	D	97.8	Very high	96.6	Very high	79 Å²	79	53.6 Å²	53.6	42%	0.422	28%	0.277	S	S	.	.	H	α-helix	trans	-63.4	-32.7	177.9	-64.9	-8.3	0	0	0	111.5	K168 N360 F361 D368	K168-D364 PolarHBondContact NZ-O 2.87Å; N360-D364 VanDerWaalsContact O-CG 3.27Å; N360-D364 PolarHBondContact O-N 3.34Å; F361-D364 PolarHBondContact O-N 3.5Å; D364-D368 PolarHBondContact O-N 3.03Å; D364-D368 VanDerWaalsContact O-N 3.08Å
365	L	97.9	Very high	96.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.5	-41	173.9	175.4	58.8	0	0	0	111.4	L164 V165 K168 F361 I362 K363 L369 M391	L164-L365 HydrophobicContact CD2-CD1 3.79Å; V165-L365 HydrophobicContact CG2-CD1 4.03Å; K168-L365 HydrophobicContact CB-CD1 4.47Å; K168-L365 HydrophobicContact CD-CB 3.8Å; K168-L365 HydrophobicContact CD-CD1 3.71Å; K168-L365 HydrophobicContact CD-CG 4.32Å; F361-L365 WeakPolarHBondContact O-CB 3.45Å; F361-L365 PolarHBondContact O-N 3.13Å; I362-L365 WeakPolarHBondContact O-CB 3.49Å; I362-L365 PolarHBondContact O-N 3.08Å; K363-L365 VanDerWaalsContact C-N 3.26Å; K363-L365 PolarHBondContact O-N 3.39Å; L365-L369 HydrophobicContact CD1-CD1 4.08Å; L365-L369 HydrophobicContact CD1-CG 4.25Å; L365-L369 HydrophobicContact CG-CD1 4.12Å; L365-L369 WeakPolarHBondContact O-CB 3.46Å; L365-L369 WeakPolarHBondContact O-CG 3.48Å; L365-L369 PolarHBondContact O-N 3.24Å; L365-M391 HydrophobicContact CD2-CE 4.22Å; L365-M391 HydrophobicContact CD2-SD 4.41Å; L365-M391 HydrophobicContact CG-CE 4.34Å
366	E	97.3	Very high	96	Very high	24 Å²	24	54.3 Å²	54.3	11%	0.112	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-39.1	175.7	-68.2	169.8	-147.3	0	0	112.5	I362 K363 L369 Y370 V388 M391 R392	I362-E366 WeakPolarHBondContact CG2-OE1 3.47Å; I362-E366 WeakPolarHBondContact O-CG 3.31Å; I362-E366 PolarHBondContact O-N 3.02Å; K363-E366 WeakPolarHBondContact O-CB 3.45Å; K363-E366 PolarHBondContact O-N 3.48Å; K363-E366 VanDerWaalsContact O-N 3.12Å; E366-L369 PolarHBondContact O-N 3.03Å; E366-Y370 VanDerWaalsContact O-CB 3.28Å; E366-Y370 WeakPolarHBondContact O-CB 3.35Å; E366-Y370 PolarHBondContact O-N 3.04Å; E366-V388 HydrophobicContact CG-CG1 3.76Å; E366-V388 HydrophobicContact CG-CG2 4.18Å; E366-V388 WeakPolarHBondContact OE2-CG1 3.42Å; E366-M391 HydrophobicContact CG-CE 3.86Å; E366-R392 IonicContact OE1-CZ 3.59Å; E366-R392 IonicContact OE1-NE 3.7Å; E366-R392 PolarHBondContact OE1-NE 3.13Å; E366-R392 IonicContact OE1-NH2 2.76Å; E366-R392 PolarHBondContact OE1-NH2 2.73Å; E366-R392 IonicContact OE2-CZ 2.7Å; E366-R392 VanDerWaalsContact OE2-CZ 3.31Å; E366-R392 IonicContact OE2-NE 2.69Å; E366-R392 IonicContact OE2-NH2 3.59Å; E366-R392 PolarHBondContact OE2-NH2 3.02Å
367	E	97.6	Very high	95.6	Very high	100 Å²	100	60.1 Å²	60.1	47%	0.467	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-44.7	175.5	-71	-173.4	-168.8	0	0	111	K363 L369 Y370 E371	K363-E367 WeakPolarHBondContact CE-OE1 3.36Å; K363-E367 IonicContact NZ-OE1 3.96Å; K363-E367 WeakPolarHBondContact O-CG 3.39Å; K363-E367 PolarHBondContact O-N 3.38Å; E367-L369 PolarHBondContact O-N 3.32Å; E367-Y370 WeakPolarHBondContact O-CB 3.33Å; E367-Y370 PolarHBondContact O-N 3.18Å; E367-E371 WeakPolarHBondContact O-CG 3.37Å; E367-E371 PolarHBondContact O-N 3.36Å
368	D	98.1	Very high	95.2	Very high	72 Å²	72	59.8 Å²	59.8	39%	0.385	32%	0.316	S	S	.	.	H	α-helix	trans	-61	-43.4	174.4	-77.4	-16	0	0	0	112.6	L164 K168 D364 Y370 E371 L372	L164-D368 HydrophobicContact CD1-CB 4.15Å; L164-D368 HydrophobicContact CD2-CB 3.92Å; L164-D368 HydrophobicContact CG-CB 4.48Å; K168-D368 IonicContact NZ-OD2 3.65Å; K168-D368 PolarHBondContact NZ-OD2 3.16Å; D364-D368 PolarHBondContact O-N 3.03Å; D364-D368 VanDerWaalsContact O-N 3.08Å; D368-Y370 VanDerWaalsContact C-N 3.34Å; D368-E371 PolarHBondContact O-N 3.4Å; D368-L372 PolarHBondContact O-N 2.98Å
369	L	98.2	Very high	95	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-66.2	-35.6	175.7	-74.6	170.8	0	0	0	111.9	L164 V165 F319 L365 E366 E367 L372 F373 F384 M391	L164-L369 HydrophobicContact CD1-CD2 4.48Å; L164-L369 HydrophobicContact CD2-CD2 4.13Å; L164-L369 HydrophobicContact CD2-CG 4.21Å; V165-L369 HydrophobicContact CG2-CD1 4.42Å; V165-L369 HydrophobicContact CG2-CD2 4.45Å; F319-L369 HydrophobicContact CE1-CD1 4.12Å; F319-L369 HydrophobicContact CE1-CD2 4.11Å; F319-L369 HydrophobicContact CZ-CD2 4.25Å; L365-L369 HydrophobicContact CD1-CD1 4.08Å; L365-L369 HydrophobicContact CD1-CG 4.25Å; L365-L369 HydrophobicContact CG-CD1 4.12Å; L365-L369 WeakPolarHBondContact O-CB 3.46Å; L365-L369 WeakPolarHBondContact O-CG 3.48Å; L365-L369 PolarHBondContact O-N 3.24Å; E366-L369 PolarHBondContact O-N 3.03Å; E367-L369 PolarHBondContact O-N 3.32Å; L369-L372 PolarHBondContact O-N 3.07Å; L369-F373 HydrophobicContact CD2-CE1 4.14Å; L369-F373 WeakPolarHBondContact O-CB 3.42Å; L369-F373 WeakPolarHBondContact O-CD1 3.47Å; L369-F373 WeakPolarHBondContact O-CG 3.44Å; L369-F373 PolarHBondContact O-N 2.93Å; L369-F384 HydrophobicContact CB-CE2 4.18Å; L369-F384 HydrophobicContact CB-CZ 4.18Å; L369-M391 HydrophobicContact CD1-CE 4.01Å; L369-M391 HydrophobicContact CD1-SD 3.64Å
370	Y	97.8	Very high	94.9	Very high	62 Å²	62	58.2 Å²	58.2	24%	0.243	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-46.2	174.2	179.7	-97.1	0	0	0	111.2	E366 E367 D368 L372 F373 K374 F379 R381 F384	E366-Y370 VanDerWaalsContact O-CB 3.28Å; E366-Y370 WeakPolarHBondContact O-CB 3.35Å; E366-Y370 PolarHBondContact O-N 3.04Å; E367-Y370 WeakPolarHBondContact O-CB 3.33Å; E367-Y370 PolarHBondContact O-N 3.18Å; D368-Y370 VanDerWaalsContact C-N 3.34Å; Y370-L372 VanDerWaalsContact C-N 3.25Å; Y370-L372 PolarHBondContact O-N 3.44Å; Y370-F373 PolarHBondContact O-N 3.25Å; Y370-K374 HydrophobicContact CD1-CD 4.17Å; Y370-K374 HydrophobicContact CE1-CD 3.92Å; Y370-K374 VanDerWaalsContact O-CB 3.27Å; Y370-K374 WeakPolarHBondContact O-CB 3.46Å; Y370-K374 VanDerWaalsContact O-CG 3.28Å; Y370-K374 WeakPolarHBondContact O-CG 3.47Å; Y370-K374 PolarHBondContact O-N 3.48Å; Y370-F379 HydrophobicContact CD2-CE1 4.42Å; Y370-F379 AromaticContact CD2-CZ 3.76Å; Y370-F379 HydrophobicContact CD2-CZ 3.76Å; Y370-F379 AromaticContact CE2-CE1 3.82Å; Y370-F379 HydrophobicContact CE2-CE1 3.82Å; Y370-F379 AromaticContact CE2-CZ 3.6Å; Y370-F379 HydrophobicContact CE2-CZ 3.6Å; Y370-R381 HydrophobicContact CE2-CG 4.44Å; Y370-F384 AromaticContact CD2-CD1 3.78Å; Y370-F384 HydrophobicContact CD2-CD1 3.78Å; Y370-F384 AromaticContact CD2-CE1 3.75Å; Y370-F384 HydrophobicContact CD2-CE1 3.75Å; Y370-F384 HydrophobicContact CD2-CG 4.35Å; Y370-F384 HydrophobicContact CD2-CZ 4.3Å; Y370-F384 HydrophobicContact CG-CE1 4.25Å; Y370-F384 HydrophobicContact CG-CZ 4.5Å
371	E	97.4	Very high	94.8	Very high	90 Å²	90	59.6 Å²	59.6	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-62.1	-31.9	176.1	-71.5	-58.7	112.6	0	0	112.7	E367 D368 K374 K375	E367-E371 WeakPolarHBondContact O-CG 3.37Å; E367-E371 PolarHBondContact O-N 3.36Å; D368-E371 PolarHBondContact O-N 3.4Å; E371-K374 VanDerWaalsContact CD-CE 3.48Å; E371-K374 VanDerWaalsContact OE1-CE 3.3Å; E371-K374 WeakPolarHBondContact OE1-CE 3.18Å; E371-K374 IonicContact OE1-NZ 2.67Å; E371-K374 PolarHBondContact OE1-NZ 2.68Å; E371-K374 WeakPolarHBondContact OE2-CE 3.47Å; E371-K374 IonicContact OE2-NZ 2.7Å; E371-K374 PolarHBondContact OE2-NZ 2.79Å; E371-K375 VanDerWaalsContact O-CE 3.28Å; E371-K375 WeakPolarHBondContact O-CE 3.46Å
372	L	96.6	Very high	94.5	Very high	14 Å²	14	59.9 Å²	59.9	7%	0.073	31%	0.309	C	S	.	.	H	α-helix	trans	-73.1	-52.4	171.7	178.8	62.2	0	0	0	112.2	L157 A160 L164 V179 D368 L369 Y370 K375	L157-L372 HydrophobicContact CD2-CD1 4.24Å; L157-L372 HydrophobicContact CD2-CG 4.26Å; A160-L372 HydrophobicContact CB-CD1 4.14Å; A160-L372 HydrophobicContact CB-CD2 4.01Å; L164-L372 HydrophobicContact CD1-CB 4.2Å; L164-L372 HydrophobicContact CD1-CD2 3.9Å; V179-L372 HydrophobicContact CG2-CD1 3.9Å; D368-L372 PolarHBondContact O-N 2.98Å; L369-L372 PolarHBondContact O-N 3.07Å; Y370-L372 VanDerWaalsContact C-N 3.25Å; Y370-L372 PolarHBondContact O-N 3.44Å; L372-K375 HydrophobicContact CD1-CD 4.46Å; L372-K375 VanDerWaalsContact O-CB 3.31Å; L372-K375 WeakPolarHBondContact O-CB 3.33Å; L372-K375 WeakPolarHBondContact O-CG 3.31Å; L372-K375 PolarHBondContact O-N 3.02Å
373	F	95.9	Very high	94.3	Very high	5 Å²	5	62.3 Å²	62.3	2%	0.022	32%	0.32	C	S	.	.	H	α-helix	trans	-74.4	-31.2	-169	-78	29.6	0	0	0	112.1	L157 F319 L369 Y370 K375 D376 F379 F384	L157-F373 HydrophobicContact CB-CD1 4.18Å; L157-F373 HydrophobicContact CB-CE1 4.15Å; L157-F373 HydrophobicContact CD1-CB 4.32Å; L157-F373 HydrophobicContact CD1-CD1 4.44Å; L157-F373 HydrophobicContact CD1-CG 4.32Å; F319-F373 HydrophobicContact CB-CE2 4.22Å; F319-F373 HydrophobicContact CB-CZ 4.22Å; F319-F373 HydrophobicContact CD1-CZ 4.2Å; F319-F373 HydrophobicContact CD2-CZ 4Å; F319-F373 HydrophobicContact CE2-CZ 4.43Å; F319-F373 HydrophobicContact CG-CE2 4.33Å; F319-F373 AromaticContact CG-CZ 3.88Å; F319-F373 HydrophobicContact CG-CZ 3.88Å; L369-F373 HydrophobicContact CD2-CE1 4.14Å; L369-F373 WeakPolarHBondContact O-CB 3.42Å; L369-F373 WeakPolarHBondContact O-CD1 3.47Å; L369-F373 WeakPolarHBondContact O-CG 3.44Å; L369-F373 PolarHBondContact O-N 2.93Å; Y370-F373 PolarHBondContact O-N 3.25Å; F373-K375 PolarHBondContact O-N 2.92Å; F373-D376 PolarHBondContact O-N 3.03Å; F373-D376 VanDerWaalsContact O-N 3.09Å; F373-F379 VanDerWaalsContact C-CD2 3.44Å; F373-F379 HydrophobicContact CB-CD2 3.97Å; F373-F379 HydrophobicContact CB-CE2 3.77Å; F373-F379 VanDerWaalsContact O-CD2 3.31Å; F373-F379 WeakPolarHBondContact O-CD2 3.5Å; F373-F384 HydrophobicContact CB-CD2 4.12Å; F373-F384 HydrophobicContact CB-CE2 4.24Å; F373-F384 AromaticContact CD2-CD2 3.88Å; F373-F384 HydrophobicContact CD2-CD2 3.88Å; F373-F384 HydrophobicContact CD2-CE2 4.08Å; F373-F384 HydrophobicContact CG-CD2 4.29Å; F373-F384 HydrophobicContact CG-CE2 4.25Å
374	K	95.4	Very high	94.3	Very high	91 Å²	91	58.1 Å²	58.1	40%	0.396	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-9	175.2	79.7	-179	-170	-178.9	0	114.4	Y370 E371 D376 F379	Y370-K374 HydrophobicContact CD1-CD 4.17Å; Y370-K374 HydrophobicContact CE1-CD 3.92Å; Y370-K374 VanDerWaalsContact O-CB 3.27Å; Y370-K374 WeakPolarHBondContact O-CB 3.46Å; Y370-K374 VanDerWaalsContact O-CG 3.28Å; Y370-K374 WeakPolarHBondContact O-CG 3.47Å; Y370-K374 PolarHBondContact O-N 3.48Å; E371-K374 VanDerWaalsContact CD-CE 3.48Å; E371-K374 VanDerWaalsContact OE1-CE 3.3Å; E371-K374 WeakPolarHBondContact OE1-CE 3.18Å; E371-K374 IonicContact OE1-NZ 2.67Å; E371-K374 PolarHBondContact OE1-NZ 2.68Å; E371-K374 WeakPolarHBondContact OE2-CE 3.47Å; E371-K374 IonicContact OE2-NZ 2.7Å; E371-K374 PolarHBondContact OE2-NZ 2.79Å; K374-D376 PolarHBondContact O-N 2.92Å; K374-F379 HydrophobicContact CB-CD1 4.11Å; K374-F379 HydrophobicContact CB-CE1 4.12Å; K374-F379 HydrophobicContact CB-CG 4.33Å; K374-F379 HydrophobicContact CB-CZ 4.34Å
375	K	91.6	Very high	94.2	Very high	124 Å²	124	59 Å²	59	54%	0.539	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-15.9	173.5	-62.6	173.2	-175.9	170.2	0	112.2	E371 L372 F373	E371-K375 VanDerWaalsContact O-CE 3.28Å; E371-K375 WeakPolarHBondContact O-CE 3.46Å; L372-K375 HydrophobicContact CD1-CD 4.46Å; L372-K375 VanDerWaalsContact O-CB 3.31Å; L372-K375 WeakPolarHBondContact O-CB 3.33Å; L372-K375 WeakPolarHBondContact O-CG 3.31Å; L372-K375 PolarHBondContact O-N 3.02Å; F373-K375 PolarHBondContact O-N 2.92Å
376	D	91.3	Very high	94	Very high	11 Å²	11	64.6 Å²	64.6	6%	0.059	33%	0.327	C	S	.	.	S	Bend	trans	-76.2	129.4	176	-156	-73.7	0	0	0	112.1	K120 Y156 L157 F373 K374 G378 F379	K120-D376 WeakPolarHBondContact CE-OD2 3.46Å; K120-D376 IonicContact NZ-OD1 2.63Å; K120-D376 PolarHBondContact NZ-OD1 3.5Å; K120-D376 IonicContact NZ-OD2 3.79Å; K120-D376 PolarHBondContact NZ-OD2 3.39Å; Y156-D376 WeakPolarHBondContact CE1-OD2 3.18Å; Y156-D376 PolarHBondContact OH-OD2 3.43Å; L157-D376 HydrophobicContact CD1-CB 3.81Å; F373-D376 PolarHBondContact O-N 3.03Å; F373-D376 VanDerWaalsContact O-N 3.09Å; K374-D376 PolarHBondContact O-N 2.92Å; D376-G378 PolarHBondContact O-N 3.44Å; D376-G378 VanDerWaalsContact O-N 3.13Å; D376-G378 WeakPolarHBondContact OD1-CA 3.31Å; D376-G378 PolarHBondContact OD1-N 3.12Å; D376-F379 HydrophobicContact CB-CB 4.27Å; D376-F379 VanDerWaalsContact O-CB 3.24Å; D376-F379 WeakPolarHBondContact O-CB 3.31Å; D376-F379 PolarHBondContact O-N 2.97Å
377	P	87.8	Confident	93.9	Very high	129 Å²	129	64.1 Å²	64.1	84%	0.838	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.6	172.4	-26.1	35.4	0	0	0	115.1
378	G	85.6	Confident	93.9	Very high	49 Å²	49	59.7 Å²	59.7	51%	0.505	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	19.8	174.8	0	0	0	0	0	113.8	D376 D380	D376-G378 PolarHBondContact O-N 3.44Å; D376-G378 VanDerWaalsContact O-N 3.13Å; D376-G378 WeakPolarHBondContact OD1-CA 3.31Å; D376-G378 PolarHBondContact OD1-N 3.12Å; G378-D380 PolarHBondContact O-N 3.11Å
379	F	91.2	Very high	93.8	Very high	46 Å²	46	56.6 Å²	56.6	20%	0.202	29%	0.289	C	S	.	.			trans	-63	122.4	175.9	177	-101.6	0	0	0	111.5	Y370 F373 K374 D376 R381 F384	Y370-F379 HydrophobicContact CD2-CE1 4.42Å; Y370-F379 AromaticContact CD2-CZ 3.76Å; Y370-F379 HydrophobicContact CD2-CZ 3.76Å; Y370-F379 AromaticContact CE2-CE1 3.82Å; Y370-F379 HydrophobicContact CE2-CE1 3.82Å; Y370-F379 AromaticContact CE2-CZ 3.6Å; Y370-F379 HydrophobicContact CE2-CZ 3.6Å; F373-F379 VanDerWaalsContact C-CD2 3.44Å; F373-F379 HydrophobicContact CB-CD2 3.97Å; F373-F379 HydrophobicContact CB-CE2 3.77Å; F373-F379 VanDerWaalsContact O-CD2 3.31Å; F373-F379 WeakPolarHBondContact O-CD2 3.5Å; K374-F379 HydrophobicContact CB-CD1 4.11Å; K374-F379 HydrophobicContact CB-CE1 4.12Å; K374-F379 HydrophobicContact CB-CG 4.33Å; K374-F379 HydrophobicContact CB-CZ 4.34Å; D376-F379 HydrophobicContact CB-CB 4.27Å; D376-F379 VanDerWaalsContact O-CB 3.24Å; D376-F379 WeakPolarHBondContact O-CB 3.31Å; D376-F379 PolarHBondContact O-N 2.97Å; F379-R381 HydrophobicContact CE1-CB 4.22Å; F379-F384 HydrophobicContact CE2-CB 3.66Å; F379-F384 AromaticContact CE2-CD2 3.89Å; F379-F384 HydrophobicContact CE2-CD2 3.89Å; F379-F384 AromaticContact CE2-CG 3.88Å; F379-F384 HydrophobicContact CE2-CG 3.88Å; F379-F384 HydrophobicContact CZ-CB 3.7Å; F379-F384 HydrophobicContact CZ-CD2 4.33Å; F379-F384 AromaticContact CZ-CG 3.93Å; F379-F384 HydrophobicContact CZ-CG 3.93Å
380	D	91.3	Very high	93.7	Very high	75 Å²	75	56.6 Å²	56.6	40%	0.401	29%	0.289	S	S	.	.			trans	-109.3	128.2	168	174.5	-116.3	0	0	0	110.8	G378 G382 Q383 F384	G378-D380 PolarHBondContact O-N 3.11Å; D380-G382 VanDerWaalsContact C-N 3.29Å; D380-G382 PolarHBondContact O-N 2.66Å; D380-G382 VanDerWaalsContact OD1-CA 3.28Å; D380-G382 WeakPolarHBondContact OD1-CA 3.28Å; D380-G382 PolarHBondContact OD1-N 3.39Å; D380-G382 PolarHBondContact OD2-N 3.01Å; D380-Q383 HydrophobicContact CB-CB 4.09Å; D380-Q383 HydrophobicContact CB-CG 4.05Å; D380-Q383 PolarHBondContact O-N 2.62Å; D380-Q383 WeakPolarHBondContact OD1-CG 3.27Å; D380-Q383 PolarHBondContact OD1-N 3.08Å; D380-F384 PolarHBondContact O-N 2.83Å
381	R	93	Very high	93.7	Very high	133 Å²	133	54 Å²	54	50%	0.502	28%	0.279	S	S	.	.	H	α-helix	trans	-69.3	-28.6	-179.4	-171.1	170.8	-174.5	171	2	112.1	Y370 F379 H385	Y370-R381 HydrophobicContact CE2-CG 4.44Å; F379-R381 HydrophobicContact CE1-CB 4.22Å; R381-H385 WeakPolarHBondContact CG-NE2 3.34Å; R381-H385 PolarHBondContact NE-NE2 3.24Å; R381-H385 PolarHBondContact O-CD2 3.42Å; R381-H385 PolarHBondContact O-N 3.47Å; R381-H385 VanDerWaalsContact O-N 3.13Å
382	G	92.4	Very high	93.6	Very high	36 Å²	36	51.1 Å²	51.1	37%	0.371	26%	0.264	S	S	.	.	H	α-helix	trans	-68	-41.4	175.4	0	0	0	0	0	112.3	D380 K386	D380-G382 VanDerWaalsContact C-N 3.29Å; D380-G382 PolarHBondContact O-N 2.66Å; D380-G382 VanDerWaalsContact OD1-CA 3.28Å; D380-G382 WeakPolarHBondContact OD1-CA 3.28Å; D380-G382 PolarHBondContact OD1-N 3.39Å; D380-G382 PolarHBondContact OD2-N 3.01Å; G382-K386 WeakPolarHBondContact O-CG 3.5Å; G382-K386 PolarHBondContact O-N 3.4Å
383	Q	91.4	Very high	93.6	Very high	68 Å²	68	50.5 Å²	50.5	32%	0.318	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-48.9	171.3	-74.9	177	18	0	0	111.4	V151 L321 D380 H385 K386 Q387	V151-Q383 VanDerWaalsContact CG1-OE1 3.28Å; V151-Q383 HydrophobicContact CG2-CB 4.45Å; L321-Q383 HydrophobicContact CD1-CG 4.47Å; L321-Q383 HydrophobicContact CD2-CB 3.59Å; L321-Q383 HydrophobicContact CD2-CG 3.89Å; L321-Q383 VanDerWaalsContact CD2-O 3.26Å; L321-Q383 WeakPolarHBondContact CD2-O 3.29Å; D380-Q383 HydrophobicContact CB-CB 4.09Å; D380-Q383 HydrophobicContact CB-CG 4.05Å; D380-Q383 PolarHBondContact O-N 2.62Å; D380-Q383 WeakPolarHBondContact OD1-CG 3.27Å; D380-Q383 PolarHBondContact OD1-N 3.08Å; Q383-H385 PolarHBondContact O-N 2.86Å; Q383-K386 WeakPolarHBondContact O-CA 3.43Å; Q383-K386 WeakPolarHBondContact O-CB 3.39Å; Q383-K386 PolarHBondContact O-N 3.09Å; Q383-Q387 PolarHBondContact O-N 2.6Å
384	F	95.4	Very high	93.7	Very high	10 Å²	10	50.5 Å²	50.5	4%	0.044	26%	0.261	C	S	.	.	H	α-helix	trans	-56.7	-45.4	178.4	-177.2	-98.2	0	0	0	113.1	L369 Y370 F373 F379 D380 K386 Q387 V388	L369-F384 HydrophobicContact CB-CE2 4.18Å; L369-F384 HydrophobicContact CB-CZ 4.18Å; Y370-F384 AromaticContact CD2-CD1 3.78Å; Y370-F384 HydrophobicContact CD2-CD1 3.78Å; Y370-F384 AromaticContact CD2-CE1 3.75Å; Y370-F384 HydrophobicContact CD2-CE1 3.75Å; Y370-F384 HydrophobicContact CD2-CG 4.35Å; Y370-F384 HydrophobicContact CD2-CZ 4.3Å; Y370-F384 HydrophobicContact CG-CE1 4.25Å; Y370-F384 HydrophobicContact CG-CZ 4.5Å; F373-F384 HydrophobicContact CB-CD2 4.12Å; F373-F384 HydrophobicContact CB-CE2 4.24Å; F373-F384 AromaticContact CD2-CD2 3.88Å; F373-F384 HydrophobicContact CD2-CD2 3.88Å; F373-F384 HydrophobicContact CD2-CE2 4.08Å; F373-F384 HydrophobicContact CG-CD2 4.29Å; F373-F384 HydrophobicContact CG-CE2 4.25Å; F379-F384 HydrophobicContact CE2-CB 3.66Å; F379-F384 AromaticContact CE2-CD2 3.89Å; F379-F384 HydrophobicContact CE2-CD2 3.89Å; F379-F384 AromaticContact CE2-CG 3.88Å; F379-F384 HydrophobicContact CE2-CG 3.88Å; F379-F384 HydrophobicContact CZ-CB 3.7Å; F379-F384 HydrophobicContact CZ-CD2 4.33Å; F379-F384 AromaticContact CZ-CG 3.93Å; F379-F384 HydrophobicContact CZ-CG 3.93Å; D380-F384 PolarHBondContact O-N 2.83Å; F384-K386 PolarHBondContact O-N 3.09Å; F384-Q387 PolarHBondContact O-N 3.14Å; F384-Q387 VanDerWaalsContact O-N 3.08Å; F384-V388 HydrophobicContact CD1-CG2 4.06Å; F384-V388 HydrophobicContact CE1-CG2 3.52Å; F384-V388 HydrophobicContact CE2-CG2 4.25Å; F384-V388 HydrophobicContact CZ-CG2 3.62Å; F384-V388 PolarHBondContact O-N 3.09Å
385	H	94.8	Very high	93.8	Very high	97 Å²	97	46.6 Å²	46.6	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-58.2	-31.6	175.9	-79.6	-57.5	0	0	0	113.2	R381 Q383 S389	R381-H385 WeakPolarHBondContact CG-NE2 3.34Å; R381-H385 PolarHBondContact NE-NE2 3.24Å; R381-H385 PolarHBondContact O-CD2 3.42Å; R381-H385 PolarHBondContact O-N 3.47Å; R381-H385 VanDerWaalsContact O-N 3.13Å; Q383-H385 PolarHBondContact O-N 2.86Å; H385-S389 WeakPolarHBondContact O-CB 3.24Å; H385-S389 PolarHBondContact O-N 3.43Å; H385-S389 PolarHBondContact O-OG 3.32Å
386	K	94.4	Very high	94.1	Very high	118 Å²	118	43.7 Å²	43.7	51%	0.513	23%	0.234	S	C	.	.	H	α-helix	trans	-75.7	-36.5	174.9	-67.2	175.4	179.8	-179.9	0	113	L321 G382 Q383 F384 V388 S389 V390	L321-K386 HydrophobicContact CB-CB 4.49Å; L321-K386 HydrophobicContact CD2-CB 4.18Å; L321-K386 WeakPolarHBondContact O-CB 3.28Å; G382-K386 WeakPolarHBondContact O-CG 3.5Å; G382-K386 PolarHBondContact O-N 3.4Å; Q383-K386 WeakPolarHBondContact O-CA 3.43Å; Q383-K386 WeakPolarHBondContact O-CB 3.39Å; Q383-K386 PolarHBondContact O-N 3.09Å; F384-K386 PolarHBondContact O-N 3.09Å; K386-V388 VanDerWaalsContact C-N 3.32Å; K386-S389 PolarHBondContact O-N 3.02Å; K386-S389 PolarHBondContact O-OG 2.94Å; K386-S389 VanDerWaalsContact O-OG 3.1Å; K386-V390 WeakPolarHBondContact O-CG2 3.2Å; K386-V390 PolarHBondContact O-N 3.33Å; K386-V390 VanDerWaalsContact O-N 3.15Å
387	Q	95.6	Very high	94.4	Very high	14 Å²	14	43.8 Å²	43.8	7%	0.065	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-44.1	172.9	-61.4	175	-72.2	0	0	110.3	F319 L321 Q383 F384 V390 M391	F319-Q387 WeakPolarHBondContact O-CG 2.99Å; F319-Q387 PolarHBondContact O-NE2 2.91Å; L321-Q387 HydrophobicContact CD2-CG 3.8Å; L321-Q387 HydrophobicContact CG-CG 4.44Å; Q383-Q387 PolarHBondContact O-N 2.6Å; F384-Q387 PolarHBondContact O-N 3.14Å; F384-Q387 VanDerWaalsContact O-N 3.08Å; Q387-V390 PolarHBondContact O-N 2.84Å; Q387-M391 WeakPolarHBondContact O-CB 3.43Å; Q387-M391 PolarHBondContact O-N 2.84Å
388	V	96.4	Very high	94.9	Very high	6 Å²	6	37.6 Å²	37.6	4%	0.036	20%	0.195	C	C	.	.	H	α-helix	trans	-63.7	-42.9	175.7	168.4	0	0	0	0	112.3	E366 F384 K386 V390 M391 R392	E366-V388 HydrophobicContact CG-CG1 3.76Å; E366-V388 HydrophobicContact CG-CG2 4.18Å; E366-V388 WeakPolarHBondContact OE2-CG1 3.42Å; F384-V388 HydrophobicContact CD1-CG2 4.06Å; F384-V388 HydrophobicContact CE1-CG2 3.52Å; F384-V388 HydrophobicContact CE2-CG2 4.25Å; F384-V388 HydrophobicContact CZ-CG2 3.62Å; F384-V388 PolarHBondContact O-N 3.09Å; K386-V388 VanDerWaalsContact C-N 3.32Å; V388-V390 VanDerWaalsContact C-N 3.31Å; V388-V390 PolarHBondContact O-N 3.35Å; V388-M391 PolarHBondContact O-N 3.46Å; V388-R392 HydrophobicContact CG1-CG 4.36Å; V388-R392 WeakPolarHBondContact O-CG 3.5Å; V388-R392 PolarHBondContact O-N 2.78Å
389	S	95.9	Very high	95.5	Very high	8 Å²	8	35.8 Å²	35.8	6%	0.056	17%	0.174	C	C	.	.	H	α-helix	trans	-67.4	-30.9	-179.5	68.8	0	0	0	0	113.3	H385 K386 G393 I418 V419	H385-S389 WeakPolarHBondContact O-CB 3.24Å; H385-S389 PolarHBondContact O-N 3.43Å; H385-S389 PolarHBondContact O-OG 3.32Å; K386-S389 PolarHBondContact O-N 3.02Å; K386-S389 PolarHBondContact O-OG 2.94Å; K386-S389 VanDerWaalsContact O-OG 3.1Å; S389-G393 PolarHBondContact O-N 3.34Å; S389-I418 WeakPolarHBondContact OG-CG2 3.46Å; S389-V419 VanDerWaalsContact CA-O 3.29Å; S389-V419 WeakPolarHBondContact CA-O 3.45Å; S389-V419 WeakPolarHBondContact CB-O 3.29Å; S389-V419 PolarHBondContact O-N 3.13Å
390	V	96.3	Very high	95.8	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-68.3	-49.7	168.1	172.7	0	0	0	0	111	R271 P320 K386 Q387 V388 R392 G393 Q394 I418	R271-V390 HydrophobicContact CB-CG1 4.45Å; P320-V390 HydrophobicContact CG-CG1 4.23Å; K386-V390 WeakPolarHBondContact O-CG2 3.2Å; K386-V390 PolarHBondContact O-N 3.33Å; K386-V390 VanDerWaalsContact O-N 3.15Å; Q387-V390 PolarHBondContact O-N 2.84Å; V388-V390 VanDerWaalsContact C-N 3.31Å; V388-V390 PolarHBondContact O-N 3.35Å; V390-R392 VanDerWaalsContact C-N 3.33Å; V390-R392 PolarHBondContact O-N 3.38Å; V390-G393 WeakPolarHBondContact O-CA 3.46Å; V390-G393 PolarHBondContact O-N 2.9Å; V390-Q394 PolarHBondContact O-N 3.21Å; V390-I418 HydrophobicContact CG2-CD1 4.32Å; V390-I418 HydrophobicContact CG2-CG1 4.34Å
391	M	97.4	Very high	96.1	Very high	7 Å²	7	34.2 Å²	34.2	3%	0.034	17%	0.165	C	C	.	.	H	α-helix	trans	-56.2	-45	179.7	-174.7	-177.6	76.4	0	0	111.9	I269 L365 E366 L369 Q387 V388 G393 Q394 I395	I269-M391 HydrophobicContact CG2-CG 4.04Å; I269-M391 HydrophobicContact CG2-SD 4.47Å; L365-M391 HydrophobicContact CD2-CE 4.22Å; L365-M391 HydrophobicContact CD2-SD 4.41Å; L365-M391 HydrophobicContact CG-CE 4.34Å; E366-M391 HydrophobicContact CG-CE 3.86Å; L369-M391 HydrophobicContact CD1-CE 4.01Å; L369-M391 HydrophobicContact CD1-SD 3.64Å; Q387-M391 WeakPolarHBondContact O-CB 3.43Å; Q387-M391 PolarHBondContact O-N 2.84Å; V388-M391 PolarHBondContact O-N 3.46Å; M391-G393 VanDerWaalsContact C-N 3.32Å; M391-G393 PolarHBondContact O-N 3.45Å; M391-Q394 WeakPolarHBondContact O-CB 3.37Å; M391-Q394 PolarHBondContact O-N 2.91Å; M391-I395 HydrophobicContact CE-CD1 4.38Å; M391-I395 HydrophobicContact CG-CD1 3.92Å; M391-I395 VanDerWaalsContact O-CG1 3.3Å; M391-I395 WeakPolarHBondContact O-CG1 3.39Å; M391-I395 PolarHBondContact O-N 2.84Å
392	R	96.6	Very high	96.3	Very high	31 Å²	31	28 Å²	28	12%	0.117	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-37.6	174.2	-74.1	174.1	172.5	164.5	-7.4	113.4	E366 V388 V390 I395 L396 V419 T421	E366-R392 IonicContact OE1-CZ 3.59Å; E366-R392 IonicContact OE1-NE 3.7Å; E366-R392 PolarHBondContact OE1-NE 3.13Å; E366-R392 IonicContact OE1-NH2 2.76Å; E366-R392 PolarHBondContact OE1-NH2 2.73Å; E366-R392 IonicContact OE2-CZ 2.7Å; E366-R392 VanDerWaalsContact OE2-CZ 3.31Å; E366-R392 IonicContact OE2-NE 2.69Å; E366-R392 IonicContact OE2-NH2 3.59Å; E366-R392 PolarHBondContact OE2-NH2 3.02Å; V388-R392 HydrophobicContact CG1-CG 4.36Å; V388-R392 WeakPolarHBondContact O-CG 3.5Å; V388-R392 PolarHBondContact O-N 2.78Å; V390-R392 VanDerWaalsContact C-N 3.33Å; V390-R392 PolarHBondContact O-N 3.38Å; R392-I395 PolarHBondContact O-N 2.96Å; R392-L396 WeakPolarHBondContact O-CB 3.27Å; R392-L396 PolarHBondContact O-N 3.03Å; R392-V419 HydrophobicContact CB-CB 3.85Å; R392-V419 HydrophobicContact CB-CG1 4.42Å; R392-V419 HydrophobicContact CB-CG2 4.46Å; R392-T421 PolarHBondContact NH1-OG1 2.6Å
393	G	96.3	Very high	96.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.7	-38.8	174.5	0	0	0	0	0	113	S389 V390 M391 N397 V417	S389-G393 PolarHBondContact O-N 3.34Å; V390-G393 WeakPolarHBondContact O-CA 3.46Å; V390-G393 PolarHBondContact O-N 2.9Å; M391-G393 VanDerWaalsContact C-N 3.32Å; M391-G393 PolarHBondContact O-N 3.45Å; G393-N397 PolarHBondContact O-N 2.74Å; G393-V417 WeakPolarHBondContact CA-O 3.24Å
394	Q	97.3	Very high	96.8	Very high	5 Å²	5	33 Å²	33	2%	0.023	16%	0.157	C	C	.	.	H	α-helix	trans	-64.5	-46.5	171.5	-58.7	-66.3	1.2	0	0	111.2	Y268 R271 H323 V390 M391 L396 N397 L398	Y268-Q394 HydrophobicContact CD1-CB 3.93Å; Y268-Q394 HydrophobicContact CE1-CB 4.03Å; Y268-Q394 VanDerWaalsContact CE1-O 3.26Å; Y268-Q394 WeakPolarHBondContact CE1-O 3.33Å; Y268-Q394 VanDerWaalsContact O-CB 3.27Å; Y268-Q394 WeakPolarHBondContact O-CB 3.47Å; Y268-Q394 WeakPolarHBondContact O-CG 3.48Å; R271-Q394 HydrophobicContact CB-CG 4.08Å; R271-Q394 VanDerWaalsContact CG-NE2 3.33Å; H323-Q394 PolarHBondContact CE1-NE2 3.06Å; H323-Q394 PolarHBondContact ND1-NE2 3.47Å; V390-Q394 PolarHBondContact O-N 3.21Å; M391-Q394 WeakPolarHBondContact O-CB 3.37Å; M391-Q394 PolarHBondContact O-N 2.91Å; Q394-L396 VanDerWaalsContact C-N 3.32Å; Q394-L396 PolarHBondContact O-N 3.4Å; Q394-N397 PolarHBondContact O-N 3.07Å; Q394-L398 WeakPolarHBondContact O-CB 3.44Å; Q394-L398 PolarHBondContact O-N 2.9Å
395	I	97.9	Very high	96.9	Very high	9 Å²	9	33.9 Å²	33.9	5%	0.046	17%	0.168	C	C	.	.	H	α-helix	trans	-60.3	-42.2	179	-69.2	166.3	0	0	0	111.3	I269 L356 I362 M391 R392 L398 C399	I269-I395 HydrophobicContact CG1-CG1 4.06Å; I269-I395 HydrophobicContact CG2-CD1 4.18Å; I269-I395 HydrophobicContact CG2-CG1 4.12Å; L356-I395 HydrophobicContact CB-CG2 4.21Å; L356-I395 HydrophobicContact CD2-CG1 4.29Å; L356-I395 HydrophobicContact CD2-CG2 4.12Å; I362-I395 HydrophobicContact CD1-CD1 3.86Å; I362-I395 HydrophobicContact CD1-CG2 3.89Å; M391-I395 HydrophobicContact CE-CD1 4.38Å; M391-I395 HydrophobicContact CG-CD1 3.92Å; M391-I395 VanDerWaalsContact O-CG1 3.3Å; M391-I395 WeakPolarHBondContact O-CG1 3.39Å; M391-I395 PolarHBondContact O-N 2.84Å; R392-I395 PolarHBondContact O-N 2.96Å; I395-L398 PolarHBondContact O-N 3Å; I395-C399 WeakPolarHBondContact O-CB 3.28Å; I395-C399 PolarHBondContact O-N 3.45Å; I395-C399 PolarHBondContact O-SG 3.29Å
396	L	97.1	Very high	97	Very high	63 Å²	63	31.6 Å²	31.6	33%	0.33	16%	0.157	S	C	.	.	H	α-helix	trans	-58.8	-50.1	175.4	179.3	66	0	0	0	112	R392 Q394 C399 Q400 V417 V419 Q435	R392-L396 WeakPolarHBondContact O-CB 3.27Å; R392-L396 PolarHBondContact O-N 3.03Å; Q394-L396 VanDerWaalsContact C-N 3.32Å; Q394-L396 PolarHBondContact O-N 3.4Å; L396-C399 PolarHBondContact O-N 3.43Å; L396-Q400 PolarHBondContact O-N 2.92Å; L396-Q400 VanDerWaalsContact O-N 3.13Å; L396-V417 HydrophobicContact CD2-CG1 4.18Å; L396-V419 HydrophobicContact CD2-CG2 3.97Å; L396-Q435 HydrophobicContact CD2-CG 4.4Å
397	N	97.7	Very high	97.2	Very high	13 Å²	13	26.3 Å²	26.3	7%	0.07	14%	0.135	C	C	.	.	H	α-helix	trans	-62.8	-42.9	177.8	-83.2	-3.4	0	0	0	112	Y268 G393 Q394 Q400 A401 L411 M414 P415	Y268-N397 HydrophobicContact CE1-CB 3.91Å; Y268-N397 WeakPolarHBondContact OH-CB 3.21Å; Y268-N397 PolarHBondContact OH-ND2 2.97Å; G393-N397 PolarHBondContact O-N 2.74Å; Q394-N397 PolarHBondContact O-N 3.07Å; N397-Q400 PolarHBondContact O-N 3.37Å; N397-A401 WeakPolarHBondContact O-CB 3.27Å; N397-A401 PolarHBondContact O-N 2.9Å; N397-L411 HydrophobicContact CB-CD1 4.45Å; N397-M414 HydrophobicContact CB-CE 3.97Å; N397-M414 HydrophobicContact CB-SD 4.46Å; N397-P415 PolarHBondContact ND2-O 2.83Å
398	L	98.1	Very high	97.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-46.9	178.4	177	60.2	0	0	0	111.7	V265 Y268 I269 F344 L356 Q394 I395 Q400 A401 L402 L411	V265-L398 HydrophobicContact CB-CD2 4.5Å; V265-L398 HydrophobicContact CG1-CD2 4.07Å; V265-L398 HydrophobicContact CG2-CD1 4.39Å; V265-L398 HydrophobicContact CG2-CD2 4.33Å; Y268-L398 HydrophobicContact CD1-CB 4Å; Y268-L398 HydrophobicContact CE1-CB 4.23Å; I269-L398 HydrophobicContact CD1-CD2 3.78Å; I269-L398 HydrophobicContact CG1-CD2 3.69Å; F344-L398 HydrophobicContact CE2-CD1 4.45Å; F344-L398 HydrophobicContact CZ-CD1 4.32Å; L356-L398 HydrophobicContact CD1-CD2 3.67Å; L356-L398 HydrophobicContact CD1-CG 4.25Å; Q394-L398 WeakPolarHBondContact O-CB 3.44Å; Q394-L398 PolarHBondContact O-N 2.9Å; I395-L398 PolarHBondContact O-N 3Å; L398-Q400 VanDerWaalsContact C-N 3.28Å; L398-Q400 PolarHBondContact O-N 3.39Å; L398-A401 PolarHBondContact O-N 2.92Å; L398-L402 HydrophobicContact CD1-CD1 3.91Å; L398-L402 HydrophobicContact CD1-CG 3.97Å; L398-L402 HydrophobicContact CG-CD1 3.88Å; L398-L402 HydrophobicContact CG-CG 4.39Å; L398-L402 WeakPolarHBondContact O-CB 3.37Å; L398-L402 VanDerWaalsContact O-CG 3.28Å; L398-L402 WeakPolarHBondContact O-CG 3.12Å; L398-L402 PolarHBondContact O-N 2.61Å; L398-L411 HydrophobicContact CB-CD1 4.43Å; L398-L411 HydrophobicContact CD1-CD1 4.5Å; L398-L411 HydrophobicContact CD1-CD2 3.68Å
399	C	97.9	Very high	97.3	Very high	11 Å²	11	27.7 Å²	27.7	7%	0.074	14%	0.142	C	C	.	.	H	α-helix	trans	-56.8	-41.2	174.9	-82.1	0	0	0	0	112.2	L353 L356 I395 L396 K403	L353-C399 HydrophobicContact CD1-CB 4.26Å; L356-C399 WeakPolarHBondContact CB-SG 3.49Å; L356-C399 PolarHBondContact O-SG 3.49Å; I395-C399 WeakPolarHBondContact O-CB 3.28Å; I395-C399 PolarHBondContact O-N 3.45Å; I395-C399 PolarHBondContact O-SG 3.29Å; L396-C399 PolarHBondContact O-N 3.43Å; C399-K403 WeakPolarHBondContact O-CB 3.3Å; C399-K403 WeakPolarHBondContact O-CD 3.4Å; C399-K403 VanDerWaalsContact O-CG 3.23Å; C399-K403 WeakPolarHBondContact O-CG 3.38Å; C399-K403 PolarHBondContact O-N 3.33Å; C399-K403 VanDerWaalsContact O-N 3.15Å
400	Q	97.5	Very high	97.4	Very high	87 Å²	87	31.6 Å²	31.6	41%	0.407	16%	0.16	S	C	.	.	H	α-helix	trans	-68.9	-44	176.7	-171.4	60.6	45.2	0	0	111.7	L396 N397 L398 L402 K403 D404 M414	L396-Q400 PolarHBondContact O-N 2.92Å; L396-Q400 VanDerWaalsContact O-N 3.13Å; N397-Q400 PolarHBondContact O-N 3.37Å; L398-Q400 VanDerWaalsContact C-N 3.28Å; L398-Q400 PolarHBondContact O-N 3.39Å; Q400-L402 PolarHBondContact O-N 3.04Å; Q400-K403 PolarHBondContact O-N 2.67Å; Q400-D404 PolarHBondContact NE2-OD1 3.34Å; Q400-D404 PolarHBondContact NE2-OD2 2.97Å; Q400-D404 WeakPolarHBondContact O-CB 3.03Å; Q400-D404 PolarHBondContact O-N 3.11Å; Q400-M414 HydrophobicContact CB-CE 4.24Å; Q400-M414 HydrophobicContact CG-CE 4.4Å
401	A	97.9	Very high	97.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-40.2	177.3	0	0	0	0	0	113.2	N397 L398 D404 G405 K406 L411 M414	N397-A401 WeakPolarHBondContact O-CB 3.27Å; N397-A401 PolarHBondContact O-N 2.9Å; L398-A401 PolarHBondContact O-N 2.92Å; A401-D404 PolarHBondContact O-N 3.49Å; A401-G405 PolarHBondContact O-N 2.63Å; A401-G405 VanDerWaalsContact O-N 3.15Å; A401-K406 HydrophobicContact CB-CB 4.03Å; A401-K406 HydrophobicContact CB-CD 4.11Å; A401-K406 HydrophobicContact CB-CG 4.46Å; A401-K406 PolarHBondContact O-N 3.14Å; A401-L411 HydrophobicContact CB-CB 4.19Å; A401-L411 HydrophobicContact CB-CD1 3.63Å; A401-L411 HydrophobicContact CB-CG 4.43Å; A401-M414 HydrophobicContact CB-SD 3.99Å
402	L	97.8	Very high	97.3	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-43.7	176.1	-72	169.1	0	0	0	111.7	F344 I348 K349 V352 L353 L398 Q400 G405	F344-L402 HydrophobicContact CB-CD2 3.9Å; F344-L402 HydrophobicContact CD1-CD2 4.21Å; F344-L402 HydrophobicContact CD2-CD2 3.77Å; F344-L402 HydrophobicContact CE2-CD2 4.32Å; F344-L402 HydrophobicContact CG-CD2 3.72Å; I348-L402 HydrophobicContact CG2-CD2 4.34Å; K349-L402 WeakPolarHBondContact CE-O 3.45Å; K349-L402 HydrophobicContact CG-CB 4.23Å; K349-L402 HydrophobicContact CG-CD2 3.82Å; V352-L402 HydrophobicContact CG2-CD1 3.48Å; V352-L402 VanDerWaalsContact CG2-CD1 3.48Å; L353-L402 HydrophobicContact CD1-CB 4.09Å; L353-L402 HydrophobicContact CD1-CD1 4.27Å; L398-L402 HydrophobicContact CD1-CD1 3.91Å; L398-L402 HydrophobicContact CD1-CG 3.97Å; L398-L402 HydrophobicContact CG-CD1 3.88Å; L398-L402 HydrophobicContact CG-CG 4.39Å; L398-L402 WeakPolarHBondContact O-CB 3.37Å; L398-L402 VanDerWaalsContact O-CG 3.28Å; L398-L402 WeakPolarHBondContact O-CG 3.12Å; L398-L402 PolarHBondContact O-N 2.61Å; Q400-L402 PolarHBondContact O-N 3.04Å; L402-G405 PolarHBondContact O-N 3.32Å
403	K	97.4	Very high	97.1	Very high	125 Å²	125	38.1 Å²	38.1	54%	0.543	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-41.4	175.8	-73.4	169.4	-174.6	177.9	0	112.4	L353 C399 Q400 G405	L353-K403 HydrophobicContact CD1-CG 4.23Å; L353-K403 HydrophobicContact CD2-CG 3.91Å; C399-K403 WeakPolarHBondContact O-CB 3.3Å; C399-K403 WeakPolarHBondContact O-CD 3.4Å; C399-K403 VanDerWaalsContact O-CG 3.23Å; C399-K403 WeakPolarHBondContact O-CG 3.38Å; C399-K403 PolarHBondContact O-N 3.33Å; C399-K403 VanDerWaalsContact O-N 3.15Å; Q400-K403 PolarHBondContact O-N 2.67Å; K403-G405 PolarHBondContact O-N 2.96Å
404	D	97.5	Very high	97	Very high	86 Å²	86	39.6 Å²	39.6	46%	0.46	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.3	-180	-64.1	-19.9	0	0	0	113.7	Q400 A401 K406	Q400-D404 PolarHBondContact NE2-OD1 3.34Å; Q400-D404 PolarHBondContact NE2-OD2 2.97Å; Q400-D404 WeakPolarHBondContact O-CB 3.03Å; Q400-D404 PolarHBondContact O-N 3.11Å; A401-D404 PolarHBondContact O-N 3.49Å; D404-K406 VanDerWaalsContact C-N 3.31Å; D404-K406 HydrophobicContact CB-CG 4.01Å; D404-K406 PolarHBondContact O-N 3.27Å; D404-K406 IonicContact OD2-NZ 3.81Å; D404-K406 PolarHBondContact OD2-NZ 3.46Å
405	G	96.4	Very high	96.8	Very high	28 Å²	28	43.3 Å²	43.3	29%	0.289	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	29.6	-176.6	0	0	0	0	0	114.3	A343 A401 L402 K403	A343-G405 WeakPolarHBondContact CB-O 3.43Å; A401-G405 PolarHBondContact O-N 2.63Å; A401-G405 VanDerWaalsContact O-N 3.15Å; L402-G405 PolarHBondContact O-N 3.32Å; K403-G405 PolarHBondContact O-N 2.96Å
406	K	97.9	Very high	96.6	Very high	49 Å²	49	45.8 Å²	45.8	21%	0.213	24%	0.243	C	C	.	.			trans	-67.8	164.6	177.9	-68.7	-172.2	-178.9	101.4	0	112.4	F344 A401 D404 Q410 M414	F344-K406 WeakPolarHBondContact CD2-O 3.4Å; F344-K406 PolarHBondContact N-O 3.12Å; A401-K406 HydrophobicContact CB-CB 4.03Å; A401-K406 HydrophobicContact CB-CD 4.11Å; A401-K406 HydrophobicContact CB-CG 4.46Å; A401-K406 PolarHBondContact O-N 3.14Å; D404-K406 VanDerWaalsContact C-N 3.31Å; D404-K406 HydrophobicContact CB-CG 4.01Å; D404-K406 PolarHBondContact O-N 3.27Å; D404-K406 IonicContact OD2-NZ 3.81Å; D404-K406 PolarHBondContact OD2-NZ 3.46Å; K406-Q410 VanDerWaalsContact CA-OE1 3.31Å; K406-Q410 HydrophobicContact CB-CB 4Å; K406-Q410 HydrophobicContact CD-CB 4.15Å; K406-Q410 HydrophobicContact CG-CB 4.29Å; K406-M414 HydrophobicContact CD-SD 4.13Å
407	S	98.4	Very high	96.3	Very high	7 Å²	7	43 Å²	43	5%	0.049	23%	0.228	C	C	.	.			trans	-90.4	162	167.9	63.6	0	0	0	0	112.9	A340 K341 V342 L409 Q410 L411	A340-S407 WeakPolarHBondContact O-CB 3.42Å; K341-S407 WeakPolarHBondContact O-CB 3.45Å; V342-S407 WeakPolarHBondContact O-CA 3.42Å; V342-S407 WeakPolarHBondContact O-CB 3.46Å; S407-L409 PolarHBondContact O-N 3.01Å; S407-Q410 PolarHBondContact O-N 3Å; S407-Q410 WeakPolarHBondContact OG-CG 3.37Å; S407-Q410 PolarHBondContact OG-N 3.27Å; S407-Q410 PolarHBondContact OG-OE1 3.36Å; S407-L411 PolarHBondContact O-N 2.78Å
408	P	97.9	Very high	96	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-51.2	-38.8	171.6	-30.3	36.8	0	0	0	114.2	F260 V264 W334 A340 V342 F344 L411 V412	F260-P408 HydrophobicContact CE1-CG 4.29Å; V264-P408 HydrophobicContact CB-CB 4.49Å; V264-P408 HydrophobicContact CG1-CB 3.84Å; V264-P408 HydrophobicContact CG1-CG 4.1Å; V264-P408 HydrophobicContact CG2-CB 3.88Å; V264-P408 HydrophobicContact CG2-CG 4Å; W334-P408 HydrophobicContact CE3-CB 4.35Å; W334-P408 HydrophobicContact CH2-CB 4.49Å; W334-P408 HydrophobicContact CZ3-CB 3.7Å; A340-P408 HydrophobicContact CB-CB 4.08Å; A340-P408 WeakPolarHBondContact O-CD 3.12Å; V342-P408 WeakPolarHBondContact O-CD 3.44Å; F344-P408 HydrophobicContact CD1-CG 4.45Å; F344-P408 HydrophobicContact CE1-CG 3.88Å; F344-P408 HydrophobicContact CZ-CB 4.47Å; F344-P408 HydrophobicContact CZ-CG 3.98Å; P408-L411 WeakPolarHBondContact O-CB 3.36Å; P408-L411 PolarHBondContact O-N 3.13Å; P408-V412 PolarHBondContact O-N 2.95Å; P408-V412 VanDerWaalsContact O-N 3.14Å
409	L	96.8	Very high	95.7	Very high	48 Å²	48	44.1 Å²	44.1	25%	0.251	23%	0.234	S	C	.	.	H	α-helix	trans	-64.6	-42	176.2	176.5	58.7	0	0	0	111.9	A340 K341 S407 L411 V412 Q413	A340-L409 HydrophobicContact CB-CB 4.42Å; A340-L409 VanDerWaalsContact O-CB 3.22Å; A340-L409 WeakPolarHBondContact O-CB 3.34Å; A340-L409 PolarHBondContact O-N 2.82Å; K341-L409 HydrophobicContact CG-CD2 4.03Å; S407-L409 PolarHBondContact O-N 3.01Å; L409-L411 VanDerWaalsContact C-N 3.34Å; L409-V412 HydrophobicContact CD1-CG2 4.38Å; L409-V412 VanDerWaalsContact O-CG2 3.24Å; L409-V412 WeakPolarHBondContact O-CG2 3.4Å; L409-Q413 VanDerWaalsContact O-CG 3.26Å; L409-Q413 WeakPolarHBondContact O-CG 3.48Å; L409-Q413 PolarHBondContact O-N 2.99Å
410	Q	97.1	Very high	95.2	Very high	91 Å²	91	48.8 Å²	48.8	43%	0.425	26%	0.255	S	S	.	.	H	α-helix	trans	-69.9	-32.1	176.7	-70.6	169.8	-35.2	0	0	112.1	K406 S407 Q413 M414	K406-Q410 VanDerWaalsContact CA-OE1 3.31Å; K406-Q410 HydrophobicContact CB-CB 4Å; K406-Q410 HydrophobicContact CD-CB 4.15Å; K406-Q410 HydrophobicContact CG-CB 4.29Å; S407-Q410 PolarHBondContact O-N 3Å; S407-Q410 WeakPolarHBondContact OG-CG 3.37Å; S407-Q410 PolarHBondContact OG-N 3.27Å; S407-Q410 PolarHBondContact OG-OE1 3.36Å; Q410-Q413 PolarHBondContact O-N 2.96Å; Q410-M414 WeakPolarHBondContact O-CG 3.44Å; Q410-M414 PolarHBondContact O-N 3.08Å
411	L	97.1	Very high	94.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-45.7	174	170.6	64.8	0	0	0	112	V264 Y268 F344 N397 L398 A401 S407 P408 L409 Q413 M414	V264-L411 HydrophobicContact CG1-CD2 4.22Å; Y268-L411 HydrophobicContact CD1-CD1 4.1Å; Y268-L411 HydrophobicContact CD1-CD2 4.06Å; Y268-L411 HydrophobicContact CD1-CG 4.29Å; Y268-L411 HydrophobicContact CD2-CD1 4.44Å; Y268-L411 HydrophobicContact CD2-CD2 3.89Å; Y268-L411 HydrophobicContact CD2-CG 3.88Å; Y268-L411 HydrophobicContact CE1-CD1 3.52Å; Y268-L411 HydrophobicContact CE1-CD2 4.3Å; Y268-L411 HydrophobicContact CE1-CG 4.02Å; Y268-L411 HydrophobicContact CE2-CD1 3.91Å; Y268-L411 HydrophobicContact CE2-CD2 4.14Å; Y268-L411 HydrophobicContact CE2-CG 3.6Å; Y268-L411 HydrophobicContact CG-CD2 3.84Å; Y268-L411 HydrophobicContact CG-CG 4.21Å; Y268-L411 VanDerWaalsContact CZ-CD1 3.4Å; Y268-L411 PolarHBondContact OH-O 2.92Å; F344-L411 HydrophobicContact CE2-CB 4.4Å; F344-L411 HydrophobicContact CE2-CD2 4.03Å; F344-L411 HydrophobicContact CZ-CD2 3.84Å; N397-L411 HydrophobicContact CB-CD1 4.45Å; L398-L411 HydrophobicContact CB-CD1 4.43Å; L398-L411 HydrophobicContact CD1-CD1 4.5Å; L398-L411 HydrophobicContact CD1-CD2 3.68Å; A401-L411 HydrophobicContact CB-CB 4.19Å; A401-L411 HydrophobicContact CB-CD1 3.63Å; A401-L411 HydrophobicContact CB-CG 4.43Å; S407-L411 PolarHBondContact O-N 2.78Å; P408-L411 WeakPolarHBondContact O-CB 3.36Å; P408-L411 PolarHBondContact O-N 3.13Å; L409-L411 VanDerWaalsContact C-N 3.34Å; L411-Q413 PolarHBondContact O-N 3.47Å; L411-M414 HydrophobicContact CD1-SD 4.22Å; L411-M414 WeakPolarHBondContact O-CB 3.29Å; L411-M414 PolarHBondContact O-N 2.98Å; L411-M414 VanDerWaalsContact O-N 3.13Å
412	V	93.9	Very high	92.4	Very high	45 Å²	45	48.7 Å²	48.7	27%	0.273	26%	0.264	S	S	.	.	H	α-helix	trans	-73.3	-15.1	179	-58.3	0	0	0	0	113.5	Y268 F332 W334 A335 P408 L409	Y268-V412 HydrophobicContact CD2-CG1 4.3Å; Y268-V412 HydrophobicContact CE2-CG1 4.28Å; F332-V412 HydrophobicContact CD2-CB 4.38Å; F332-V412 HydrophobicContact CD2-CG1 3.56Å; F332-V412 HydrophobicContact CE2-CG1 4.03Å; F332-V412 HydrophobicContact CG-CG1 4.48Å; W334-V412 HydrophobicContact CH2-CG1 3.51Å; W334-V412 HydrophobicContact CZ2-CG1 4.43Å; W334-V412 HydrophobicContact CZ3-CG1 3.95Å; A335-V412 HydrophobicContact CB-CG2 3.85Å; P408-V412 PolarHBondContact O-N 2.95Å; P408-V412 VanDerWaalsContact O-N 3.14Å; L409-V412 HydrophobicContact CD1-CG2 4.38Å; L409-V412 VanDerWaalsContact O-CG2 3.24Å; L409-V412 WeakPolarHBondContact O-CG2 3.4Å
413	Q	93.7	Very high	90	Very high	132 Å²	132	59 Å²	59	62%	0.617	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-11.7	170.7	-71.2	169.1	-6.8	0	0	113.1	L409 Q410 L411	L409-Q413 VanDerWaalsContact O-CG 3.26Å; L409-Q413 WeakPolarHBondContact O-CG 3.48Å; L409-Q413 PolarHBondContact O-N 2.99Å; Q410-Q413 PolarHBondContact O-N 2.96Å; L411-Q413 PolarHBondContact O-N 3.47Å
414	M	94.4	Very high	87.3	Confident	31 Å²	31	54.7 Å²	54.7	15%	0.153	29%	0.291	C	S	.	.	S	Bend	trans	-67.4	138.4	176.9	-66.5	-177.7	57.8	0	0	110.9	N397 Q400 A401 K406 Q410 L411	N397-M414 HydrophobicContact CB-CE 3.97Å; N397-M414 HydrophobicContact CB-SD 4.46Å; Q400-M414 HydrophobicContact CB-CE 4.24Å; Q400-M414 HydrophobicContact CG-CE 4.4Å; A401-M414 HydrophobicContact CB-SD 3.99Å; K406-M414 HydrophobicContact CD-SD 4.13Å; Q410-M414 WeakPolarHBondContact O-CG 3.44Å; Q410-M414 PolarHBondContact O-N 3.08Å; L411-M414 HydrophobicContact CD1-SD 4.22Å; L411-M414 WeakPolarHBondContact O-CB 3.29Å; L411-M414 PolarHBondContact O-N 2.98Å; L411-M414 VanDerWaalsContact O-N 3.13Å
415	P	93.1	Very high	84.5	Confident	83 Å²	83	55.9 Å²	55.9	54%	0.539	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-54.9	135.2	177.8	-27.6	35.6	0	0	0	112.3	N397 V417 F437	N397-P415 PolarHBondContact ND2-O 2.83Å; P415-V417 PolarHBondContact O-N 2.98Å; P415-F437 HydrophobicContact CB-CD1 4.45Å
416	P	92.1	Very high	82.1	Confident	61 Å²	61	64.6 Å²	64.6	40%	0.396	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-64.7	126	175.5	-22.2	33.3	0	0	0	112.2	H323 Q438	H323-P416 HydrophobicContact CB-CB 4.1Å; P416-Q438 PolarHBondContact O-N 3.12Å
417	V	92.3	Very high	79.4	Confident	3 Å²	3	74.2 Å²	74.2	2%	0.018	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	147.7	178.4	-171.7	0	0	0	0	109.6	H323 G393 L396 P415 V419 S436 F437	H323-V417 PolarHBondContact NE2-O 2.84Å; G393-V417 WeakPolarHBondContact CA-O 3.24Å; L396-V417 HydrophobicContact CD2-CG1 4.18Å; P415-V417 PolarHBondContact O-N 2.98Å; V417-V419 HydrophobicContact CG1-CG2 4.18Å; V417-S436 WeakPolarHBondContact CA-O 3.3Å; V417-S436 WeakPolarHBondContact CG1-O 3.4Å; V417-F437 HydrophobicContact CG2-CD1 3.8Å; V417-F437 HydrophobicContact CG2-CE1 3.59Å; V417-F437 HydrophobicContact CG2-CZ 4.47Å
418	I	91.6	Very high	76.6	Confident	26 Å²	26	76.4 Å²	76.4	13%	0.133	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.9	166.8	-62.2	179.2	0	0	0	107.9	S389 V390 E420 S436	S389-I418 WeakPolarHBondContact OG-CG2 3.46Å; V390-I418 HydrophobicContact CG2-CD1 4.32Å; V390-I418 HydrophobicContact CG2-CG1 4.34Å; I418-E420 HydrophobicContact CG2-CG 4.11Å; I418-S436 PolarHBondContact N-O 3.12Å; I418-S436 PolarHBondContact O-N 2.99Å; I418-S436 PolarHBondContact O-OG 3.38Å
419	V	91.9	Very high	73.9	Confident	12 Å²	12	85.3 Å²	85.3	7%	0.073	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	104.8	-178.1	-177.8	0	0	0	0	109.6	S389 R392 L396 V417 Y433 Q435	S389-V419 VanDerWaalsContact CA-O 3.29Å; S389-V419 WeakPolarHBondContact CA-O 3.45Å; S389-V419 WeakPolarHBondContact CB-O 3.29Å; S389-V419 PolarHBondContact O-N 3.13Å; R392-V419 HydrophobicContact CB-CB 3.85Å; R392-V419 HydrophobicContact CB-CG1 4.42Å; R392-V419 HydrophobicContact CB-CG2 4.46Å; L396-V419 HydrophobicContact CD2-CG2 3.97Å; V417-V419 HydrophobicContact CG1-CG2 4.18Å; V419-Y433 HydrophobicContact CG1-CD1 3.91Å; V419-Q435 HydrophobicContact CG2-CG 4.37Å
420	E	87.3	Confident	71.4	Confident	108 Å²	108	86.6 Å²	86.6	51%	0.505	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	137.3	-179.6	-58.5	-169.2	154	0	0	110.7	I418 T434	I418-E420 HydrophobicContact CG2-CG 4.11Å; E420-T434 PolarHBondContact N-O 2.82Å; E420-T434 PolarHBondContact O-N 3.39Å
421	T	77.3	Confident	69.1	Low	49 Å²	49	87.6 Å²	87.6	30%	0.301	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	116.1	164.6	-56.3	0	0	0	0	108.1	R392 R423 E431 Y433	R392-T421 PolarHBondContact NH1-OG1 2.6Å; T421-R423 PolarHBondContact O-N 2.85Å; T421-E431 HydrophobicContact CG2-CB 4.05Å; T421-E431 HydrophobicContact CG2-CG 4.23Å; T421-Y433 WeakPolarHBondContact OG1-CE1 3.43Å
422	A	58.1	Low	66.8	Low	37 Å²	37	90.6 Å²	90.6	31%	0.306	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	130	169.6	0	0	0	0	0	109	A424 S432	A422-A424 PolarHBondContact O-N 3.27Å; A422-S432 PolarHBondContact N-O 2.9Å
423	R	47.5	Very low	65.3	Low	217 Å²	217	93.8 Å²	93.8	82%	0.819	48%	0.484	S	S	*	.			trans	-68.3	100.9	171.7	-73	-174.1	-178.5	177.3	2.9	108.9	T421	T421-R423 PolarHBondContact O-N 2.85Å
424	A	40.8	Very low	63.9	Low	36 Å²	36	91.1 Å²	91.1	30%	0.298	48%	0.477	S	S	.	.			trans	-55.9	134.8	165.3	0	0	0	0	0	109.2	A422 A428	A422-A424 PolarHBondContact O-N 3.27Å; A424-A428 HydrophobicContact CB-CB 4.37Å
425	P	39.6	Very low	62.5	Low	110 Å²	110	95.2 Å²	95.2	71%	0.714	50%	0.496	S	S	*	.			trans	-58.6	150.2	166.9	25.8	-32.5	0	0	0	109.2	R427 A428	P425-R427 PolarHBondContact O-N 3.04Å; P425-A428 PolarHBondContact O-N 3.01Å
426	Q	44.9	Very low	60.9	Low	211 Å²	211	93.6 Å²	93.6	99%	0.986	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	24.4	-162.7	-64.4	-176.7	-55.3	0	0	117.7
427	R	41.9	Very low	59.8	Low	251 Å²	251	96.9 Å²	96.9	95%	0.947	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.7	1.8	178.9	-68.3	-173.4	175.6	-179.7	-1.6	114.8	P425	P425-R427 PolarHBondContact O-N 3.04Å
428	A	40.5	Very low	57.8	Low	53 Å²	53	100 Å²	100	44%	0.438	51%	0.509	S	S	.	.			trans	-114.6	120	174	0	0	0	0	0	110.5	A424 P425 S430	A424-A428 HydrophobicContact CB-CB 4.37Å; P425-A428 PolarHBondContact O-N 3.01Å; A428-S430 PolarHBondContact O-N 3.05Å
429	N	41	Very low	55.4	Low	187 Å²	187	104.2 Å²	104.2	100%	1	54%	0.541	S	S	*	.			trans	-83	33.5	-177.8	-143.8	31.3	0	0	0	112.1
430	S	44.5	Very low	53.1	Low	75 Å²	75	112.6 Å²	112.6	52%	0.524	57%	0.572	S	S	.	*			trans	-135.2	111.5	-171.3	59.9	0	0	0	0	110	A428 S432	A428-S430 PolarHBondContact O-N 3.05Å; S430-S432 PolarHBondContact O-N 3.38Å
431	E	47.2	Very low	50.5	Low	113 Å²	113	118.1 Å²	118.1	53%	0.528	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-72.2	124	170.2	-66.1	-178.9	170.8	0	0	109.7	T421 Y433	T421-E431 HydrophobicContact CG2-CB 4.05Å; T421-E431 HydrophobicContact CG2-CG 4.23Å; E431-Y433 HydrophobicContact CB-CE2 4.01Å; E431-Y433 PolarHBondContact OE2-OH 3.24Å
432	S	50.2	Low	48.7	Very low	63 Å²	63	119.3 Å²	119.3	44%	0.441	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	130.3	171.4	46.8	0	0	0	0	110.3	A422 S430	A422-S432 PolarHBondContact N-O 2.9Å; S430-S432 PolarHBondContact O-N 3.38Å
433	Y	62.4	Low	47.7	Very low	111 Å²	111	127 Å²	127	44%	0.435	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.5	127.4	-179.6	-69.6	-90.6	0	0	0	110	V419 T421 E431	V419-Y433 HydrophobicContact CG1-CD1 3.91Å; T421-Y433 WeakPolarHBondContact OG1-CE1 3.43Å; E431-Y433 HydrophobicContact CB-CE2 4.01Å; E431-Y433 PolarHBondContact OE2-OH 3.24Å
434	T	63	Low	47.2	Very low	76 Å²	76	124.7 Å²	124.7	47%	0.466	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.3	119	174.4	-56.8	0	0	0	0	109.4	E420	E420-T434 PolarHBondContact N-O 2.82Å; E420-T434 PolarHBondContact O-N 3.39Å
435	Q	66.4	Low	46.7	Very low	117 Å²	117	128.1 Å²	128.1	55%	0.547	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.5	135.1	173.1	-60.6	-177.6	3.1	0	0	109.6	L396 V419	L396-Q435 HydrophobicContact CD2-CG 4.4Å; V419-Q435 HydrophobicContact CG2-CG 4.37Å
436	S	59.4	Low	46.6	Very low	50 Å²	50	133.2 Å²	133.2	35%	0.35	64%	0.642	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.7	138.2	174.4	64.1	0	0	0	0	111.1	V417 I418	V417-S436 WeakPolarHBondContact CA-O 3.3Å; V417-S436 WeakPolarHBondContact CG1-O 3.4Å; I418-S436 PolarHBondContact N-O 3.12Å; I418-S436 PolarHBondContact O-N 2.99Å; I418-S436 PolarHBondContact O-OG 3.38Å
437	F	67.5	Low	46.3	Very low	130 Å²	130	138.1 Å²	138.1	57%	0.57	65%	0.651	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99	134.1	176.3	-64.8	-85.6	0	0	0	109.6	P415 V417 S439	P415-F437 HydrophobicContact CB-CD1 4.45Å; V417-F437 HydrophobicContact CG2-CD1 3.8Å; V417-F437 HydrophobicContact CG2-CE1 3.59Å; V417-F437 HydrophobicContact CG2-CZ 4.47Å; F437-S439 VanDerWaalsContact C-N 3.3Å; F437-S439 PolarHBondContact O-N 2.81Å
438	Q	51.3	Low	46.6	Very low	67 Å²	67	132.5 Å²	132.5	31%	0.313	64%	0.637	S	S	.	*			trans	-77.5	78	178.3	-173.7	165.5	-21.9	0	0	111.4	P416 R440	P416-Q438 PolarHBondContact O-N 3.12Å; Q438-R440 PolarHBondContact O-N 3.09Å
439	S	41.3	Very low	46.9	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	65%	0.647	S	S	*	*			trans	-88.4	71.7	176.9	58.6	0	0	0	0	112.7	F437	F437-S439 VanDerWaalsContact C-N 3.3Å; F437-S439 PolarHBondContact O-N 2.81Å
440	R	43.3	Very low	47.2	Very low	189 Å²	189	133.8 Å²	133.8	71%	0.713	63%	0.628	S	S	*	*			trans	-105.4	109.3	158.5	-77.6	-171.3	171.4	-170.5	-3.6	109.3	Q438	Q438-R440 PolarHBondContact O-N 3.09Å
441	R	32.8	Very low	47.4	Very low	224 Å²	224	137.3 Å²	137.3	85%	0.845	63%	0.634	S	S	*	*			trans	-58.8	142.9	168.3	-66.3	-174.7	179.3	-166.2	-0.4	108.6	F443	R441-F443 PolarHBondContact O-N 3.26Å
442	P	38.3	Very low	47.4	Very low	73 Å²	73	138.8 Å²	138.8	47%	0.474	64%	0.64	S	S	.	*			trans	-59.4	133.9	176.5	23.8	-32	0	0	0	109.7	F444 T445	P442-F444 PolarHBondContact O-N 3.19Å; P442-T445 HydrophobicContact CG-CG2 4.1Å
443	F	37.9	Very low	47.2	Very low	198 Å²	198	143.9 Å²	143.9	87%	0.868	65%	0.653	S	S	*	*	S	Bend	trans	-68.8	-1.3	-173.9	-114	-93.3	0	0	0	114.5	R441	R441-F443 PolarHBondContact O-N 3.26Å
444	F	36.8	Very low	46.1	Very low	170 Å²	170	146.2 Å²	146.2	75%	0.746	67%	0.669	S	S	*	*			trans	-135.4	80.2	170.5	-73.9	-76.8	0	0	0	110.2	P442 W446	P442-F444 PolarHBondContact O-N 3.19Å; F444-W446 AromaticContact CD1-CD1 3.85Å; F444-W446 AromaticContact CD1-NE1 3.67Å
445	T	31.8	Very low	44.8	Very low	108 Å²	108	151.6 Å²	151.6	66%	0.663	69%	0.685	S	S	*	*			trans	-86.8	95.9	145.8	52.6	0	0	0	0	107	P442	P442-T445 HydrophobicContact CG-CG2 4.1Å
446	W	36.1	Very low	43	Very low	216 Å²	216	154.5 Å²	154.5	82%	0.818	70%	0.696	S	S	*	*			trans	-72.6	147.3	154.6	-83.6	80	0	0	0	108.3	F444	F444-W446 AromaticContact CD1-CD1 3.85Å; F444-W446 AromaticContact CD1-NE1 3.67Å
447	W	39.7	Very low	41.5	Very low	314 Å²	314	164 Å²	164	100%	1.189	73%	0.728	S	S	*	*			trans	-64.9	0	-165	-60.7	81.4	0	0	0	114

Retrieved 447 of 447 residues in 297.6 ms (Link to these results)

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