A0A5K4EUT3_SCHMA Loading...

GOLD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EUT3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 428 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	38.2	Very low	33.8	Very low	251 Å²	251	147.6 Å²	147.6	100%	1.236	83%	0.828	S	S	*	*				0	122.1	0	-80.8	-143.4	-82.7	0	0	107.3
2	G	40.8	Very low	33.4	Very low	86 Å²	86	146.3 Å²	146.3	89%	0.887	82%	0.817	S	S	*	*			trans	85.8	85.2	175.8	0	0	0	0	0	114.4
3	E	29.7	Very low	33.2	Very low	178 Å²	178	149.2 Å²	149.2	83%	0.832	82%	0.816	S	S	*	*			trans	-111.7	145.2	171.4	-88.1	-179.2	159.6	0	0	110.1
4	F	32.6	Very low	33.3	Very low	190 Å²	190	153.6 Å²	153.6	83%	0.833	82%	0.824	S	S	*	*			trans	59.3	159	159	-80.4	-109.8	0	0	0	116.7
5	E	32.6	Very low	33.1	Very low	164 Å²	164	154.4 Å²	154.4	77%	0.766	82%	0.82	S	S	*	*			cis	-136.5	150.8	20.7	-62.2	167.7	151.8	0	0	111.5
6	T	33.7	Very low	32.8	Very low	133 Å²	133	153.1 Å²	153.1	82%	0.816	82%	0.82	S	S	*	*			trans	-113.8	106.7	164.2	50.1	0	0	0	0	110.1
7	N	30.2	Very low	32.7	Very low	141 Å²	141	154.1 Å²	154.1	75%	0.754	82%	0.824	S	S	*	*			trans	-75.7	124.3	167.2	-85.8	-69	0	0	0	109.8
8	V	33.5	Very low	32.5	Very low	137 Å²	137	151.5 Å²	151.5	83%	0.83	82%	0.82	S	S	*	*			trans	-117.6	108.5	165.7	178.1	0	0	0	0	107.4
9	S	35.2	Very low	32.6	Very low	106 Å²	106	152.2 Å²	152.2	74%	0.741	82%	0.822	S	S	*	*			trans	-87.8	141.5	177.8	-63.1	0	0	0	0	111.4
10	N	29.2	Very low	32.7	Very low	120 Å²	120	151.8 Å²	151.8	64%	0.642	82%	0.82	S	S	*	*			trans	-57.1	146.6	176.9	-173.5	28.5	0	0	0	114.2	D12	N10-D12 PolarHBondContact ND2-OD2 3.06Å; N10-D12 PolarHBondContact OD1-N 2.93Å
11	P	35.9	Very low	32.6	Very low	118 Å²	118	152.2 Å²	152.2	77%	0.766	82%	0.822	S	S	*	*			trans	-121.3	79.3	156.9	37.5	-24	0	0	0	112.7	K13	P11-K13 PolarHBondContact O-N 3.08Å
12	D	29.5	Very low	32.6	Very low	132 Å²	132	146 Å²	146	71%	0.706	80%	0.8	S	S	*	*			trans	-70.4	107	151.2	-78.4	-56.8	0	0	0	108.7	N10	N10-D12 PolarHBondContact ND2-OD2 3.06Å; N10-D12 PolarHBondContact OD1-N 2.93Å
13	K	31.2	Very low	32.2	Very low	183 Å²	183	147 Å²	147	80%	0.796	79%	0.794	S	S	*	*			trans	177.1	116	156.3	-102.7	160.8	-174.2	-171.7	0	110.2	P11	P11-K13 PolarHBondContact O-N 3.08Å
14	F	33.8	Very low	32.3	Very low	212 Å²	212	145.5 Å²	145.5	93%	0.93	79%	0.791	S	S	*	*			trans	-115.7	124.7	152.8	-133.7	-93	0	0	0	107.6
15	E	30.4	Very low	32.5	Very low	165 Å²	165	140.5 Å²	140.5	77%	0.771	78%	0.78	S	S	*	*			trans	-86.1	138.6	-168.5	-68.3	175.6	134.1	0	0	111.7	L17	E15-L17 PolarHBondContact O-N 3.04Å
16	T	29.2	Very low	32.6	Very low	133 Å²	133	139.2 Å²	139.2	82%	0.816	78%	0.778	S	S	*	*			trans	-68.1	124.4	173.4	-41.4	0	0	0	0	110.3	S18	T16-S18 PolarHBondContact O-N 3.39Å
17	L	30.4	Very low	32.6	Very low	170 Å²	170	140.5 Å²	140.5	89%	0.89	78%	0.775	S	S	*	*			trans	-83.1	103	174.1	-70.4	173.3	0	0	0	110.8	E15	E15-L17 PolarHBondContact O-N 3.04Å
18	S	28.8	Very low	32.7	Very low	108 Å²	108	139.9 Å²	139.9	76%	0.755	77%	0.77	S	S	*	*			trans	-89.2	136.7	168.5	-65.5	0	0	0	0	111.5	T16	T16-S18 PolarHBondContact O-N 3.39Å
19	L	34.4	Very low	32.7	Very low	164 Å²	164	141.5 Å²	141.5	86%	0.859	77%	0.769	S	S	*	*			trans	-113.2	93.4	176.5	-90.9	161.1	0	0	0	111.9
20	N	35.4	Very low	32.5	Very low	145 Å²	145	144.8 Å²	144.8	78%	0.775	77%	0.773	S	S	*	*			trans	28.7	122.5	150	-55.1	-35.7	0	0	0	121.9
21	D	31.1	Very low	32.6	Very low	160 Å²	160	145.7 Å²	145.7	86%	0.856	78%	0.782	S	S	*	*			trans	-62.8	166	156.7	-81.8	-51.9	0	0	0	113.6
22	P	37.1	Very low	32.3	Very low	121 Å²	121	145.5 Å²	145.5	79%	0.786	78%	0.784	S	S	*	*				-138.4	146.7	109.8	37.5	-27	0	0	0	116.5
23	S	31.9	Very low	32.4	Very low	107 Å²	107	145.9 Å²	145.9	75%	0.748	79%	0.791	S	S	*	*			trans	-52.6	154.5	160.4	53.2	0	0	0	0	113
24	D	33.3	Very low	32.2	Very low	146 Å²	146	147.9 Å²	147.9	78%	0.781	79%	0.793	S	S	*	*				-177	163.6	52.2	-164.1	4.1	0	0	0	112.3
25	S	35.7	Very low	32.1	Very low	86 Å²	86	143.9 Å²	143.9	60%	0.601	79%	0.786	S	S	*	*			trans	78.4	126.7	151.7	77.7	0	0	0	0	122.9
26	N	35	Very low	32.1	Very low	136 Å²	136	144.3 Å²	144.3	73%	0.727	79%	0.785	S	S	*	*			trans	88.6	95.3	138	-62.2	-9	0	0	0	122.7
27	E	32.9	Very low	32	Very low	160 Å²	160	146 Å²	146	75%	0.748	78%	0.784	S	S	*	*				75	117.2	113.6	-79.2	-162.6	142.3	0	0	122.3
28	I	33.5	Very low	32	Very low	128 Å²	128	142.1 Å²	142.1	66%	0.656	79%	0.785	S	S	*	*				113.4	121.8	120	-79.2	170.1	0	0	0	120.1
29	H	33.9	Very low	32	Very low	171 Å²	171	146.4 Å²	146.4	79%	0.792	79%	0.79	S	S	*	*			trans	66	113.4	156.1	-83.8	-55.7	0	0	0	123.3
30	E	30.8	Very low	31.7	Very low	176 Å²	176	143.9 Å²	143.9	82%	0.822	79%	0.785	S	S	*	*			trans	-41.5	141.3	148.4	-66.4	173.6	103.7	0	0	113.8
31	T	30.9	Very low	31.9	Very low	138 Å²	138	143.7 Å²	143.7	85%	0.847	78%	0.784	S	S	*	*				-151.4	129.5	129.5	-44.3	0	0	0	0	110.5
32	S	28.8	Very low	32.6	Very low	115 Å²	115	143 Å²	143	80%	0.804	78%	0.78	S	S	*	*			trans	-75.9	129.3	178.4	171	0	0	0	0	113.4
33	V	32.6	Very low	32.8	Very low	140 Å²	140	145.9 Å²	145.9	85%	0.848	78%	0.783	S	S	*	*			trans	-145.1	143.1	152.8	-175.1	0	0	0	0	111
34	R	27.1	Very low	33.6	Very low	224 Å²	224	143.5 Å²	143.5	85%	0.845	78%	0.775	S	S	*	*			trans	-66.7	148.4	-176.8	-83.8	177.1	174.7	170.3	-2.4	116.7
35	V	31.7	Very low	35.3	Very low	128 Å²	128	140.3 Å²	140.3	78%	0.776	76%	0.758	S	S	*	*			trans	62.1	115.2	142.6	177.1	0	0	0	0	117.7
36	K	29	Very low	36.9	Very low	175 Å²	175	140.4 Å²	140.4	76%	0.761	75%	0.752	S	S	*	*			trans	-165.1	137.2	133.6	-104	154.2	-173.5	-174.1	0	111.9
37	E	28.9	Very low	39	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	73%	0.733	S	S	*	*			trans	40.1	99.2	148.5	-69.9	143.2	-155.6	0	0	117.8	F39	E37-F39 PolarHBondContact O-N 2.86Å
38	G	29.1	Very low	41.2	Very low	88 Å²	88	132.5 Å²	132.5	91%	0.907	72%	0.719	S	S	*	*			trans	-69.8	112.3	168	0	0	0	0	0	111
39	F	28.6	Very low	43.3	Very low	199 Å²	199	128.1 Å²	128.1	87%	0.873	70%	0.695	S	S	*	*			trans	-139.7	64.9	178.8	-152.8	-79.8	0	0	0	108.5	E37	E37-F39 PolarHBondContact O-N 2.86Å
40	C	29.2	Very low	45.8	Very low	110 Å²	110	123.9 Å²	123.9	74%	0.743	68%	0.676	S	S	*	*			trans	-140.4	156	-175	-65.8	0	0	0	0	112.4
41	D	39.4	Very low	48.4	Very low	142 Å²	142	120.6 Å²	120.6	76%	0.759	66%	0.662	S	S	*	*			trans	94.7	5.3	156.1	-53.8	-20.3	0	0	0	121.7	Q43	D41-Q43 PolarHBondContact O-N 2.8Å
42	D	46	Very low	51	Low	145 Å²	145	116.7 Å²	116.7	78%	0.775	64%	0.635	S	S	*	*	H	α-helix	trans	-67	-31.1	173.9	-167.4	41.3	0	0	0	114.1
43	Q	41.1	Very low	53.5	Low	182 Å²	182	111.2 Å²	111.2	85%	0.85	60%	0.597	S	S	*	*	H	α-helix	trans	-79.8	-23.2	-178.1	-71.4	-173	-0.5	0	0	114.6	D41	D41-Q43 PolarHBondContact O-N 2.8Å
44	G	49	Very low	56.2	Low	56 Å²	56	108 Å²	108	58%	0.577	57%	0.571	S	S	*	*	H	α-helix	trans	-74	-38.1	-178.1	0	0	0	0	0	112.6	Q48	G44-Q48 PolarHBondContact O-N 2.95Å
45	D	67.6	Low	59	Low	80 Å²	80	100.8 Å²	100.8	43%	0.428	56%	0.555	S	S	.	*	H	α-helix	trans	-69.1	-42.8	-178.2	179.2	44.3	0	0	0	112.3	G47 Q48 K49	D45-G47 PolarHBondContact O-N 3.24Å; D45-Q48 PolarHBondContact O-N 3.12Å; D45-K49 WeakPolarHBondContact O-CG 3.41Å; D45-K49 PolarHBondContact O-N 3.14Å; D45-K49 VanDerWaalsContact OD1-CE 3.24Å; D45-K49 WeakPolarHBondContact OD1-CE 3.47Å; D45-K49 IonicContact OD1-NZ 3.5Å; D45-K49 VanDerWaalsContact OD2-CE 3.24Å; D45-K49 WeakPolarHBondContact OD2-CE 3.41Å; D45-K49 IonicContact OD2-NZ 3.49Å; D45-K49 PolarHBondContact OD2-NZ 3.5Å
46	L	68.9	Low	61.3	Low	88 Å²	88	95.1 Å²	95.1	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-62.9	-41.6	178.5	-167.2	70.9	0	0	0	112.6	Q48 K49 E50	L46-Q48 VanDerWaalsContact C-N 3.34Å; L46-Q48 PolarHBondContact O-N 3.36Å; L46-K49 PolarHBondContact O-N 3.35Å; L46-E50 PolarHBondContact O-N 3.46Å
47	G	80.1	Confident	63.9	Low	32 Å²	32	87 Å²	87	33%	0.33	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-36.6	177.4	0	0	0	0	0	113	D45 I51	D45-G47 PolarHBondContact O-N 3.24Å; G47-I51 WeakPolarHBondContact O-CG1 3.43Å; G47-I51 PolarHBondContact O-N 2.67Å
48	Q	80.1	Confident	66.5	Low	97 Å²	97	81.4 Å²	81.4	45%	0.453	46%	0.463	S	S	.	.	H	α-helix	trans	-67.3	-42.7	174.1	-178.4	57.7	36.3	0	0	111.6	G44 D45 L46 E50 I51 E52	G44-Q48 PolarHBondContact O-N 2.95Å; D45-Q48 PolarHBondContact O-N 3.12Å; L46-Q48 VanDerWaalsContact C-N 3.34Å; L46-Q48 PolarHBondContact O-N 3.36Å; Q48-E50 PolarHBondContact O-N 3.08Å; Q48-I51 WeakPolarHBondContact O-CB 3.21Å; Q48-I51 PolarHBondContact O-N 3.16Å; Q48-E52 WeakPolarHBondContact CG-OE1 3.31Å; Q48-E52 PolarHBondContact NE2-OE1 3.08Å; Q48-E52 PolarHBondContact O-N 2.93Å
49	K	76.9	Confident	69	Low	36 Å²	36	81.4 Å²	81.4	16%	0.157	44%	0.44	C	S	.	.	H	α-helix	trans	-59.7	-42.3	174.5	-73.4	165.1	172.5	171.9	0	112.4	D45 L46 I51 E52 I53 P140	D45-K49 WeakPolarHBondContact O-CG 3.41Å; D45-K49 PolarHBondContact O-N 3.14Å; D45-K49 VanDerWaalsContact OD1-CE 3.24Å; D45-K49 WeakPolarHBondContact OD1-CE 3.47Å; D45-K49 IonicContact OD1-NZ 3.5Å; D45-K49 VanDerWaalsContact OD2-CE 3.24Å; D45-K49 WeakPolarHBondContact OD2-CE 3.41Å; D45-K49 IonicContact OD2-NZ 3.49Å; D45-K49 PolarHBondContact OD2-NZ 3.5Å; L46-K49 PolarHBondContact O-N 3.35Å; K49-I51 VanDerWaalsContact C-N 3.33Å; K49-I51 PolarHBondContact O-N 2.96Å; K49-E52 PolarHBondContact O-N 3.2Å; K49-I53 WeakPolarHBondContact O-CD1 3.32Å; K49-I53 VanDerWaalsContact O-CG1 3.25Å; K49-I53 WeakPolarHBondContact O-CG1 3.44Å; K49-I53 PolarHBondContact O-N 2.82Å; K49-P140 HydrophobicContact CD-CG 4.19Å; K49-P140 HydrophobicContact CG-CG 4.4Å
50	E	85.5	Confident	71.3	Confident	83 Å²	83	74.8 Å²	74.8	39%	0.388	41%	0.412	S	S	.	.	H	α-helix	trans	-61.1	-39.1	175.2	-78.4	-178	-172	0	0	112.6	L46 Q48 K54 F92 L96	L46-E50 PolarHBondContact O-N 3.46Å; Q48-E50 PolarHBondContact O-N 3.08Å; E50-K54 WeakPolarHBondContact O-CB 3.4Å; E50-K54 PolarHBondContact O-N 2.93Å; E50-F92 HydrophobicContact CB-CZ 4.21Å; E50-F92 WeakPolarHBondContact O-CE2 3.5Å; E50-F92 WeakPolarHBondContact O-CZ 3.07Å; E50-L96 HydrophobicContact CG-CD1 4.41Å
51	I	86.7	Confident	73.6	Confident	106 Å²	106	69.6 Å²	69.6	54%	0.544	38%	0.376	S	S	.	.	H	α-helix	trans	-65.4	-42.2	175.2	-67.2	164.1	0	0	0	111.1	G47 Q48 K49 K54 S55	G47-I51 WeakPolarHBondContact O-CG1 3.43Å; G47-I51 PolarHBondContact O-N 2.67Å; Q48-I51 WeakPolarHBondContact O-CB 3.21Å; Q48-I51 PolarHBondContact O-N 3.16Å; K49-I51 VanDerWaalsContact C-N 3.33Å; K49-I51 PolarHBondContact O-N 2.96Å; I51-K54 PolarHBondContact O-N 2.7Å; I51-S55 WeakPolarHBondContact O-CB 3.49Å; I51-S55 PolarHBondContact O-N 3.13Å
52	E	84	Confident	75.6	Confident	57 Å²	57	67.7 Å²	67.7	27%	0.266	36%	0.361	S	S	.	.	H	α-helix	trans	-64.7	-46.3	178.2	-74.7	168	-163.5	0	0	111.8	Q48 K49 K54 S55 A56 I142 Q397	Q48-E52 WeakPolarHBondContact CG-OE1 3.31Å; Q48-E52 PolarHBondContact NE2-OE1 3.08Å; Q48-E52 PolarHBondContact O-N 2.93Å; K49-E52 PolarHBondContact O-N 3.2Å; E52-K54 PolarHBondContact O-N 3.42Å; E52-S55 PolarHBondContact O-N 3.02Å; E52-A56 PolarHBondContact O-N 3.39Å; E52-I142 HydrophobicContact CB-CD1 4.41Å; E52-Q397 PolarHBondContact OE2-NE2 3.47Å; E52-Q397 PolarHBondContact OE2-OE1 2.79Å
53	I	83.1	Confident	77	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-56.7	-50.4	172	-65.3	157.9	0	0	0	110.1	K49 S55 A56 L57 F92 Y95 L96 Y100 I142	K49-I53 WeakPolarHBondContact O-CD1 3.32Å; K49-I53 VanDerWaalsContact O-CG1 3.25Å; K49-I53 WeakPolarHBondContact O-CG1 3.44Å; K49-I53 PolarHBondContact O-N 2.82Å; I53-S55 VanDerWaalsContact C-N 3.32Å; I53-S55 PolarHBondContact O-N 3.37Å; I53-A56 PolarHBondContact O-N 2.91Å; I53-L57 HydrophobicContact CG2-CD1 4.21Å; I53-L57 HydrophobicContact CG2-CG 4.33Å; I53-L57 WeakPolarHBondContact O-CG 3.46Å; I53-L57 PolarHBondContact O-N 3.32Å; I53-F92 HydrophobicContact CB-CE2 4.19Å; I53-F92 HydrophobicContact CG2-CD2 4.24Å; I53-F92 HydrophobicContact CG2-CE2 3.88Å; I53-Y95 HydrophobicContact CG2-CD1 3.69Å; I53-Y95 HydrophobicContact CG2-CE1 3.7Å; I53-L96 HydrophobicContact CD1-CD2 4Å; I53-L96 HydrophobicContact CG2-CD2 4.29Å; I53-Y100 HydrophobicContact CD1-CD2 3.82Å; I53-Y100 HydrophobicContact CD1-CE2 3.36Å; I53-Y100 HydrophobicContact CG1-CE2 4.46Å; I53-I142 HydrophobicContact CG1-CD1 4.26Å; I53-I142 HydrophobicContact CG1-CG1 3.8Å
54	K	87.3	Confident	78.8	Confident	73 Å²	73	61.4 Å²	61.4	32%	0.317	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-43.4	-178.3	-167.3	165.6	-174.9	168.1	0	111.6	E50 I51 E52 L57 V58 D89 F92	E50-K54 WeakPolarHBondContact O-CB 3.4Å; E50-K54 PolarHBondContact O-N 2.93Å; I51-K54 PolarHBondContact O-N 2.7Å; E52-K54 PolarHBondContact O-N 3.42Å; K54-L57 PolarHBondContact O-N 3.25Å; K54-V58 HydrophobicContact CG-CG2 4.35Å; K54-V58 VanDerWaalsContact O-CB 3.31Å; K54-V58 WeakPolarHBondContact O-CB 3.43Å; K54-V58 WeakPolarHBondContact O-CG2 3.34Å; K54-V58 PolarHBondContact O-N 2.89Å; K54-D89 WeakPolarHBondContact CE-OD1 3.24Å; K54-D89 IonicContact NZ-OD1 3.61Å; K54-D89 PolarHBondContact NZ-OD1 3.13Å; K54-F92 HydrophobicContact CB-CD2 3.78Å; K54-F92 HydrophobicContact CB-CE2 3.51Å; K54-F92 HydrophobicContact CB-CG 4.44Å; K54-F92 HydrophobicContact CB-CZ 3.95Å; K54-F92 HydrophobicContact CD-CD1 4.17Å; K54-F92 HydrophobicContact CD-CD2 4.44Å; K54-F92 HydrophobicContact CD-CE1 4.19Å; K54-F92 HydrophobicContact CD-CE2 4.48Å; K54-F92 HydrophobicContact CD-CG 4.28Å; K54-F92 HydrophobicContact CD-CZ 4.33Å; K54-F92 HydrophobicContact CG-CD2 3.97Å; K54-F92 HydrophobicContact CG-CE2 4.14Å; K54-F92 HydrophobicContact CG-CG 4.18Å; K54-F92 HydrophobicContact CG-CZ 4.47Å
55	S	86.6	Confident	80.5	Confident	72 Å²	72	59.3 Å²	59.3	50%	0.503	31%	0.308	S	S	.	.	H	α-helix	trans	-60.1	-46.1	177.1	-169.4	0	0	0	0	112	I51 E52 I53 V58 Q59	I51-S55 WeakPolarHBondContact O-CB 3.49Å; I51-S55 PolarHBondContact O-N 3.13Å; E52-S55 PolarHBondContact O-N 3.02Å; I53-S55 VanDerWaalsContact C-N 3.32Å; I53-S55 PolarHBondContact O-N 3.37Å; S55-V58 PolarHBondContact O-N 3.09Å; S55-Q59 PolarHBondContact O-N 3.12Å
56	A	81.1	Confident	81.4	Confident	9 Å²	9	58.6 Å²	58.6	7%	0.074	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-48.4	177.4	0	0	0	0	0	112.2	E52 I53 V58 Q59 Q60 I142	E52-A56 PolarHBondContact O-N 3.39Å; I53-A56 PolarHBondContact O-N 2.91Å; A56-V58 PolarHBondContact O-N 3.34Å; A56-Q59 PolarHBondContact O-N 3.38Å; A56-Q60 WeakPolarHBondContact O-CB 3.38Å; A56-Q60 PolarHBondContact O-N 3.39Å; A56-I142 HydrophobicContact CB-CG2 4.06Å
57	L	81.9	Confident	82	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-39	177.5	-61.9	-173.2	0	0	0	112.4	I53 K54 Q60 T61 Y91 F92 Y95 P143	I53-L57 HydrophobicContact CG2-CD1 4.21Å; I53-L57 HydrophobicContact CG2-CG 4.33Å; I53-L57 WeakPolarHBondContact O-CG 3.46Å; I53-L57 PolarHBondContact O-N 3.32Å; K54-L57 PolarHBondContact O-N 3.25Å; L57-Q60 PolarHBondContact O-N 3.31Å; L57-T61 WeakPolarHBondContact O-CB 3.34Å; L57-T61 WeakPolarHBondContact O-CG2 3.33Å; L57-T61 PolarHBondContact O-N 2.93Å; L57-T61 PolarHBondContact O-OG1 3.14Å; L57-Y91 HydrophobicContact CB-CD1 4.05Å; L57-Y91 HydrophobicContact CB-CE1 3.88Å; L57-Y91 HydrophobicContact CD1-CD1 4.07Å; L57-Y91 HydrophobicContact CD1-CE1 4.01Å; L57-Y91 HydrophobicContact CD2-CE1 3.78Å; L57-Y91 HydrophobicContact CG-CD1 4.47Å; L57-Y91 HydrophobicContact CG-CE1 4.08Å; L57-F92 HydrophobicContact CD1-CB 4.48Å; L57-F92 HydrophobicContact CD1-CD2 4.05Å; L57-Y95 HydrophobicContact CD1-CD1 3.96Å; L57-Y95 HydrophobicContact CD1-CD2 4.07Å; L57-Y95 HydrophobicContact CD1-CG 3.56Å; L57-Y95 HydrophobicContact CD2-CD2 3.85Å; L57-Y95 HydrophobicContact CD2-CE2 4.1Å; L57-Y95 HydrophobicContact CD2-CG 4.16Å; L57-Y95 HydrophobicContact CG-CG 4.44Å; L57-P143 HydrophobicContact CD2-CG 3.89Å
58	V	85.3	Confident	82.1	Confident	50 Å²	50	59.6 Å²	59.6	30%	0.303	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-45.3	175.1	161.4	0	0	0	0	110.7	K54 S55 A56 T61 K62 Q88	K54-V58 HydrophobicContact CG-CG2 4.35Å; K54-V58 VanDerWaalsContact O-CB 3.31Å; K54-V58 WeakPolarHBondContact O-CB 3.43Å; K54-V58 WeakPolarHBondContact O-CG2 3.34Å; K54-V58 PolarHBondContact O-N 2.89Å; S55-V58 PolarHBondContact O-N 3.09Å; A56-V58 PolarHBondContact O-N 3.34Å; V58-T61 PolarHBondContact O-OG1 2.94Å; V58-K62 WeakPolarHBondContact O-CB 3.46Å; V58-K62 PolarHBondContact O-N 3.46Å; V58-K62 VanDerWaalsContact O-N 3.13Å; V58-Q88 HydrophobicContact CG2-CB 4.34Å; V58-Q88 HydrophobicContact CG2-CG 4.25Å
59	Q	80.7	Confident	82.2	Confident	89 Å²	89	55 Å²	55	42%	0.416	27%	0.273	S	S	.	.	H	α-helix	trans	-68.5	-39.7	178.9	-173.3	171.8	-11.3	0	0	111.9	S55 A56 T145 W147	S55-Q59 PolarHBondContact O-N 3.12Å; A56-Q59 PolarHBondContact O-N 3.38Å; Q59-T145 HydrophobicContact CB-CG2 3.76Å; Q59-T145 HydrophobicContact CG-CG2 3.52Å; Q59-W147 VanDerWaalsContact NE2-CE3 3.27Å
60	Q	76.4	Confident	82.9	Confident	59 Å²	59	59.1 Å²	59.1	28%	0.276	29%	0.287	S	S	.	.	H	α-helix	trans	-64.3	-37.7	177.2	-173.4	-171.7	-4.9	0	0	112.9	A56 L57	A56-Q60 WeakPolarHBondContact O-CB 3.38Å; A56-Q60 PolarHBondContact O-N 3.39Å; L57-Q60 PolarHBondContact O-N 3.31Å
61	T	78.4	Confident	83.1	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-92.3	-11.2	-174.3	55.6	0	0	0	0	114.5	L57 V58 D63 L64 Y65 Y91 L344	L57-T61 WeakPolarHBondContact O-CB 3.34Å; L57-T61 WeakPolarHBondContact O-CG2 3.33Å; L57-T61 PolarHBondContact O-N 2.93Å; L57-T61 PolarHBondContact O-OG1 3.14Å; V58-T61 PolarHBondContact O-OG1 2.94Å; T61-D63 PolarHBondContact O-N 2.82Å; T61-L64 PolarHBondContact O-N 3.42Å; T61-Y65 HydrophobicContact CG2-CD2 4.49Å; T61-Y65 HydrophobicContact CG2-CE1 4.44Å; T61-Y65 HydrophobicContact CG2-CE2 3.84Å; T61-Y65 WeakPolarHBondContact O-CB 3.46Å; T61-Y65 PolarHBondContact O-N 2.92Å; T61-Y65 WeakPolarHBondContact OG1-CE2 3.5Å; T61-Y91 HydrophobicContact CG2-CD1 3.72Å; T61-Y91 HydrophobicContact CG2-CE1 3.55Å; T61-L344 HydrophobicContact CG2-CD2 3.98Å
62	K	80.9	Confident	83	Confident	102 Å²	102	59.1 Å²	59.1	44%	0.443	29%	0.285	S	S	.	.	H	α-helix	trans	-47.3	-62	-169.1	-176.2	-173.2	171.7	-169	0	114.1	V58 L64 Y65 E66	V58-K62 WeakPolarHBondContact O-CB 3.46Å; V58-K62 PolarHBondContact O-N 3.46Å; V58-K62 VanDerWaalsContact O-N 3.13Å; K62-L64 VanDerWaalsContact C-N 3.35Å; K62-L64 PolarHBondContact O-N 3.08Å; K62-Y65 PolarHBondContact O-N 3.15Å; K62-E66 WeakPolarHBondContact CE-OE1 3.43Å; K62-E66 HydrophobicContact CG-CG 4.46Å; K62-E66 IonicContact NZ-OE1 3.82Å; K62-E66 WeakPolarHBondContact O-CB 3.49Å; K62-E66 WeakPolarHBondContact O-CG 3.49Å; K62-E66 PolarHBondContact O-N 3.4Å
63	D	76.3	Confident	83.4	Confident	114 Å²	114	59.7 Å²	59.7	61%	0.61	29%	0.287	S	S	*	.	H	α-helix	trans	-66.5	-38	-168.9	-65.8	-26.7	0	0	0	112	T61 Q67	T61-D63 PolarHBondContact O-N 2.82Å; D63-Q67 WeakPolarHBondContact O-CB 3.35Å; D63-Q67 PolarHBondContact O-N 3.49Å
64	L	78.5	Confident	83.8	Confident	82 Å²	82	64 Å²	64	43%	0.429	32%	0.315	S	S	.	.	H	α-helix	trans	-65.8	-45.9	176	-179.2	66.6	0	0	0	111.6	T61 K62 Q67 Y68 L344	T61-L64 PolarHBondContact O-N 3.42Å; K62-L64 VanDerWaalsContact C-N 3.35Å; K62-L64 PolarHBondContact O-N 3.08Å; L64-Q67 PolarHBondContact O-N 3.01Å; L64-Y68 WeakPolarHBondContact O-CB 3.07Å; L64-Y68 PolarHBondContact O-N 3.48Å; L64-L344 HydrophobicContact CD2-CD1 3.79Å; L64-L344 HydrophobicContact CD2-CD2 3.44Å; L64-L344 VanDerWaalsContact CD2-CD2 3.44Å; L64-L344 HydrophobicContact CD2-CG 3.71Å
65	Y	84.5	Confident	84	Confident	11 Å²	11	70.5 Å²	70.5	4%	0.043	34%	0.343	C	S	.	.	H	α-helix	trans	-68.7	-37.8	179.6	-72.5	-3.8	0	0	0	112	T61 K62 A69 M87 Q88 Y91 L344	T61-Y65 HydrophobicContact CG2-CD2 4.49Å; T61-Y65 HydrophobicContact CG2-CE1 4.44Å; T61-Y65 HydrophobicContact CG2-CE2 3.84Å; T61-Y65 WeakPolarHBondContact O-CB 3.46Å; T61-Y65 PolarHBondContact O-N 2.92Å; T61-Y65 WeakPolarHBondContact OG1-CE2 3.5Å; K62-Y65 PolarHBondContact O-N 3.15Å; Y65-A69 WeakPolarHBondContact O-CB 3.44Å; Y65-A69 PolarHBondContact O-N 3.36Å; Y65-M87 HydrophobicContact CD1-CE 3.89Å; Y65-M87 HydrophobicContact CD1-SD 4.31Å; Y65-M87 HydrophobicContact CD2-CB 4.07Å; Y65-M87 HydrophobicContact CD2-CE 4.28Å; Y65-M87 HydrophobicContact CE1-CB 4.38Å; Y65-M87 HydrophobicContact CE2-CB 3.84Å; Y65-M87 HydrophobicContact CG-CB 4.45Å; Y65-M87 HydrophobicContact CG-CE 3.71Å; Y65-Q88 HydrophobicContact CD2-CG 3.59Å; Y65-Q88 HydrophobicContact CE2-CG 3.67Å; Y65-Y91 WeakPolarHBondContact OH-CB 3.23Å; Y65-L344 HydrophobicContact CE1-CD1 3.58Å
66	E	87.1	Confident	84.4	Confident	65 Å²	65	69.6 Å²	69.6	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-62.4	-41.1	170.9	-78.5	-170.2	-159	0	0	112.2	K62 R70 I84	K62-E66 WeakPolarHBondContact CE-OE1 3.43Å; K62-E66 HydrophobicContact CG-CG 4.46Å; K62-E66 IonicContact NZ-OE1 3.82Å; K62-E66 WeakPolarHBondContact O-CB 3.49Å; K62-E66 WeakPolarHBondContact O-CG 3.49Å; K62-E66 PolarHBondContact O-N 3.4Å; E66-R70 VanDerWaalsContact O-CB 3.22Å; E66-R70 WeakPolarHBondContact O-CB 3.47Å; E66-R70 PolarHBondContact O-N 2.99Å; E66-R70 IonicContact OE2-NH2 3.56Å; E66-I84 HydrophobicContact CG-CD1 3.96Å
67	Q	81.3	Confident	85	Confident	101 Å²	101	74.2 Å²	74.2	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-63.9	-53.6	175.1	177.8	175.1	-18.3	0	0	111.4	D63 L64 A69 R70 E71	D63-Q67 WeakPolarHBondContact O-CB 3.35Å; D63-Q67 PolarHBondContact O-N 3.49Å; L64-Q67 PolarHBondContact O-N 3.01Å; Q67-A69 VanDerWaalsContact C-N 3.32Å; Q67-A69 PolarHBondContact O-N 3.33Å; Q67-R70 WeakPolarHBondContact O-CB 3.37Å; Q67-R70 PolarHBondContact O-N 2.87Å; Q67-R70 VanDerWaalsContact O-N 3.07Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.39Å; Q67-E71 PolarHBondContact NE2-OE1 3.38Å; Q67-E71 PolarHBondContact O-N 3.24Å
68	Y	80.9	Confident	85.6	Confident	41 Å²	41	79.7 Å²	79.7	16%	0.161	38%	0.381	C	S	.	.	H	α-helix	trans	-59.2	-43.4	-179	-179.5	-106.9	0	0	0	112	L64 R70 E71 Q72 L83 M87 L339	L64-Y68 WeakPolarHBondContact O-CB 3.07Å; L64-Y68 PolarHBondContact O-N 3.48Å; Y68-R70 VanDerWaalsContact C-N 3.31Å; Y68-R70 PolarHBondContact O-N 3.33Å; Y68-E71 PolarHBondContact O-N 3.48Å; Y68-Q72 HydrophobicContact CD1-CG 4.24Å; Y68-Q72 HydrophobicContact CD2-CG 4.41Å; Y68-Q72 HydrophobicContact CE1-CG 3.89Å; Y68-Q72 HydrophobicContact CE2-CG 4.06Å; Y68-Q72 WeakPolarHBondContact O-CG 3.46Å; Y68-Q72 PolarHBondContact O-N 2.87Å; Y68-Q72 PolarHBondContact OH-NE2 3.08Å; Y68-L83 HydrophobicContact CD1-CD2 4Å; Y68-L83 HydrophobicContact CE1-CD2 4Å; Y68-M87 HydrophobicContact CD1-CE 4Å; Y68-M87 HydrophobicContact CD1-SD 3.58Å; Y68-M87 VanDerWaalsContact CD1-SD 3.58Å; Y68-M87 HydrophobicContact CE1-SD 3.87Å; Y68-L339 HydrophobicContact CD1-CD1 3.93Å; Y68-L339 HydrophobicContact CD2-CD1 4.37Å; Y68-L339 HydrophobicContact CD2-CD2 3.77Å; Y68-L339 HydrophobicContact CD2-CG 4.39Å; Y68-L339 HydrophobicContact CE1-CD1 3.77Å; Y68-L339 HydrophobicContact CE1-CG 4.38Å; Y68-L339 HydrophobicContact CE2-CD1 4.22Å; Y68-L339 HydrophobicContact CE2-CD2 3.74Å; Y68-L339 HydrophobicContact CE2-CG 4.03Å; Y68-L339 HydrophobicContact CG-CD1 4.21Å; Y68-L339 HydrophobicContact CG-CD2 4.28Å
69	A	83.9	Confident	86	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-62.1	-39	175.8	0	0	0	0	0	112.4	Y65 Q67 E71 Q72 F73 Q80 L83 I84	Y65-A69 WeakPolarHBondContact O-CB 3.44Å; Y65-A69 PolarHBondContact O-N 3.36Å; Q67-A69 VanDerWaalsContact C-N 3.32Å; Q67-A69 PolarHBondContact O-N 3.33Å; A69-E71 VanDerWaalsContact C-N 3.32Å; A69-E71 PolarHBondContact O-N 2.95Å; A69-Q72 PolarHBondContact O-N 2.67Å; A69-F73 PolarHBondContact O-N 3.03Å; A69-Q80 HydrophobicContact CB-CB 4.03Å; A69-Q80 HydrophobicContact CB-CG 4.2Å; A69-Q80 WeakPolarHBondContact O-CG 3.23Å; A69-L83 HydrophobicContact CB-CD2 4.14Å; A69-I84 HydrophobicContact CB-CD1 3.98Å; A69-I84 HydrophobicContact CB-CG1 3.73Å
70	R	90.8	Very high	86.6	Confident	122 Å²	122	79.2 Å²	79.2	46%	0.46	37%	0.374	S	S	.	.	H	α-helix	trans	-66.2	-32.2	175.5	-168.4	-177.6	-57.2	119.5	5	112.6	E66 Q67 Y68 P74	E66-R70 VanDerWaalsContact O-CB 3.22Å; E66-R70 WeakPolarHBondContact O-CB 3.47Å; E66-R70 PolarHBondContact O-N 2.99Å; E66-R70 IonicContact OE2-NH2 3.56Å; Q67-R70 WeakPolarHBondContact O-CB 3.37Å; Q67-R70 PolarHBondContact O-N 2.87Å; Q67-R70 VanDerWaalsContact O-N 3.07Å; Y68-R70 VanDerWaalsContact C-N 3.31Å; Y68-R70 PolarHBondContact O-N 3.33Å; R70-P74 WeakPolarHBondContact O-CA 3.31Å; R70-P74 WeakPolarHBondContact O-CB 3.31Å; R70-P74 VanDerWaalsContact O-CG 3.29Å; R70-P74 WeakPolarHBondContact O-CG 3.35Å
71	E	88.9	Confident	87.5	Confident	118 Å²	118	81.2 Å²	81.2	55%	0.551	38%	0.382	S	S	*	.	H	α-helix	trans	-72.2	-44.4	174	-70.4	174.5	-161.7	0	0	112.1	Q67 Y68 A69	Q67-E71 WeakPolarHBondContact CG-OE1 3.39Å; Q67-E71 PolarHBondContact NE2-OE1 3.38Å; Q67-E71 PolarHBondContact O-N 3.24Å; Y68-E71 PolarHBondContact O-N 3.48Å; A69-E71 VanDerWaalsContact C-N 3.32Å; A69-E71 PolarHBondContact O-N 2.95Å
72	Q	86.3	Confident	88.2	Confident	71 Å²	71	84 Å²	84	33%	0.332	41%	0.405	S	S	.	.	H	α-helix	trans	-70.3	-37.8	179.4	-64.8	-66.1	-14.4	0	0	112.8	Y68 A69 L83	Y68-Q72 HydrophobicContact CD1-CG 4.24Å; Y68-Q72 HydrophobicContact CD2-CG 4.41Å; Y68-Q72 HydrophobicContact CE1-CG 3.89Å; Y68-Q72 HydrophobicContact CE2-CG 4.06Å; Y68-Q72 WeakPolarHBondContact O-CG 3.46Å; Y68-Q72 PolarHBondContact O-N 2.87Å; Y68-Q72 PolarHBondContact OH-NE2 3.08Å; A69-Q72 PolarHBondContact O-N 2.67Å; Q72-L83 HydrophobicContact CB-CD2 4.25Å; Q72-L83 HydrophobicContact CG-CD2 4.32Å
73	F	91.5	Very high	88.6	Confident	70 Å²	70	80.6 Å²	80.6	31%	0.307	39%	0.391	S	S	.	.			trans	-131.6	62.7	-175.7	-59.9	-61.2	0	0	0	113.7	A69 K75 D76 K79 Q80 L83	A69-F73 PolarHBondContact O-N 3.03Å; F73-K75 PolarHBondContact O-N 3.49Å; F73-D76 HydrophobicContact CB-CB 4.39Å; F73-D76 PolarHBondContact O-N 3.13Å; F73-D76 VanDerWaalsContact O-N 3.17Å; F73-K79 HydrophobicContact CB-CB 4.08Å; F73-K79 HydrophobicContact CD1-CB 4.03Å; F73-K79 HydrophobicContact CD1-CD 3.7Å; F73-K79 HydrophobicContact CD2-CB 3.72Å; F73-K79 HydrophobicContact CE1-CB 4.41Å; F73-K79 HydrophobicContact CE1-CD 3.69Å; F73-K79 HydrophobicContact CE2-CB 4.11Å; F73-K79 HydrophobicContact CG-CB 3.67Å; F73-K79 HydrophobicContact CG-CD 4.23Å; F73-K79 HydrophobicContact CZ-CB 4.44Å; F73-K79 HydrophobicContact CZ-CD 4.2Å; F73-Q80 HydrophobicContact CB-CG 4.06Å; F73-Q80 PolarHBondContact O-NE2 3.01Å; F73-L83 HydrophobicContact CD2-CD2 4.23Å; F73-L83 HydrophobicContact CE2-CB 4.31Å; F73-L83 HydrophobicContact CE2-CD2 4.04Å
74	P	92.1	Very high	89.1	Confident	91 Å²	91	76.5 Å²	76.5	59%	0.591	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-10.6	-166.4	-23.6	31.8	0	0	0	118.1	R70	R70-P74 WeakPolarHBondContact O-CA 3.31Å; R70-P74 WeakPolarHBondContact O-CB 3.31Å; R70-P74 VanDerWaalsContact O-CG 3.29Å; R70-P74 WeakPolarHBondContact O-CG 3.35Å
75	K	91.2	Very high	89.8	Confident	208 Å²	208	76 Å²	76	90%	0.904	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	0.9	-176	-61.1	-176.1	-179.2	179.4	0	114	F73	F73-K75 PolarHBondContact O-N 3.49Å
76	D	94.2	Very high	90	Very high	53 Å²	53	80.5 Å²	80.5	28%	0.283	39%	0.391	S	S	.	.			trans	-124.4	86.1	-168.3	-167.4	-27.3	0	0	0	109.8	F73 E78 K79 Q80	F73-D76 HydrophobicContact CB-CB 4.39Å; F73-D76 PolarHBondContact O-N 3.13Å; F73-D76 VanDerWaalsContact O-N 3.17Å; D76-E78 VanDerWaalsContact C-N 3.25Å; D76-E78 PolarHBondContact O-N 3.34Å; D76-K79 HydrophobicContact CB-CB 4.19Å; D76-K79 HydrophobicContact CB-CD 4.42Å; D76-K79 HydrophobicContact CB-CG 4.42Å; D76-K79 PolarHBondContact O-N 3.17Å; D76-K79 PolarHBondContact OD1-N 3.5Å; D76-K79 VanDerWaalsContact OD2-CD 3.32Å; D76-K79 WeakPolarHBondContact OD2-CD 3.16Å; D76-K79 VanDerWaalsContact OD2-CE 3.32Å; D76-K79 WeakPolarHBondContact OD2-CE 3.4Å; D76-K79 IonicContact OD2-NZ 2.7Å; D76-K79 PolarHBondContact OD2-NZ 2.99Å; D76-Q80 WeakPolarHBondContact O-CG 3.3Å; D76-Q80 PolarHBondContact O-N 3.22Å
77	L	94.5	Very high	90	Very high	106 Å²	106	78.4 Å²	78.4	56%	0.555	38%	0.381	S	S	*	.	H	α-helix	trans	-62.4	-31.5	-173.4	-172.5	68.3	0	0	0	112.7	Q80 K81	L77-Q80 WeakPolarHBondContact O-CB 3.27Å; L77-Q80 PolarHBondContact O-N 2.95Å; L77-K81 WeakPolarHBondContact O-CG 3.47Å; L77-K81 PolarHBondContact O-N 3.27Å
78	E	95.1	Very high	90.3	Very high	119 Å²	119	75 Å²	75	56%	0.556	37%	0.365	S	S	*	.	H	α-helix	trans	-72.8	-37.7	178.6	-64.1	-56.3	114.8	0	0	111.2	D76 K81 A82	D76-E78 VanDerWaalsContact C-N 3.25Å; D76-E78 PolarHBondContact O-N 3.34Å; E78-K81 PolarHBondContact O-N 3.39Å; E78-K81 IonicContact OE1-NZ 2.82Å; E78-K81 PolarHBondContact OE1-NZ 2.62Å; E78-A82 WeakPolarHBondContact O-CB 3.46Å; E78-A82 PolarHBondContact O-N 2.95Å
79	K	93.5	Very high	90.6	Very high	104 Å²	104	75.9 Å²	75.9	45%	0.452	37%	0.373	S	S	.	.	H	α-helix	trans	-67.4	-34.8	169.1	-70.6	-171.8	-172	119.2	0	113	F73 D76 L83	F73-K79 HydrophobicContact CB-CB 4.08Å; F73-K79 HydrophobicContact CD1-CB 4.03Å; F73-K79 HydrophobicContact CD1-CD 3.7Å; F73-K79 HydrophobicContact CD2-CB 3.72Å; F73-K79 HydrophobicContact CE1-CB 4.41Å; F73-K79 HydrophobicContact CE1-CD 3.69Å; F73-K79 HydrophobicContact CE2-CB 4.11Å; F73-K79 HydrophobicContact CG-CB 3.67Å; F73-K79 HydrophobicContact CG-CD 4.23Å; F73-K79 HydrophobicContact CZ-CB 4.44Å; F73-K79 HydrophobicContact CZ-CD 4.2Å; D76-K79 HydrophobicContact CB-CB 4.19Å; D76-K79 HydrophobicContact CB-CD 4.42Å; D76-K79 HydrophobicContact CB-CG 4.42Å; D76-K79 PolarHBondContact O-N 3.17Å; D76-K79 PolarHBondContact OD1-N 3.5Å; D76-K79 VanDerWaalsContact OD2-CD 3.32Å; D76-K79 WeakPolarHBondContact OD2-CD 3.16Å; D76-K79 VanDerWaalsContact OD2-CE 3.32Å; D76-K79 WeakPolarHBondContact OD2-CE 3.4Å; D76-K79 IonicContact OD2-NZ 2.7Å; D76-K79 PolarHBondContact OD2-NZ 2.99Å; K79-L83 WeakPolarHBondContact O-CB 3Å; K79-L83 PolarHBondContact O-N 2.87Å
80	Q	92.8	Very high	90.6	Very high	25 Å²	25	81.1 Å²	81.1	12%	0.117	40%	0.398	C	S	.	.	H	α-helix	trans	-59.8	-52.6	173.5	-70	177.4	18.1	0	0	110.7	A69 F73 D76 L77 A82 L83 I84	A69-Q80 HydrophobicContact CB-CB 4.03Å; A69-Q80 HydrophobicContact CB-CG 4.2Å; A69-Q80 WeakPolarHBondContact O-CG 3.23Å; F73-Q80 HydrophobicContact CB-CG 4.06Å; F73-Q80 PolarHBondContact O-NE2 3.01Å; D76-Q80 WeakPolarHBondContact O-CG 3.3Å; D76-Q80 PolarHBondContact O-N 3.22Å; L77-Q80 WeakPolarHBondContact O-CB 3.27Å; L77-Q80 PolarHBondContact O-N 2.95Å; Q80-A82 PolarHBondContact O-N 2.82Å; Q80-L83 PolarHBondContact O-N 2.79Å; Q80-I84 WeakPolarHBondContact O-CD1 3.43Å; Q80-I84 VanDerWaalsContact O-CG1 3.23Å; Q80-I84 WeakPolarHBondContact O-CG1 3.46Å; Q80-I84 PolarHBondContact O-N 3.08Å
81	K	94.5	Very high	90.2	Very high	102 Å²	102	75.9 Å²	75.9	44%	0.443	38%	0.378	S	S	.	.	H	α-helix	trans	-56.9	-49.4	176.7	-70.5	169.6	-177	170	0	112.2	L77 E78 L83 I84 T85	L77-K81 WeakPolarHBondContact O-CG 3.47Å; L77-K81 PolarHBondContact O-N 3.27Å; E78-K81 PolarHBondContact O-N 3.39Å; E78-K81 IonicContact OE1-NZ 2.82Å; E78-K81 PolarHBondContact OE1-NZ 2.62Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 2.8Å; K81-I84 PolarHBondContact O-N 3.23Å; K81-T85 PolarHBondContact O-N 3.38Å; K81-T85 PolarHBondContact O-OG1 3.11Å
82	A	94.3	Very high	90	Very high	59 Å²	59	71.4 Å²	71.4	49%	0.488	36%	0.357	S	S	.	.	H	α-helix	trans	-59.4	-42.8	-179.1	0	0	0	0	0	112	E78 Q80 T85 E86	E78-A82 WeakPolarHBondContact O-CB 3.46Å; E78-A82 PolarHBondContact O-N 2.95Å; Q80-A82 PolarHBondContact O-N 2.82Å; A82-T85 PolarHBondContact O-N 3.15Å; A82-E86 WeakPolarHBondContact O-CB 3.23Å; A82-E86 PolarHBondContact O-N 3.49Å
83	L	89	Confident	90	Very high	31 Å²	31	74.7 Å²	74.7	16%	0.162	37%	0.372	C	S	.	.	H	α-helix	trans	-66.3	-41.6	176.2	-173.6	71.9	0	0	0	112.1	Y68 A69 Q72 F73 K79 Q80 K81 E86 M87	Y68-L83 HydrophobicContact CD1-CD2 4Å; Y68-L83 HydrophobicContact CE1-CD2 4Å; A69-L83 HydrophobicContact CB-CD2 4.14Å; Q72-L83 HydrophobicContact CB-CD2 4.25Å; Q72-L83 HydrophobicContact CG-CD2 4.32Å; F73-L83 HydrophobicContact CD2-CD2 4.23Å; F73-L83 HydrophobicContact CE2-CB 4.31Å; F73-L83 HydrophobicContact CE2-CD2 4.04Å; K79-L83 WeakPolarHBondContact O-CB 3Å; K79-L83 PolarHBondContact O-N 2.87Å; Q80-L83 PolarHBondContact O-N 2.79Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 2.8Å; L83-E86 PolarHBondContact O-N 3.13Å; L83-M87 HydrophobicContact CD2-CE 4.39Å; L83-M87 HydrophobicContact CG-CE 4.07Å; L83-M87 HydrophobicContact CG-CG 4.46Å; L83-M87 HydrophobicContact CG-SD 4.23Å; L83-M87 WeakPolarHBondContact O-CB 3.17Å; L83-M87 VanDerWaalsContact O-CG 3.28Å; L83-M87 WeakPolarHBondContact O-CG 3.44Å; L83-M87 PolarHBondContact O-N 3.01Å
84	I	86.9	Confident	89.3	Confident	27 Å²	27	74.2 Å²	74.2	14%	0.138	37%	0.371	C	S	.	.	H	α-helix	trans	-60.5	-47.8	176.7	-67.3	161.3	0	0	0	110.2	E66 A69 Q80 K81 M87 Q88	E66-I84 HydrophobicContact CG-CD1 3.96Å; A69-I84 HydrophobicContact CB-CD1 3.98Å; A69-I84 HydrophobicContact CB-CG1 3.73Å; Q80-I84 WeakPolarHBondContact O-CD1 3.43Å; Q80-I84 VanDerWaalsContact O-CG1 3.23Å; Q80-I84 WeakPolarHBondContact O-CG1 3.46Å; Q80-I84 PolarHBondContact O-N 3.08Å; K81-I84 PolarHBondContact O-N 3.23Å; I84-M87 HydrophobicContact CG1-CE 4.48Å; I84-M87 PolarHBondContact O-N 3.41Å; I84-Q88 HydrophobicContact CG2-CG 4.38Å; I84-Q88 WeakPolarHBondContact O-CB 3.48Å; I84-Q88 VanDerWaalsContact O-CG 3.25Å; I84-Q88 WeakPolarHBondContact O-CG 3.28Å; I84-Q88 PolarHBondContact O-N 2.67Å
85	T	92.3	Very high	88.8	Confident	73 Å²	73	70.1 Å²	70.1	45%	0.448	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-45.2	176.7	-59.6	0	0	0	0	111.8	K81 A82 M87 Q88 D89	K81-T85 PolarHBondContact O-N 3.38Å; K81-T85 PolarHBondContact O-OG1 3.11Å; A82-T85 PolarHBondContact O-N 3.15Å; T85-M87 PolarHBondContact O-N 3.28Å; T85-Q88 PolarHBondContact O-N 3.18Å; T85-D89 WeakPolarHBondContact O-CB 3.24Å; T85-D89 PolarHBondContact O-N 2.86Å
86	E	89.4	Confident	88.4	Confident	105 Å²	105	62 Å²	62	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-59.1	-45.8	176.7	-178.4	179.6	176.2	0	0	112.1	A82 L83 D89 Q90	A82-E86 WeakPolarHBondContact O-CB 3.23Å; A82-E86 PolarHBondContact O-N 3.49Å; L83-E86 PolarHBondContact O-N 3.13Å; E86-D89 PolarHBondContact O-N 3.31Å; E86-Q90 WeakPolarHBondContact O-CB 3.4Å; E86-Q90 VanDerWaalsContact O-CG 3.29Å; E86-Q90 WeakPolarHBondContact O-CG 3.29Å; E86-Q90 PolarHBondContact O-N 3.16Å; E86-Q90 PolarHBondContact OE1-NE2 3.3Å
87	M	87.5	Confident	87.5	Confident	20 Å²	20	62.8 Å²	62.8	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-38.6	177	-69.1	-175.7	-54.1	0	0	112.2	Y65 Y68 L83 I84 T85 Y91 L339	Y65-M87 HydrophobicContact CD1-CE 3.89Å; Y65-M87 HydrophobicContact CD1-SD 4.31Å; Y65-M87 HydrophobicContact CD2-CB 4.07Å; Y65-M87 HydrophobicContact CD2-CE 4.28Å; Y65-M87 HydrophobicContact CE1-CB 4.38Å; Y65-M87 HydrophobicContact CE2-CB 3.84Å; Y65-M87 HydrophobicContact CG-CB 4.45Å; Y65-M87 HydrophobicContact CG-CE 3.71Å; Y68-M87 HydrophobicContact CD1-CE 4Å; Y68-M87 HydrophobicContact CD1-SD 3.58Å; Y68-M87 VanDerWaalsContact CD1-SD 3.58Å; Y68-M87 HydrophobicContact CE1-SD 3.87Å; L83-M87 HydrophobicContact CD2-CE 4.39Å; L83-M87 HydrophobicContact CG-CE 4.07Å; L83-M87 HydrophobicContact CG-CG 4.46Å; L83-M87 HydrophobicContact CG-SD 4.23Å; L83-M87 WeakPolarHBondContact O-CB 3.17Å; L83-M87 VanDerWaalsContact O-CG 3.28Å; L83-M87 WeakPolarHBondContact O-CG 3.44Å; L83-M87 PolarHBondContact O-N 3.01Å; I84-M87 HydrophobicContact CG1-CE 4.48Å; I84-M87 PolarHBondContact O-N 3.41Å; T85-M87 PolarHBondContact O-N 3.28Å; M87-Y91 WeakPolarHBondContact O-CB 3.49Å; M87-Y91 PolarHBondContact O-N 2.96Å; M87-L339 HydrophobicContact SD-CD1 4.01Å
88	Q	86.3	Confident	86.5	Confident	29 Å²	29	63.6 Å²	63.6	14%	0.136	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-40.1	177.6	-74.2	174.3	-23.2	0	0	112.4	V58 Y65 I84 T85 F92	V58-Q88 HydrophobicContact CG2-CB 4.34Å; V58-Q88 HydrophobicContact CG2-CG 4.25Å; Y65-Q88 HydrophobicContact CD2-CG 3.59Å; Y65-Q88 HydrophobicContact CE2-CG 3.67Å; I84-Q88 HydrophobicContact CG2-CG 4.38Å; I84-Q88 WeakPolarHBondContact O-CB 3.48Å; I84-Q88 VanDerWaalsContact O-CG 3.25Å; I84-Q88 WeakPolarHBondContact O-CG 3.28Å; I84-Q88 PolarHBondContact O-N 2.67Å; T85-Q88 PolarHBondContact O-N 3.18Å; Q88-F92 VanDerWaalsContact O-CB 3.24Å; Q88-F92 WeakPolarHBondContact O-CB 3.22Å; Q88-F92 PolarHBondContact O-N 3.44Å
89	D	88.2	Confident	85.4	Confident	60 Å²	60	58.8 Å²	58.8	32%	0.321	30%	0.299	S	S	.	.	H	α-helix	trans	-67.6	-46.1	176.4	-72.4	-22.6	0	0	0	111	K54 T85 E86 Y91 F92 E93	K54-D89 WeakPolarHBondContact CE-OD1 3.24Å; K54-D89 IonicContact NZ-OD1 3.61Å; K54-D89 PolarHBondContact NZ-OD1 3.13Å; T85-D89 WeakPolarHBondContact O-CB 3.24Å; T85-D89 PolarHBondContact O-N 2.86Å; E86-D89 PolarHBondContact O-N 3.31Å; D89-Y91 VanDerWaalsContact C-N 3.34Å; D89-Y91 PolarHBondContact O-N 3.33Å; D89-F92 PolarHBondContact O-N 3.11Å; D89-E93 WeakPolarHBondContact O-CG 3.46Å; D89-E93 PolarHBondContact O-N 3.48Å
90	Q	84.2	Confident	84.7	Confident	111 Å²	111	55.3 Å²	55.3	52%	0.519	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-42.7	174.4	-73.3	175.5	14.6	0	0	112.3	E86 H94	E86-Q90 WeakPolarHBondContact O-CB 3.4Å; E86-Q90 VanDerWaalsContact O-CG 3.29Å; E86-Q90 WeakPolarHBondContact O-CG 3.29Å; E86-Q90 PolarHBondContact O-N 3.16Å; E86-Q90 PolarHBondContact OE1-NE2 3.3Å; Q90-H94 WeakPolarHBondContact O-CB 3.35Å; Q90-H94 PolarHBondContact O-N 3.37Å
91	Y	81.1	Confident	83.9	Confident	11 Å²	11	62.3 Å²	62.3	4%	0.043	31%	0.309	C	S	.	.	H	α-helix	trans	-66.2	-39.3	177.8	-177.2	-120.1	0	0	0	112.1	L57 T61 Y65 M87 D89 H94 Y95 L344 I345	L57-Y91 HydrophobicContact CB-CD1 4.05Å; L57-Y91 HydrophobicContact CB-CE1 3.88Å; L57-Y91 HydrophobicContact CD1-CD1 4.07Å; L57-Y91 HydrophobicContact CD1-CE1 4.01Å; L57-Y91 HydrophobicContact CD2-CE1 3.78Å; L57-Y91 HydrophobicContact CG-CD1 4.47Å; L57-Y91 HydrophobicContact CG-CE1 4.08Å; T61-Y91 HydrophobicContact CG2-CD1 3.72Å; T61-Y91 HydrophobicContact CG2-CE1 3.55Å; Y65-Y91 WeakPolarHBondContact OH-CB 3.23Å; M87-Y91 WeakPolarHBondContact O-CB 3.49Å; M87-Y91 PolarHBondContact O-N 2.96Å; D89-Y91 VanDerWaalsContact C-N 3.34Å; D89-Y91 PolarHBondContact O-N 3.33Å; Y91-H94 PolarHBondContact O-N 3.39Å; Y91-Y95 VanDerWaalsContact O-CB 3.28Å; Y91-Y95 WeakPolarHBondContact O-CB 3.49Å; Y91-Y95 PolarHBondContact O-N 3.04Å; Y91-L344 HydrophobicContact CE2-CB 4.31Å; Y91-L344 PolarHBondContact OH-O 2.67Å; Y91-I345 HydrophobicContact CE2-CG1 3.71Å
92	F	85.9	Confident	83	Confident	25 Å²	25	62 Å²	62	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-66.2	-44.1	176.2	179.1	-110.7	0	0	0	112.4	E50 I53 K54 L57 Q88 D89 H94 Y95 L96	E50-F92 HydrophobicContact CB-CZ 4.21Å; E50-F92 WeakPolarHBondContact O-CE2 3.5Å; E50-F92 WeakPolarHBondContact O-CZ 3.07Å; I53-F92 HydrophobicContact CB-CE2 4.19Å; I53-F92 HydrophobicContact CG2-CD2 4.24Å; I53-F92 HydrophobicContact CG2-CE2 3.88Å; K54-F92 HydrophobicContact CB-CD2 3.78Å; K54-F92 HydrophobicContact CB-CE2 3.51Å; K54-F92 HydrophobicContact CB-CG 4.44Å; K54-F92 HydrophobicContact CB-CZ 3.95Å; K54-F92 HydrophobicContact CD-CD1 4.17Å; K54-F92 HydrophobicContact CD-CD2 4.44Å; K54-F92 HydrophobicContact CD-CE1 4.19Å; K54-F92 HydrophobicContact CD-CE2 4.48Å; K54-F92 HydrophobicContact CD-CG 4.28Å; K54-F92 HydrophobicContact CD-CZ 4.33Å; K54-F92 HydrophobicContact CG-CD2 3.97Å; K54-F92 HydrophobicContact CG-CE2 4.14Å; K54-F92 HydrophobicContact CG-CG 4.18Å; K54-F92 HydrophobicContact CG-CZ 4.47Å; L57-F92 HydrophobicContact CD1-CB 4.48Å; L57-F92 HydrophobicContact CD1-CD2 4.05Å; Q88-F92 VanDerWaalsContact O-CB 3.24Å; Q88-F92 WeakPolarHBondContact O-CB 3.22Å; Q88-F92 PolarHBondContact O-N 3.44Å; D89-F92 PolarHBondContact O-N 3.11Å; F92-H94 PolarHBondContact O-N 3.08Å; F92-Y95 PolarHBondContact O-N 3.13Å; F92-L96 HydrophobicContact CD1-CD1 4.2Å; F92-L96 HydrophobicContact CD2-CD1 4.47Å; F92-L96 HydrophobicContact CD2-CG 4.39Å; F92-L96 HydrophobicContact CE1-CD1 3.6Å; F92-L96 HydrophobicContact CE1-CG 4.47Å; F92-L96 HydrophobicContact CE2-CD1 3.9Å; F92-L96 HydrophobicContact CE2-CD2 4.35Å; F92-L96 HydrophobicContact CE2-CG 4.05Å; F92-L96 HydrophobicContact CZ-CD1 3.44Å; F92-L96 VanDerWaalsContact CZ-CD1 3.44Å; F92-L96 HydrophobicContact CZ-CG 4.13Å; F92-L96 PolarHBondContact O-N 2.72Å
93	E	85.3	Confident	82	Confident	139 Å²	139	59.4 Å²	59.4	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-60.7	-43.2	174.3	-73	-176	173.4	0	0	112	D89 S97	D89-E93 WeakPolarHBondContact O-CG 3.46Å; D89-E93 PolarHBondContact O-N 3.48Å; E93-S97 WeakPolarHBondContact O-CB 3.29Å; E93-S97 PolarHBondContact O-N 3.09Å; E93-S97 VanDerWaalsContact O-N 3.09Å; E93-S97 PolarHBondContact O-OG 3.27Å
94	H	78.3	Confident	81.4	Confident	61 Å²	61	60.7 Å²	60.7	28%	0.282	29%	0.292	S	S	.	.	H	α-helix	trans	-64.2	-42.7	175.4	-170.5	-56	0	0	0	111.9	Q90 Y91 F92 S97 E98	Q90-H94 WeakPolarHBondContact O-CB 3.35Å; Q90-H94 PolarHBondContact O-N 3.37Å; Y91-H94 PolarHBondContact O-N 3.39Å; F92-H94 PolarHBondContact O-N 3.08Å; H94-S97 PolarHBondContact O-OG 3.07Å; H94-E98 IonicContact CE1-OE2 2.69Å; H94-E98 PolarHBondContact CE1-OE2 3.2Å; H94-E98 IonicContact ND1-OE2 3.21Å; H94-E98 IonicContact NE2-OE2 3.91Å; H94-E98 PolarHBondContact O-N 2.89Å; H94-E98 VanDerWaalsContact O-N 3.13Å
95	Y	80	Confident	81	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.016	31%	0.307	C	S	.	.	I	π-helix	trans	-62.1	-49	178.6	-177	-87.1	0	0	0	111.6	I53 L57 Y91 F92 S97 V99 Y100 Q103 L141 P143	I53-Y95 HydrophobicContact CG2-CD1 3.69Å; I53-Y95 HydrophobicContact CG2-CE1 3.7Å; L57-Y95 HydrophobicContact CD1-CD1 3.96Å; L57-Y95 HydrophobicContact CD1-CD2 4.07Å; L57-Y95 HydrophobicContact CD1-CG 3.56Å; L57-Y95 HydrophobicContact CD2-CD2 3.85Å; L57-Y95 HydrophobicContact CD2-CE2 4.1Å; L57-Y95 HydrophobicContact CD2-CG 4.16Å; L57-Y95 HydrophobicContact CG-CG 4.44Å; Y91-Y95 VanDerWaalsContact O-CB 3.28Å; Y91-Y95 WeakPolarHBondContact O-CB 3.49Å; Y91-Y95 PolarHBondContact O-N 3.04Å; F92-Y95 PolarHBondContact O-N 3.13Å; Y95-S97 PolarHBondContact O-N 3.24Å; Y95-V99 HydrophobicContact CD2-CB 3.9Å; Y95-V99 HydrophobicContact CD2-CG1 4.08Å; Y95-V99 HydrophobicContact CD2-CG2 4.2Å; Y95-V99 HydrophobicContact CE2-CB 3.88Å; Y95-V99 HydrophobicContact CE2-CG1 3.58Å; Y95-V99 HydrophobicContact CG-CB 4.39Å; Y95-V99 WeakPolarHBondContact O-CB 3.11Å; Y95-V99 PolarHBondContact O-N 3.1Å; Y95-Y100 HydrophobicContact CE1-CD2 4.19Å; Y95-Y100 WeakPolarHBondContact O-CB 3.22Å; Y95-Y100 PolarHBondContact O-N 3.11Å; Y95-Q103 VanDerWaalsContact OH-CD 3.3Å; Y95-Q103 PolarHBondContact OH-NE2 2.68Å; Y95-Q103 PolarHBondContact OH-OE1 3.47Å; Y95-L141 PolarHBondContact OH-O 3.12Å; Y95-P143 HydrophobicContact CE1-CG 4.46Å; Y95-P143 HydrophobicContact CE2-CG 3.46Å; Y95-P143 VanDerWaalsContact CE2-CG 3.46Å; Y95-P143 VanDerWaalsContact CZ-CG 3.46Å; Y95-P143 VanDerWaalsContact OH-CD 3.23Å; Y95-P143 WeakPolarHBondContact OH-CD 3.47Å; Y95-P143 WeakPolarHBondContact OH-CG 3.3Å
96	L	83	Confident	80.3	Confident	38 Å²	38	61.8 Å²	61.8	20%	0.199	30%	0.296	C	S	.	.	I	π-helix	trans	-66.1	-37.3	-179.4	-72.5	-175.6	0	0	0	113	E50 I53 F92 Y100	E50-L96 HydrophobicContact CG-CD1 4.41Å; I53-L96 HydrophobicContact CD1-CD2 4Å; I53-L96 HydrophobicContact CG2-CD2 4.29Å; F92-L96 HydrophobicContact CD1-CD1 4.2Å; F92-L96 HydrophobicContact CD2-CD1 4.47Å; F92-L96 HydrophobicContact CD2-CG 4.39Å; F92-L96 HydrophobicContact CE1-CD1 3.6Å; F92-L96 HydrophobicContact CE1-CG 4.47Å; F92-L96 HydrophobicContact CE2-CD1 3.9Å; F92-L96 HydrophobicContact CE2-CD2 4.35Å; F92-L96 HydrophobicContact CE2-CG 4.05Å; F92-L96 HydrophobicContact CZ-CD1 3.44Å; F92-L96 VanDerWaalsContact CZ-CD1 3.44Å; F92-L96 HydrophobicContact CZ-CG 4.13Å; F92-L96 PolarHBondContact O-N 2.72Å; L96-Y100 HydrophobicContact CD2-CD1 4.16Å; L96-Y100 HydrophobicContact CD2-CD2 4.4Å; L96-Y100 HydrophobicContact CD2-CG 4.04Å
97	S	76.1	Confident	79.6	Confident	70 Å²	70	56.8 Å²	56.8	49%	0.49	27%	0.273	S	S	.	.	I	π-helix	trans	-76.4	-41.8	-175.9	53.3	0	0	0	0	113.8	E93 H94 Y95	E93-S97 WeakPolarHBondContact O-CB 3.29Å; E93-S97 PolarHBondContact O-N 3.09Å; E93-S97 VanDerWaalsContact O-N 3.09Å; E93-S97 PolarHBondContact O-OG 3.27Å; H94-S97 PolarHBondContact O-OG 3.07Å; Y95-S97 PolarHBondContact O-N 3.24Å
98	E	73.3	Confident	79.2	Confident	122 Å²	122	63.2 Å²	63.2	57%	0.57	30%	0.296	S	S	*	.	I	π-helix	trans	-103.3	-52.6	-176.1	-61	-154.9	132.7	0	0	113.8	H94 F102	H94-E98 IonicContact CE1-OE2 2.69Å; H94-E98 PolarHBondContact CE1-OE2 3.2Å; H94-E98 IonicContact ND1-OE2 3.21Å; H94-E98 IonicContact NE2-OE2 3.91Å; H94-E98 PolarHBondContact O-N 2.89Å; H94-E98 VanDerWaalsContact O-N 3.13Å; E98-F102 WeakPolarHBondContact O-CB 3.47Å; E98-F102 PolarHBondContact O-N 3.2Å
99	V	72.7	Confident	79.1	Confident	19 Å²	19	66.2 Å²	66.2	12%	0.115	31%	0.31	C	S	.	.	I	π-helix	trans	-78.5	-53.9	-168.5	-174.2	0	0	0	0	111.1	Y95 R101 F102 Q103 I345 Y348	Y95-V99 HydrophobicContact CD2-CB 3.9Å; Y95-V99 HydrophobicContact CD2-CG1 4.08Å; Y95-V99 HydrophobicContact CD2-CG2 4.2Å; Y95-V99 HydrophobicContact CE2-CB 3.88Å; Y95-V99 HydrophobicContact CE2-CG1 3.58Å; Y95-V99 HydrophobicContact CG-CB 4.39Å; Y95-V99 WeakPolarHBondContact O-CB 3.11Å; Y95-V99 PolarHBondContact O-N 3.1Å; V99-R101 PolarHBondContact O-N 3.09Å; V99-F102 WeakPolarHBondContact O-CB 3.45Å; V99-F102 PolarHBondContact O-N 2.92Å; V99-F102 VanDerWaalsContact O-N 3.11Å; V99-Q103 HydrophobicContact CG1-CG 4.42Å; V99-Q103 WeakPolarHBondContact O-CG 3.46Å; V99-Q103 PolarHBondContact O-N 2.77Å; V99-I345 HydrophobicContact CG2-CG2 3.94Å; V99-Y348 HydrophobicContact CG1-CD2 4.49Å
100	Y	77.4	Confident	78.7	Confident	30 Å²	30	63.5 Å²	63.5	12%	0.118	30%	0.296	C	S	.	.	I	π-helix	trans	-58.2	-45.6	-177.4	-177.2	-106.3	0	0	0	112.8	I53 Y95 L96 F102 Q103 L104 P140	I53-Y100 HydrophobicContact CD1-CD2 3.82Å; I53-Y100 HydrophobicContact CD1-CE2 3.36Å; I53-Y100 HydrophobicContact CG1-CE2 4.46Å; Y95-Y100 HydrophobicContact CE1-CD2 4.19Å; Y95-Y100 WeakPolarHBondContact O-CB 3.22Å; Y95-Y100 PolarHBondContact O-N 3.11Å; L96-Y100 HydrophobicContact CD2-CD1 4.16Å; L96-Y100 HydrophobicContact CD2-CD2 4.4Å; L96-Y100 HydrophobicContact CD2-CG 4.04Å; Y100-F102 VanDerWaalsContact C-N 3.28Å; Y100-F102 PolarHBondContact O-N 3.17Å; Y100-Q103 PolarHBondContact O-N 2.71Å; Y100-L104 HydrophobicContact CD1-CD1 3.93Å; Y100-L104 HydrophobicContact CE1-CD1 3.49Å; Y100-L104 VanDerWaalsContact CE1-CD1 3.49Å; Y100-L104 HydrophobicContact CE1-CG 4.43Å; Y100-L104 PolarHBondContact O-N 2.92Å; Y100-L104 VanDerWaalsContact O-N 3.08Å; Y100-P140 HydrophobicContact CD2-CB 4.32Å; Y100-P140 HydrophobicContact CE2-CB 3.32Å; Y100-P140 HydrophobicContact CE2-CG 4.17Å
101	R	76.4	Confident	78.4	Confident	173 Å²	173	58.4 Å²	58.4	65%	0.653	27%	0.272	S	S	*	.	H	α-helix	trans	-63.3	-34.5	177.9	-167.1	-177.1	69.7	91.7	2.9	112.4	V99 V105	V99-R101 PolarHBondContact O-N 3.09Å; R101-V105 WeakPolarHBondContact O-CG2 3.46Å
102	F	75.9	Confident	78.4	Confident	94 Å²	94	61.7 Å²	61.7	41%	0.412	29%	0.288	S	S	.	.	H	α-helix	trans	-72.7	-44.5	176.4	-177.6	-97.1	0	0	0	111.6	E98 V99 Y100 L104 V105 H106	E98-F102 WeakPolarHBondContact O-CB 3.47Å; E98-F102 PolarHBondContact O-N 3.2Å; V99-F102 WeakPolarHBondContact O-CB 3.45Å; V99-F102 PolarHBondContact O-N 2.92Å; V99-F102 VanDerWaalsContact O-N 3.11Å; Y100-F102 VanDerWaalsContact C-N 3.28Å; Y100-F102 PolarHBondContact O-N 3.17Å; F102-L104 PolarHBondContact O-N 3.42Å; F102-V105 PolarHBondContact O-N 3.46Å; F102-H106 PolarHBondContact O-N 3.31Å
103	Q	72.4	Confident	78.1	Confident	5 Å²	5	63.2 Å²	63.2	2%	0.023	30%	0.295	C	S	.	.	H	α-helix	trans	-56	-48.1	176.3	-72.7	168.4	-30.2	0	0	112.3	Y95 V99 Y100 V105 H106 Q107 L141	Y95-Q103 VanDerWaalsContact OH-CD 3.3Å; Y95-Q103 PolarHBondContact OH-NE2 2.68Å; Y95-Q103 PolarHBondContact OH-OE1 3.47Å; V99-Q103 HydrophobicContact CG1-CG 4.42Å; V99-Q103 WeakPolarHBondContact O-CG 3.46Å; V99-Q103 PolarHBondContact O-N 2.77Å; Y100-Q103 PolarHBondContact O-N 2.71Å; Q103-V105 VanDerWaalsContact C-N 3.29Å; Q103-V105 PolarHBondContact O-N 3.46Å; Q103-H106 PolarHBondContact O-N 2.85Å; Q103-Q107 VanDerWaalsContact O-CB 3.23Å; Q103-Q107 WeakPolarHBondContact O-CB 3.27Å; Q103-Q107 PolarHBondContact O-N 2.85Å; Q103-L141 HydrophobicContact CB-CB 4.25Å; Q103-L141 HydrophobicContact CG-CB 4.42Å; Q103-L141 PolarHBondContact NE2-O 3.01Å; Q103-L141 VanDerWaalsContact NE2-O 3.17Å; Q103-L141 PolarHBondContact OE1-O 3.48Å
104	L	76.3	Confident	77.8	Confident	58 Å²	58	56.9 Å²	56.9	30%	0.304	27%	0.266	S	S	.	.	H	α-helix	trans	-58.6	-38.5	178.7	-76.4	171.2	0	0	0	113	Y100 F102 R108 P140	Y100-L104 HydrophobicContact CD1-CD1 3.93Å; Y100-L104 HydrophobicContact CE1-CD1 3.49Å; Y100-L104 VanDerWaalsContact CE1-CD1 3.49Å; Y100-L104 HydrophobicContact CE1-CG 4.43Å; Y100-L104 PolarHBondContact O-N 2.92Å; Y100-L104 VanDerWaalsContact O-N 3.08Å; F102-L104 PolarHBondContact O-N 3.42Å; L104-R108 WeakPolarHBondContact O-CB 3.39Å; L104-R108 PolarHBondContact O-N 2.74Å; L104-P140 HydrophobicContact CD2-CB 4.32Å
105	V	78.7	Confident	77.8	Confident	74 Å²	74	58.3 Å²	58.3	45%	0.448	27%	0.269	S	S	.	.	H	α-helix	trans	-70.5	-42.9	176.7	174	0	0	0	0	111	R101 F102 Q103 R108 Q109	R101-V105 WeakPolarHBondContact O-CG2 3.46Å; F102-V105 PolarHBondContact O-N 3.46Å; Q103-V105 VanDerWaalsContact C-N 3.29Å; Q103-V105 PolarHBondContact O-N 3.46Å; V105-R108 PolarHBondContact O-N 2.82Å; V105-Q109 WeakPolarHBondContact O-CG 3.39Å; V105-Q109 PolarHBondContact O-N 3.42Å; V105-Q109 VanDerWaalsContact O-N 3.13Å
106	H	78.4	Confident	77.8	Confident	49 Å²	49	61 Å²	61	23%	0.227	29%	0.292	C	S	.	.	H	α-helix	trans	-61.6	-51.4	178.1	-173.5	-109.3	0	0	0	112	F102 Q103 R108 Q109 Q110 D377	F102-H106 PolarHBondContact O-N 3.31Å; Q103-H106 PolarHBondContact O-N 2.85Å; H106-R108 VanDerWaalsContact C-N 3.31Å; H106-R108 PolarHBondContact O-N 3.27Å; H106-Q109 WeakPolarHBondContact O-CA 3.33Å; H106-Q109 WeakPolarHBondContact O-CB 3.25Å; H106-Q109 PolarHBondContact O-N 3.02Å; H106-Q110 PolarHBondContact CE1-NE2 2.76Å; H106-Q110 PolarHBondContact ND1-OE1 3.04Å; H106-Q110 WeakPolarHBondContact O-CG 3.39Å; H106-Q110 PolarHBondContact O-N 3.17Å; H106-D377 IonicContact CE1-OD1 2.91Å; H106-D377 PolarHBondContact CE1-OD1 3.34Å; H106-D377 IonicContact ND1-OD1 2.87Å; H106-D377 PolarHBondContact ND1-OD1 3.02Å; H106-D377 VanDerWaalsContact ND1-OD1 3.08Å
107	Q	75.4	Confident	77.5	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-58	-42	179.2	-175.5	179.4	55.5	0	0	112.4	Q103 Q109 Q110 L111 P138 L139 W208	Q103-Q107 VanDerWaalsContact O-CB 3.23Å; Q103-Q107 WeakPolarHBondContact O-CB 3.27Å; Q103-Q107 PolarHBondContact O-N 2.85Å; Q107-Q109 PolarHBondContact O-N 2.76Å; Q107-Q110 PolarHBondContact O-N 3.46Å; Q107-L111 PolarHBondContact O-N 2.61Å; Q107-P138 HydrophobicContact CG-CB 3.86Å; Q107-L139 PolarHBondContact NE2-O 2.88Å; Q107-L139 PolarHBondContact OE1-O 2.79Å; Q107-L139 VanDerWaalsContact OE1-O 3.13Å; Q107-W208 HydrophobicContact CG-CH2 3.72Å; Q107-W208 HydrophobicContact CG-CZ2 3.57Å; Q107-W208 VanDerWaalsContact NE2-CH2 3.3Å
108	R	79.2	Confident	77.4	Confident	155 Å²	155	60.4 Å²	60.4	59%	0.585	28%	0.281	S	S	*	.	H	α-helix	trans	-61.9	-42.4	174.1	179.6	175.7	173.4	154.3	3.7	112.1	L104 V105 H106 Q110 L111 E112	L104-R108 WeakPolarHBondContact O-CB 3.39Å; L104-R108 PolarHBondContact O-N 2.74Å; V105-R108 PolarHBondContact O-N 2.82Å; H106-R108 VanDerWaalsContact C-N 3.31Å; H106-R108 PolarHBondContact O-N 3.27Å; R108-Q110 VanDerWaalsContact C-N 3.35Å; R108-L111 PolarHBondContact O-N 3.12Å; R108-E112 WeakPolarHBondContact CG-OE1 3.48Å; R108-E112 IonicContact CZ-OE1 3.77Å; R108-E112 IonicContact NE-OE1 3.65Å; R108-E112 PolarHBondContact NE-OE1 3.13Å; R108-E112 IonicContact NH2-OE1 2.63Å; R108-E112 PolarHBondContact NH2-OE1 3.39Å; R108-E112 WeakPolarHBondContact O-CB 3.25Å; R108-E112 WeakPolarHBondContact O-CG 3.36Å; R108-E112 PolarHBondContact O-N 2.96Å
109	Q	83	Confident	77.6	Confident	92 Å²	92	58.7 Å²	58.7	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-63.3	-40	176.8	-70.7	169.7	-3.9	0	0	111.7	V105 H106 Q107 E112 Q113	V105-Q109 WeakPolarHBondContact O-CG 3.39Å; V105-Q109 PolarHBondContact O-N 3.42Å; V105-Q109 VanDerWaalsContact O-N 3.13Å; H106-Q109 WeakPolarHBondContact O-CA 3.33Å; H106-Q109 WeakPolarHBondContact O-CB 3.25Å; H106-Q109 PolarHBondContact O-N 3.02Å; Q107-Q109 PolarHBondContact O-N 2.76Å; Q109-E112 PolarHBondContact O-N 2.92Å; Q109-Q113 VanDerWaalsContact O-CG 3.31Å; Q109-Q113 WeakPolarHBondContact O-CG 3.17Å; Q109-Q113 PolarHBondContact O-N 3.17Å
110	Q	79.4	Confident	77.6	Confident	3 Å²	3	61.4 Å²	61.4	1%	0.014	31%	0.307	C	S	.	.	H	α-helix	trans	-64.5	-42.9	175.6	-67.4	170.1	-47.5	0	0	112.3	H106 Q107 R108 E112 Q113 L114 P375 I376 D377	H106-Q110 PolarHBondContact CE1-NE2 2.76Å; H106-Q110 PolarHBondContact ND1-OE1 3.04Å; H106-Q110 WeakPolarHBondContact O-CG 3.39Å; H106-Q110 PolarHBondContact O-N 3.17Å; Q107-Q110 PolarHBondContact O-N 3.46Å; R108-Q110 VanDerWaalsContact C-N 3.35Å; Q110-E112 VanDerWaalsContact C-N 3.33Å; Q110-E112 PolarHBondContact O-N 3.26Å; Q110-Q113 WeakPolarHBondContact O-CB 3.47Å; Q110-Q113 PolarHBondContact O-N 3.16Å; Q110-L114 PolarHBondContact O-N 3.49Å; Q110-P375 HydrophobicContact CB-CB 3.71Å; Q110-P375 HydrophobicContact CB-CG 4.19Å; Q110-P375 HydrophobicContact CG-CB 3.74Å; Q110-I376 PolarHBondContact NE2-O 2.97Å; Q110-D377 PolarHBondContact NE2-OD1 2.82Å; Q110-D377 PolarHBondContact OE1-OD1 2.9Å; Q110-D377 PolarHBondContact OE1-OD2 2.85Å; Q110-D377 VanDerWaalsContact OE1-OD2 3.11Å
111	L	77.9	Confident	77.2	Confident	3 Å²	3	66 Å²	66	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-65.4	-35.2	174.5	-74.1	168.5	0	0	0	112.5	Q107 R108 L114 R115 P138 W208	Q107-L111 PolarHBondContact O-N 2.61Å; R108-L111 PolarHBondContact O-N 3.12Å; L111-L114 HydrophobicContact CD2-CD1 4.25Å; L111-L114 PolarHBondContact O-N 2.88Å; L111-R115 WeakPolarHBondContact O-CG 3.47Å; L111-R115 PolarHBondContact O-N 2.85Å; L111-P138 HydrophobicContact CD1-CB 3.62Å; L111-P138 HydrophobicContact CD1-CG 3.83Å; L111-W208 HydrophobicContact CD1-CZ3 4.4Å; L111-W208 HydrophobicContact CD2-CE3 3.82Å; L111-W208 HydrophobicContact CD2-CZ3 3.94Å; L111-W208 HydrophobicContact CG-CE3 4.33Å; L111-W208 HydrophobicContact CG-CZ3 4.28Å
112	E	81.2	Confident	76.5	Confident	80 Å²	80	63 Å²	63	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-68.2	-37	172.7	-73.1	172.7	-172.6	0	0	111.7	R108 Q109 Q110 R115 A116	R108-E112 WeakPolarHBondContact CG-OE1 3.48Å; R108-E112 IonicContact CZ-OE1 3.77Å; R108-E112 IonicContact NE-OE1 3.65Å; R108-E112 PolarHBondContact NE-OE1 3.13Å; R108-E112 IonicContact NH2-OE1 2.63Å; R108-E112 PolarHBondContact NH2-OE1 3.39Å; R108-E112 WeakPolarHBondContact O-CB 3.25Å; R108-E112 WeakPolarHBondContact O-CG 3.36Å; R108-E112 PolarHBondContact O-N 2.96Å; Q109-E112 PolarHBondContact O-N 2.92Å; Q110-E112 VanDerWaalsContact C-N 3.33Å; Q110-E112 PolarHBondContact O-N 3.26Å; E112-R115 PolarHBondContact O-N 3.28Å; E112-A116 PolarHBondContact O-N 3.06Å; E112-A116 VanDerWaalsContact O-N 3.15Å
113	Q	80.9	Confident	75.7	Confident	57 Å²	57	63.6 Å²	63.6	27%	0.266	34%	0.338	S	S	.	.	H	α-helix	trans	-63.7	-46.7	170.5	-72.2	169.7	8.1	0	0	111.7	Q109 Q110 R115 A116 V117 P375	Q109-Q113 VanDerWaalsContact O-CG 3.31Å; Q109-Q113 WeakPolarHBondContact O-CG 3.17Å; Q109-Q113 PolarHBondContact O-N 3.17Å; Q110-Q113 WeakPolarHBondContact O-CB 3.47Å; Q110-Q113 PolarHBondContact O-N 3.16Å; Q113-R115 VanDerWaalsContact C-N 3.34Å; Q113-R115 PolarHBondContact O-N 3.46Å; Q113-A116 WeakPolarHBondContact O-CB 3.44Å; Q113-A116 PolarHBondContact O-N 3.47Å; Q113-A116 VanDerWaalsContact O-N 3.08Å; Q113-V117 WeakPolarHBondContact O-CG2 3.33Å; Q113-V117 PolarHBondContact O-N 3.42Å; Q113-P375 HydrophobicContact CB-CG 4.25Å
114	L	78.3	Confident	75	Confident	7 Å²	7	69.3 Å²	69.3	4%	0.037	38%	0.375	C	S	.	.	H	α-helix	trans	-57.5	-43.8	175.5	-84.1	-179.7	0	0	0	113	Q110 L111 A116 V117 K118 W208 L210 L374 P375	Q110-L114 PolarHBondContact O-N 3.49Å; L111-L114 HydrophobicContact CD2-CD1 4.25Å; L111-L114 PolarHBondContact O-N 2.88Å; L114-A116 VanDerWaalsContact C-N 3.28Å; L114-A116 PolarHBondContact O-N 2.95Å; L114-V117 PolarHBondContact O-N 3.5Å; L114-K118 WeakPolarHBondContact O-CB 3.34Å; L114-K118 PolarHBondContact O-N 2.83Å; L114-W208 HydrophobicContact CD1-CB 3.53Å; L114-W208 WeakPolarHBondContact CD2-O 3.24Å; L114-W208 HydrophobicContact CG-CB 4.33Å; L114-L210 HydrophobicContact CB-CD1 4.31Å; L114-L210 HydrophobicContact CD1-CD1 4.42Å; L114-L210 HydrophobicContact CD1-CG 4.14Å; L114-L374 HydrophobicContact CD2-CD2 3.7Å; L114-P375 HydrophobicContact CD2-CG 4.36Å; L114-P375 HydrophobicContact CG-CG 4.08Å
115	R	78.7	Confident	74.1	Confident	90 Å²	90	74.2 Å²	74.2	34%	0.34	40%	0.396	S	S	.	.	H	α-helix	trans	-55.6	-45.5	173.5	-78.6	167.6	-174.5	161.4	5.4	111.2	L111 E112 Q113 S119 F135	L111-R115 WeakPolarHBondContact O-CG 3.47Å; L111-R115 PolarHBondContact O-N 2.85Å; E112-R115 PolarHBondContact O-N 3.28Å; Q113-R115 VanDerWaalsContact C-N 3.34Å; Q113-R115 PolarHBondContact O-N 3.46Å; R115-S119 WeakPolarHBondContact O-CB 3.35Å; R115-S119 PolarHBondContact O-N 2.56Å; R115-F135 HydrophobicContact CB-CE1 4.31Å; R115-F135 HydrophobicContact CB-CZ 4.41Å; R115-F135 HydrophobicContact CG-CD1 3.64Å; R115-F135 HydrophobicContact CG-CD2 4.4Å; R115-F135 HydrophobicContact CG-CE1 3.23Å; R115-F135 HydrophobicContact CG-CE2 4.08Å; R115-F135 HydrophobicContact CG-CG 4.21Å; R115-F135 HydrophobicContact CG-CZ 3.51Å
116	A	80.5	Confident	73.1	Confident	61 Å²	61	75.2 Å²	75.2	50%	0.504	40%	0.399	S	S	.	.	H	α-helix	trans	-64.7	-45	178.5	0	0	0	0	0	112.3	E112 Q113 L114 S119 A120	E112-A116 PolarHBondContact O-N 3.06Å; E112-A116 VanDerWaalsContact O-N 3.15Å; Q113-A116 WeakPolarHBondContact O-CB 3.44Å; Q113-A116 PolarHBondContact O-N 3.47Å; Q113-A116 VanDerWaalsContact O-N 3.08Å; L114-A116 VanDerWaalsContact C-N 3.28Å; L114-A116 PolarHBondContact O-N 2.95Å; A116-S119 PolarHBondContact O-N 2.96Å; A116-A120 WeakPolarHBondContact O-CB 3.46Å; A116-A120 PolarHBondContact O-N 3.47Å
117	V	76	Confident	71.9	Confident	30 Å²	30	81.9 Å²	81.9	18%	0.182	43%	0.43	C	S	.	.	H	α-helix	trans	-60.3	-49.5	176.2	177.1	0	0	0	0	110.8	Q113 L114 S119 A120 V121 Q372	Q113-V117 WeakPolarHBondContact O-CG2 3.33Å; Q113-V117 PolarHBondContact O-N 3.42Å; L114-V117 PolarHBondContact O-N 3.5Å; V117-S119 VanDerWaalsContact C-N 3.31Å; V117-S119 PolarHBondContact O-N 2.95Å; V117-A120 PolarHBondContact O-N 3.04Å; V117-V121 PolarHBondContact O-N 2.77Å; V117-Q372 HydrophobicContact CG1-CB 4.29Å; V117-Q372 HydrophobicContact CG2-CB 3.97Å
118	K	74.1	Confident	70.9	Confident	65 Å²	65	88.9 Å²	88.9	28%	0.283	47%	0.467	S	S	.	.	H	α-helix	trans	-64.2	-35.3	179.5	-166.1	169.4	-170.7	171.6	0	112.3	L114 L210 E211	L114-K118 WeakPolarHBondContact O-CB 3.34Å; L114-K118 PolarHBondContact O-N 2.83Å; K118-L210 HydrophobicContact CD-CD1 4.25Å; K118-E211 WeakPolarHBondContact CE-OE1 3.43Å; K118-E211 IonicContact NZ-OE1 3.83Å; K118-E211 PolarHBondContact NZ-OE1 3.12Å
119	S	76.4	Confident	69.5	Low	86 Å²	86	83.7 Å²	83.7	60%	0.601	46%	0.458	S	S	*	.	H	α-helix	trans	-68	-38.1	174.6	-174.3	0	0	0	0	112.6	R115 A116 V117 V121 K122	R115-S119 WeakPolarHBondContact O-CB 3.35Å; R115-S119 PolarHBondContact O-N 2.56Å; A116-S119 PolarHBondContact O-N 2.96Å; V117-S119 VanDerWaalsContact C-N 3.31Å; V117-S119 PolarHBondContact O-N 2.95Å; S119-V121 VanDerWaalsContact C-N 3.28Å; S119-V121 PolarHBondContact O-N 2.67Å; S119-K122 PolarHBondContact O-N 3.03Å
120	A	73.8	Confident	67.8	Low	77 Å²	77	88.2 Å²	88.2	64%	0.636	48%	0.479	S	S	*	.	H	α-helix	trans	-70	-20.9	-179.3	0	0	0	0	0	114.3	A116 V117	A116-A120 WeakPolarHBondContact O-CB 3.46Å; A116-A120 PolarHBondContact O-N 3.47Å; V117-A120 PolarHBondContact O-N 3.04Å
121	V	68.6	Low	66.4	Low	127 Å²	127	92.2 Å²	92.2	77%	0.77	51%	0.507	S	S	*	.	H	α-helix	trans	-91.6	-19.5	178.9	179	0	0	0	0	112.6	V117 S119	V117-V121 PolarHBondContact O-N 2.77Å; S119-V121 VanDerWaalsContact C-N 3.28Å; S119-V121 PolarHBondContact O-N 2.67Å
122	K	62	Low	65.2	Low	108 Å²	108	98.5 Å²	98.5	47%	0.47	54%	0.541	S	S	.	.	S	Bend	trans	-70.6	133.9	177.3	-77.2	-176.3	174.8	-169.1	0	111.3	S119	S119-K122 PolarHBondContact O-N 3.03Å
123	D	58.4	Low	63.8	Low	108 Å²	108	103.5 Å²	103.5	58%	0.578	56%	0.562	S	S	*	*			trans	-65.9	127.3	174.1	-168.8	-41.6	0	0	0	109.4	H125 D126	D123-H125 PolarHBondContact O-N 2.82Å; D123-H125 IonicContact OD1-CD2 3.53Å; D123-H125 PolarHBondContact OD1-N 3.16Å; D123-H125 VanDerWaalsContact OD1-N 3.08Å; D123-D126 PolarHBondContact O-N 2.84Å; D123-D126 VanDerWaalsContact O-N 3.16Å
124	P	59	Low	62.6	Low	124 Å²	124	108.1 Å²	108.1	81%	0.805	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-1.8	-178.8	25.8	-35.8	0	0	0	115.1
125	H	56.9	Low	61.5	Low	161 Å²	161	110 Å²	110	75%	0.745	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-0.2	174	-76.7	-63.2	0	0	0	116	D123 E127	D123-H125 PolarHBondContact O-N 2.82Å; D123-H125 IonicContact OD1-CD2 3.53Å; D123-H125 PolarHBondContact OD1-N 3.16Å; D123-H125 VanDerWaalsContact OD1-N 3.08Å; H125-E127 PolarHBondContact O-N 3.05Å; H125-E127 VanDerWaalsContact O-N 3.14Å
126	D	57.1	Low	60.5	Low	96 Å²	96	107.8 Å²	107.8	51%	0.513	59%	0.593	S	S	.	*			trans	-84.6	82	175.1	-168.2	5.9	0	0	0	112.6	D123 N128	D123-D126 PolarHBondContact O-N 2.84Å; D123-D126 VanDerWaalsContact O-N 3.16Å; D126-N128 PolarHBondContact O-N 2.89Å; D126-N128 VanDerWaalsContact O-N 3.14Å; D126-N128 PolarHBondContact OD1-N 3.01Å
127	E	53.7	Low	59.6	Low	189 Å²	189	112.9 Å²	112.9	88%	0.883	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-0.6	177.8	-63.3	-172.8	164.6	0	0	114.3	H125	H125-E127 PolarHBondContact O-N 3.05Å; H125-E127 VanDerWaalsContact O-N 3.14Å
128	N	53.1	Low	58.8	Low	147 Å²	147	113.2 Å²	113.2	79%	0.786	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	10.2	179.9	-77	-47.6	0	0	0	114.3	D126 E130	D126-N128 PolarHBondContact O-N 2.89Å; D126-N128 VanDerWaalsContact O-N 3.14Å; D126-N128 PolarHBondContact OD1-N 3.01Å; N128-E130 PolarHBondContact O-N 2.88Å
129	A	49.7	Very low	58.4	Low	47 Å²	47	113.7 Å²	113.7	39%	0.388	61%	0.614	S	S	.	*			trans	-64.4	100	176.1	0	0	0	0	0	111.6	S131	A129-S131 PolarHBondContact O-N 3.1Å
130	E	47.3	Very low	57.8	Low	187 Å²	187	110 Å²	110	87%	0.874	59%	0.589	S	S	*	*			trans	-55.4	136.5	176.6	-85.5	-175.1	129.2	0	0	111.7	N128	N128-E130 PolarHBondContact O-N 2.88Å
131	S	51.9	Low	57.8	Low	86 Å²	86	106.5 Å²	106.5	60%	0.601	56%	0.559	S	S	*	*			trans	-89	128	-157.3	48.9	0	0	0	0	113.8	A129 K133	A129-S131 PolarHBondContact O-N 3.1Å; S131-K133 WeakPolarHBondContact O-CG 3.39Å; S131-K133 PolarHBondContact O-N 2.85Å
132	D	52.8	Low	58.2	Low	135 Å²	135	101 Å²	101	72%	0.722	53%	0.525	S	S	*	.	S	Bend	trans	46.6	-5	154.5	-67.2	-26.2	0	0	0	121.1
133	K	51.6	Low	59	Low	186 Å²	186	96.1 Å²	96.1	81%	0.809	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-17.6	-171	-71.6	-176.9	179.7	-175.8	0	114.8	S131	S131-K133 WeakPolarHBondContact O-CG 3.39Å; S131-K133 PolarHBondContact O-N 2.85Å
134	D	54	Low	60.4	Low	154 Å²	154	91.4 Å²	91.4	82%	0.824	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	4.7	-179.8	-74.5	-18.1	0	0	0	113.7	P136	D134-P136 VanDerWaalsContact O-CD 3.27Å; D134-P136 WeakPolarHBondContact O-CD 3.13Å
135	F	56.1	Low	61.8	Low	47 Å²	47	86 Å²	86	21%	0.206	45%	0.446	C	S	.	.	S	Bend	trans	-77.5	114.7	170.3	-70.7	-83.8	0	0	0	109.2	R115 E137 L210	R115-F135 HydrophobicContact CB-CE1 4.31Å; R115-F135 HydrophobicContact CB-CZ 4.41Å; R115-F135 HydrophobicContact CG-CD1 3.64Å; R115-F135 HydrophobicContact CG-CD2 4.4Å; R115-F135 HydrophobicContact CG-CE1 3.23Å; R115-F135 HydrophobicContact CG-CE2 4.08Å; R115-F135 HydrophobicContact CG-CG 4.21Å; R115-F135 HydrophobicContact CG-CZ 3.51Å; F135-E137 PolarHBondContact O-N 2.95Å; F135-L210 HydrophobicContact CD1-CD1 3.76Å; F135-L210 HydrophobicContact CD1-CD2 4.46Å; F135-L210 HydrophobicContact CE1-CD1 3.36Å; F135-L210 HydrophobicContact CZ-CD1 4.45Å
136	P	57.4	Low	63.4	Low	42 Å²	42	80.6 Å²	80.6	27%	0.273	42%	0.424	S	S	.	.			trans	-58.6	138.3	176.4	26	-34.3	0	0	0	109.4	D134 L210 V401	D134-P136 VanDerWaalsContact O-CD 3.27Å; D134-P136 WeakPolarHBondContact O-CD 3.13Å; P136-L210 HydrophobicContact CG-CD2 4.43Å; P136-V401 HydrophobicContact CG-CG2 4.21Å
137	E	61.6	Low	64.9	Low	168 Å²	168	80.2 Å²	80.2	79%	0.785	42%	0.415	S	S	*	.			trans	-64.8	132.6	172.3	-170.7	163.8	-155	0	0	108.7	F135 L139	F135-E137 PolarHBondContact O-N 2.95Å; E137-L139 PolarHBondContact O-N 3.29Å
138	P	59.2	Low	66.8	Low	38 Å²	38	73.7 Å²	73.7	25%	0.247	39%	0.388	C	S	.	.			trans	-53.6	113.7	178.5	11.8	-24.6	0	0	0	111.4	Q107 L111	Q107-P138 HydrophobicContact CG-CB 3.86Å; L111-P138 HydrophobicContact CD1-CB 3.62Å; L111-P138 HydrophobicContact CD1-CG 3.83Å
139	L	65.6	Low	68.8	Low	74 Å²	74	69.3 Å²	69.3	39%	0.387	36%	0.361	S	S	.	.			trans	-79.6	135.8	169.1	-64.6	177.1	0	0	0	107.9	Q107 E137 L141 Y398 P399	Q107-L139 PolarHBondContact NE2-O 2.88Å; Q107-L139 PolarHBondContact OE1-O 2.79Å; Q107-L139 VanDerWaalsContact OE1-O 3.13Å; E137-L139 PolarHBondContact O-N 3.29Å; L139-L141 PolarHBondContact O-N 2.87Å; L139-Y398 WeakPolarHBondContact CD1-O 3.47Å; L139-P399 WeakPolarHBondContact CB-O 3.08Å; L139-P399 PolarHBondContact N-O 3.17Å; L139-P399 VanDerWaalsContact N-O 3.12Å
140	P	64.3	Low	70.9	Confident	10 Å²	10	75.1 Å²	75.1	7%	0.065	38%	0.377	C	S	.	.			trans	-52.1	139.4	-176.2	19	-31.7	0	0	0	112.8	K49 Y100 L104 I142	K49-P140 HydrophobicContact CD-CG 4.19Å; K49-P140 HydrophobicContact CG-CG 4.4Å; Y100-P140 HydrophobicContact CD2-CB 4.32Å; Y100-P140 HydrophobicContact CE2-CB 3.32Å; Y100-P140 HydrophobicContact CE2-CG 4.17Å; L104-P140 HydrophobicContact CD2-CB 4.32Å; P140-I142 HydrophobicContact CB-CG1 4.46Å; P140-I142 HydrophobicContact CG-CD1 4.43Å; P140-I142 HydrophobicContact CG-CG1 4.43Å; P140-I142 PolarHBondContact O-N 2.94Å
141	L	74.5	Confident	73.1	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.016	35%	0.352	C	S	.	.			trans	-75.2	76.7	177.9	-163.8	66.3	0	0	0	110.8	Y95 Q103 L139 Y348 D377 L379 P399	Y95-L141 PolarHBondContact OH-O 3.12Å; Q103-L141 HydrophobicContact CB-CB 4.25Å; Q103-L141 HydrophobicContact CG-CB 4.42Å; Q103-L141 PolarHBondContact NE2-O 3.01Å; Q103-L141 VanDerWaalsContact NE2-O 3.17Å; Q103-L141 PolarHBondContact OE1-O 3.48Å; L139-L141 PolarHBondContact O-N 2.87Å; L141-Y348 HydrophobicContact CD2-CD1 4.37Å; L141-Y348 HydrophobicContact CD2-CE1 3.56Å; L141-D377 HydrophobicContact CD2-CB 4.2Å; L141-L379 HydrophobicContact CD1-CD2 3.67Å; L141-L379 HydrophobicContact CD2-CD2 4.23Å; L141-L379 HydrophobicContact CG-CD2 4.22Å; L141-P399 HydrophobicContact CD1-CB 3.59Å; L141-P399 HydrophobicContact CD1-CG 3.89Å
142	I	76.4	Confident	75.2	Confident	10 Å²	10	66.5 Å²	66.5	5%	0.051	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-65.8	134.1	179.4	-66.1	167.8	0	0	0	108.9	E52 I53 A56 P140 H396	E52-I142 HydrophobicContact CB-CD1 4.41Å; I53-I142 HydrophobicContact CG1-CD1 4.26Å; I53-I142 HydrophobicContact CG1-CG1 3.8Å; A56-I142 HydrophobicContact CB-CG2 4.06Å; P140-I142 HydrophobicContact CB-CG1 4.46Å; P140-I142 HydrophobicContact CG-CD1 4.43Å; P140-I142 HydrophobicContact CG-CG1 4.43Å; P140-I142 PolarHBondContact O-N 2.94Å; I142-H396 PolarHBondContact O-CD2 2.86Å; I142-H396 PolarHBondContact O-NE2 2.59Å
143	P	78.9	Confident	77.3	Confident	7 Å²	7	63.9 Å²	63.9	5%	0.045	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-60	146	-175.8	-25.6	37.8	0	0	0	112.5	L57 Y95 T145	L57-P143 HydrophobicContact CD2-CG 3.89Å; Y95-P143 HydrophobicContact CE1-CG 4.46Å; Y95-P143 HydrophobicContact CE2-CG 3.46Å; Y95-P143 VanDerWaalsContact CE2-CG 3.46Å; Y95-P143 VanDerWaalsContact CZ-CG 3.46Å; Y95-P143 VanDerWaalsContact OH-CD 3.23Å; Y95-P143 WeakPolarHBondContact OH-CD 3.47Å; Y95-P143 WeakPolarHBondContact OH-CG 3.3Å; P143-T145 PolarHBondContact O-N 2.81Å
144	A	88.1	Confident	79.5	Confident	9 Å²	9	59.6 Å²	59.6	7%	0.074	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-67.1	123.4	174.8	0	0	0	0	0	110.7	W191 I380 H396	A144-W191 HydrophobicContact CB-CH2 4.04Å; A144-I380 HydrophobicContact CB-CD1 3.74Å; A144-I380 HydrophobicContact CB-CG1 3.65Å; A144-H396 HydrophobicContact CB-CB 4.24Å
145	T	88.2	Confident	81.6	Confident	10 Å²	10	52.2 Å²	52.2	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	129.3	176.9	-52.9	0	0	0	0	109.2	Q59 P143 W147 G394 T395	Q59-T145 HydrophobicContact CB-CG2 3.76Å; Q59-T145 HydrophobicContact CG-CG2 3.52Å; P143-T145 PolarHBondContact O-N 2.81Å; T145-W147 HydrophobicContact CG2-CE3 3.98Å; T145-W147 HydrophobicContact CG2-CZ3 3.93Å; T145-G394 CarbonylContact O-C 3.51Å; T145-G394 WeakPolarHBondContact O-CA 3.49Å; T145-T395 PolarHBondContact N-O 2.87Å; T145-T395 PolarHBondContact O-N 2.89Å
146	V	89.6	Confident	83.5	Confident	48 Å²	48	51.5 Å²	51.5	29%	0.291	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.6	-176.6	-177	0	0	0	0	109.9	W191 I380 C393	V146-W191 HydrophobicContact CG2-CZ2 4.28Å; V146-I380 HydrophobicContact CG2-CD1 3.8Å; V146-C393 WeakPolarHBondContact CA-O 3.49Å
147	W	89.7	Confident	85.4	Confident	88 Å²	88	56.1 Å²	56.1	33%	0.333	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	175.9	175.6	62.9	95.9	0	0	0	110.7	Q59 T145 C393 G394 T395	Q59-W147 VanDerWaalsContact NE2-CE3 3.27Å; T145-W147 HydrophobicContact CG2-CE3 3.98Å; T145-W147 HydrophobicContact CG2-CZ3 3.93Å; W147-C393 HydrophobicContact CD2-CB 4.01Å; W147-C393 VanDerWaalsContact CE2-CB 3.48Å; W147-C393 HydrophobicContact CG-CB 4.15Å; W147-C393 HydrophobicContact CZ2-CB 3.94Å; W147-C393 PolarHBondContact N-O 3.42Å; W147-C393 VanDerWaalsContact NE1-CB 3.3Å; W147-C393 PolarHBondContact O-N 2.77Å; W147-C393 VanDerWaalsContact O-O 3.06Å; W147-G394 VanDerWaalsContact CZ3-CA 3.48Å; W147-T395 HydrophobicContact CH2-CG2 4.03Å; W147-T395 HydrophobicContact CZ3-CG2 4Å
148	T	93.1	Very high	87.1	Confident	51 Å²	51	51.7 Å²	51.7	31%	0.313	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	161.7	176.9	62.7	0	0	0	0	112.9	E390 V391 Y392	T148-E390 WeakPolarHBondContact CB-OE2 3.3Å; T148-E390 HydrophobicContact CG2-CB 4.44Å; T148-E390 PolarHBondContact OG1-OE2 3.43Å; T148-V391 CarbonylContact C-O 3.54Å; T148-V391 VanDerWaalsContact CA-O 3.22Å; T148-V391 WeakPolarHBondContact CA-O 3.23Å; T148-Y392 HydrophobicContact CG2-CD1 4.05Å; T148-Y392 HydrophobicContact CG2-CD2 4.16Å; T148-Y392 HydrophobicContact CG2-CE1 3.93Å; T148-Y392 HydrophobicContact CG2-CE2 4.07Å; T148-Y392 HydrophobicContact CG2-CG 4.18Å
149	R	93.8	Very high	88.9	Confident	55 Å²	55	49.9 Å²	49.9	21%	0.208	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	139.1	173.2	-58.7	-171.3	-67.3	103.3	-8.8	111.8	N151 E192 V391 C393	R149-N151 VanDerWaalsContact NH1-CG 3.31Å; R149-N151 PolarHBondContact NH1-ND2 3.17Å; R149-N151 PolarHBondContact NH1-OD1 3Å; R149-E192 IonicContact CZ-OE1 2.65Å; R149-E192 VanDerWaalsContact CZ-OE1 3.32Å; R149-E192 IonicContact NE-OE1 3.99Å; R149-E192 PolarHBondContact NE-OE1 2.82Å; R149-E192 IonicContact NH2-OE1 3.24Å; R149-E192 PolarHBondContact NH2-OE1 2.92Å; R149-E192 IonicContact NH2-OE2 3.32Å; R149-V391 HydrophobicContact CB-CB 4.32Å; R149-V391 PolarHBondContact N-O 2.91Å; R149-V391 PolarHBondContact O-N 2.82Å; R149-C393 PolarHBondContact NE-SG 2.81Å; R149-C393 VanDerWaalsContact NE-SG 3.36Å
150	K	94.2	Very high	90.3	Very high	170 Å²	170	50 Å²	50	74%	0.739	25%	0.247	S	C	*	.	S	Bend	trans	-80.6	-15.8	-173.4	-70.7	178.2	178.4	179.9	0	115.5	I152 E390	K150-I152 PolarHBondContact O-N 3.23Å; K150-E390 WeakPolarHBondContact CE-OE1 3.43Å; K150-E390 HydrophobicContact CG-CG 4.37Å; K150-E390 WeakPolarHBondContact CG-OE1 3.22Å
151	N	94.3	Very high	91.8	Very high	65 Å²	65	55.4 Å²	55.4	35%	0.348	28%	0.276	S	S	.	.			trans	-82.7	49.8	-177.3	58.8	-37.9	0	0	0	113.3	R149 A153 E154 F155	R149-N151 VanDerWaalsContact NH1-CG 3.31Å; R149-N151 PolarHBondContact NH1-ND2 3.17Å; R149-N151 PolarHBondContact NH1-OD1 3Å; N151-A153 PolarHBondContact O-N 3.26Å; N151-E154 HydrophobicContact CB-CB 4.26Å; N151-E154 PolarHBondContact ND2-OE2 3.29Å; N151-E154 PolarHBondContact O-N 3.44Å; N151-F155 PolarHBondContact O-N 2.97Å; N151-F155 VanDerWaalsContact O-N 3.12Å
152	I	96.6	Very high	92.6	Very high	27 Å²	27	59.9 Å²	59.9	14%	0.138	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-39.5	-177.8	-173.7	169.4	0	0	0	113.9	K150 E154 F155 K156 A194 C387 H388 V391	K150-I152 PolarHBondContact O-N 3.23Å; I152-E154 VanDerWaalsContact C-N 3.33Å; I152-E154 PolarHBondContact O-N 3.37Å; I152-F155 PolarHBondContact O-N 2.94Å; I152-K156 HydrophobicContact CG1-CD 4.32Å; I152-K156 HydrophobicContact CG1-CG 4.49Å; I152-K156 WeakPolarHBondContact O-CG 3.42Å; I152-K156 PolarHBondContact O-N 3.46Å; I152-A194 HydrophobicContact CD1-CB 3.96Å; I152-A194 HydrophobicContact CG1-CB 3.91Å; I152-C387 WeakPolarHBondContact CD1-O 3.43Å; I152-H388 WeakPolarHBondContact CD1-O 3.37Å; I152-V391 HydrophobicContact CB-CG2 4Å; I152-V391 HydrophobicContact CG1-CG2 4.27Å
153	A	96.8	Very high	93.3	Very high	79 Å²	79	61.3 Å²	61.3	65%	0.653	31%	0.309	S	S	*	.	H	α-helix	trans	-67.3	-33.8	179.3	0	0	0	0	0	112.9	N151 R157	N151-A153 PolarHBondContact O-N 3.26Å; A153-R157 PolarHBondContact O-N 3.43Å
154	E	97	Very high	93.9	Very high	96 Å²	96	68.1 Å²	68.1	45%	0.449	34%	0.338	S	S	.	.	H	α-helix	trans	-71.2	-47.9	176.1	177	171.6	-126.7	0	0	111.1	N151 I152 K156 R157 E158	N151-E154 HydrophobicContact CB-CB 4.26Å; N151-E154 PolarHBondContact ND2-OE2 3.29Å; N151-E154 PolarHBondContact O-N 3.44Å; I152-E154 VanDerWaalsContact C-N 3.33Å; I152-E154 PolarHBondContact O-N 3.37Å; E154-K156 PolarHBondContact O-N 3.27Å; E154-R157 PolarHBondContact O-N 2.93Å; E154-R157 IonicContact OE1-NH2 3.46Å; E154-E158 PolarHBondContact O-N 2.93Å
155	F	97.3	Very high	94.1	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-56.3	-49.2	176.2	171.9	-107.1	0	0	0	112	N151 I152 R157 E158 I159 E192 A194 V391 R423	N151-F155 PolarHBondContact O-N 2.97Å; N151-F155 VanDerWaalsContact O-N 3.12Å; I152-F155 PolarHBondContact O-N 2.94Å; F155-R157 VanDerWaalsContact C-N 3.31Å; F155-R157 PolarHBondContact O-N 3.26Å; F155-E158 WeakPolarHBondContact O-CB 3.35Å; F155-E158 PolarHBondContact O-N 3.03Å; F155-I159 HydrophobicContact CD2-CG1 4.25Å; F155-I159 HydrophobicContact CE1-CG1 4.26Å; F155-I159 HydrophobicContact CE2-CD1 3.9Å; F155-I159 HydrophobicContact CE2-CG1 3.86Å; F155-I159 HydrophobicContact CZ-CD1 4.17Å; F155-I159 HydrophobicContact CZ-CG1 3.86Å; F155-I159 WeakPolarHBondContact O-CG1 3.49Å; F155-I159 PolarHBondContact O-N 3.19Å; F155-E192 HydrophobicContact CE2-CB 3.76Å; F155-E192 HydrophobicContact CZ-CB 3.98Å; F155-A194 HydrophobicContact CD1-CB 3.77Å; F155-A194 HydrophobicContact CE1-CB 3.75Å; F155-V391 HydrophobicContact CB-CG2 3.73Å; F155-V391 HydrophobicContact CD1-CB 4.49Å; F155-V391 HydrophobicContact CD1-CG1 3.81Å; F155-V391 HydrophobicContact CD1-CG2 3.85Å; F155-V391 HydrophobicContact CD2-CG1 4.26Å; F155-V391 HydrophobicContact CE1-CG1 3.95Å; F155-V391 HydrophobicContact CE2-CG1 4.37Å; F155-V391 HydrophobicContact CG-CG1 3.97Å; F155-V391 HydrophobicContact CG-CG2 3.9Å; F155-V391 HydrophobicContact CZ-CG1 4.22Å; F155-R423 HydrophobicContact CE2-CB 4.36Å
156	K	97.3	Very high	94.4	Very high	31 Å²	31	72.6 Å²	72.6	14%	0.135	36%	0.358	C	S	.	.	H	α-helix	trans	-59	-41	177.9	-72.4	178.9	179.2	-178.7	0	112.9	I152 E154 L160 T195 D196 Y421	I152-K156 HydrophobicContact CG1-CD 4.32Å; I152-K156 HydrophobicContact CG1-CG 4.49Å; I152-K156 WeakPolarHBondContact O-CG 3.42Å; I152-K156 PolarHBondContact O-N 3.46Å; E154-K156 PolarHBondContact O-N 3.27Å; K156-L160 VanDerWaalsContact O-CG 3.28Å; K156-L160 WeakPolarHBondContact O-CG 3.24Å; K156-L160 PolarHBondContact O-N 3.23Å; K156-T195 WeakPolarHBondContact CE-O 3.35Å; K156-T195 PolarHBondContact NZ-O 3.39Å; K156-D196 VanDerWaalsContact NZ-CA 3.34Å; K156-D196 IonicContact NZ-OD1 3.46Å; K156-D196 PolarHBondContact NZ-OD1 3.5Å; K156-Y421 HydrophobicContact CB-CD1 4.07Å; K156-Y421 HydrophobicContact CB-CE1 4.09Å; K156-Y421 HydrophobicContact CB-CG 4.39Å; K156-Y421 HydrophobicContact CD-CD2 4.16Å; K156-Y421 HydrophobicContact CD-CE2 3.99Å; K156-Y421 HydrophobicContact CG-CD1 4.02Å; K156-Y421 HydrophobicContact CG-CD2 3.85Å; K156-Y421 HydrophobicContact CG-CE1 4.21Å; K156-Y421 HydrophobicContact CG-CE2 4.07Å; K156-Y421 HydrophobicContact CG-CG 3.84Å
157	R	97.2	Very high	94.8	Very high	140 Å²	140	71.2 Å²	71.2	53%	0.528	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-46.6	175.8	178.1	-174.8	62.6	-174.2	-2.9	111	A153 E154 F155 I159 L160 D161	A153-R157 PolarHBondContact O-N 3.43Å; E154-R157 PolarHBondContact O-N 2.93Å; E154-R157 IonicContact OE1-NH2 3.46Å; F155-R157 VanDerWaalsContact C-N 3.31Å; F155-R157 PolarHBondContact O-N 3.26Å; R157-I159 VanDerWaalsContact C-N 3.35Å; R157-I159 PolarHBondContact O-N 3.36Å; R157-L160 PolarHBondContact O-N 3.3Å; R157-L160 VanDerWaalsContact O-N 3.13Å; R157-D161 VanDerWaalsContact CG-OD2 3.25Å; R157-D161 WeakPolarHBondContact CG-OD2 3.35Å; R157-D161 WeakPolarHBondContact O-CB 3.29Å; R157-D161 VanDerWaalsContact O-CG 3.29Å; R157-D161 PolarHBondContact O-N 2.93Å
158	E	96.1	Very high	95.1	Very high	74 Å²	74	68.1 Å²	68.1	35%	0.346	34%	0.34	S	S	.	.	H	α-helix	trans	-56.2	-46.4	177.1	-171.8	-173.2	-174.7	0	0	111.8	E154 F155 L160 D161 V162 R423	E154-E158 PolarHBondContact O-N 2.93Å; F155-E158 WeakPolarHBondContact O-CB 3.35Å; F155-E158 PolarHBondContact O-N 3.03Å; E158-L160 PolarHBondContact O-N 3.21Å; E158-D161 PolarHBondContact O-N 3.42Å; E158-V162 WeakPolarHBondContact O-CB 3.23Å; E158-V162 WeakPolarHBondContact O-CG2 3.5Å; E158-V162 PolarHBondContact O-N 3Å; E158-R423 IonicContact OE1-CZ 3.13Å; E158-R423 IonicContact OE1-NH1 2.71Å; E158-R423 PolarHBondContact OE1-NH1 2.9Å; E158-R423 IonicContact OE1-NH2 3.07Å; E158-R423 IonicContact OE2-CZ 2.62Å; E158-R423 IonicContact OE2-NH1 3.54Å; E158-R423 PolarHBondContact OE2-NH1 3.38Å; E158-R423 IonicContact OE2-NH2 3.89Å; E158-R423 PolarHBondContact OE2-NH2 3.48Å
159	I	96.8	Very high	95.2	Very high	1 Å²	1	70.5 Å²	70.5	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-62.2	-42.7	175.2	-61.3	-55.1	0	0	0	111.6	F155 R157 Q163 K164 C166 C167 Y421 R423	F155-I159 HydrophobicContact CD2-CG1 4.25Å; F155-I159 HydrophobicContact CE1-CG1 4.26Å; F155-I159 HydrophobicContact CE2-CD1 3.9Å; F155-I159 HydrophobicContact CE2-CG1 3.86Å; F155-I159 HydrophobicContact CZ-CD1 4.17Å; F155-I159 HydrophobicContact CZ-CG1 3.86Å; F155-I159 WeakPolarHBondContact O-CG1 3.49Å; F155-I159 PolarHBondContact O-N 3.19Å; R157-I159 VanDerWaalsContact C-N 3.35Å; R157-I159 PolarHBondContact O-N 3.36Å; I159-Q163 CarbonylContact O-C 2.93Å; I159-Q163 WeakPolarHBondContact O-CA 3.45Å; I159-Q163 PolarHBondContact O-N 3.48Å; I159-Q163 VanDerWaalsContact O-O 3.14Å; I159-K164 PolarHBondContact O-N 2.87Å; I159-K164 VanDerWaalsContact O-N 3.14Å; I159-C166 HydrophobicContact CG2-CB 4.29Å; I159-C167 HydrophobicContact CG2-CB 4.32Å; I159-Y421 HydrophobicContact CB-CD1 4.27Å; I159-Y421 HydrophobicContact CG2-CD1 4.18Å; I159-R423 HydrophobicContact CD1-CB 3.91Å
160	L	95.9	Very high	95.3	Very high	75 Å²	75	67.9 Å²	67.9	39%	0.393	34%	0.336	S	S	.	.	H	α-helix	trans	-69.1	-34.4	179.4	-71.4	171.1	0	0	0	113.9	K156 R157 E158 C167 Y421	K156-L160 VanDerWaalsContact O-CG 3.28Å; K156-L160 WeakPolarHBondContact O-CG 3.24Å; K156-L160 PolarHBondContact O-N 3.23Å; R157-L160 PolarHBondContact O-N 3.3Å; R157-L160 VanDerWaalsContact O-N 3.13Å; E158-L160 PolarHBondContact O-N 3.21Å; L160-C167 HydrophobicContact CD2-CB 4.3Å; L160-Y421 HydrophobicContact CD1-CE1 3.91Å; L160-Y421 HydrophobicContact CD2-CE1 3.92Å; L160-Y421 HydrophobicContact CG-CD1 4.41Å; L160-Y421 HydrophobicContact CG-CE1 3.75Å
161	D	95.1	Very high	95.3	Very high	124 Å²	124	61 Å²	61	66%	0.663	31%	0.309	S	S	*	.	H	α-helix	trans	-82.2	-35.7	-177.1	-70.6	-15.8	0	0	0	112.2	R157 E158	R157-D161 VanDerWaalsContact CG-OD2 3.25Å; R157-D161 WeakPolarHBondContact CG-OD2 3.35Å; R157-D161 WeakPolarHBondContact O-CB 3.29Å; R157-D161 VanDerWaalsContact O-CG 3.29Å; R157-D161 PolarHBondContact O-N 2.93Å; E158-D161 PolarHBondContact O-N 3.42Å
162	V	92.6	Very high	95.2	Very high	97 Å²	97	59.7 Å²	59.7	59%	0.588	31%	0.305	S	S	*	.	H	α-helix	trans	-109.9	-37.8	-171.3	-169.9	0	0	0	0	113.5	E158	E158-V162 WeakPolarHBondContact O-CB 3.23Å; E158-V162 WeakPolarHBondContact O-CG2 3.5Å; E158-V162 PolarHBondContact O-N 3Å
163	Q	89.9	Confident	94.9	Very high	40 Å²	40	60.8 Å²	60.8	19%	0.187	31%	0.311	C	S	.	.			trans	-137.6	56	-168.5	-63.6	-173.4	-16.4	0	0	111.5	I159 E165 C166	I159-Q163 CarbonylContact O-C 2.93Å; I159-Q163 WeakPolarHBondContact O-CA 3.45Å; I159-Q163 PolarHBondContact O-N 3.48Å; I159-Q163 VanDerWaalsContact O-O 3.14Å; Q163-E165 PolarHBondContact O-N 2.92Å; Q163-E165 VanDerWaalsContact O-N 3.12Å; Q163-C166 HydrophobicContact CB-CB 4.31Å; Q163-C166 WeakPolarHBondContact O-CA 3.42Å; Q163-C166 WeakPolarHBondContact O-CB 3.35Å; Q163-C166 PolarHBondContact O-N 3.2Å
164	K	92.5	Very high	94.6	Very high	150 Å²	150	57 Å²	57	65%	0.652	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-58.9	-29.8	-170.7	-174.3	176.8	177.8	-179.8	0	113.3	I159 C166 C167	I159-K164 PolarHBondContact O-N 2.87Å; I159-K164 VanDerWaalsContact O-N 3.14Å; K164-C166 PolarHBondContact O-N 3.45Å; K164-C167 WeakPolarHBondContact O-CB 3.32Å; K164-C167 PolarHBondContact O-N 3.37Å
165	E	92.5	Very high	94.4	Very high	110 Å²	110	53.1 Å²	53.1	51%	0.514	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-70.6	-1.6	173.4	73.1	-72.1	169.3	0	0	114.6	Q163 K263	Q163-E165 PolarHBondContact O-N 2.92Å; Q163-E165 VanDerWaalsContact O-N 3.12Å; E165-K263 HydrophobicContact CG-CD 4.47Å; E165-K263 PolarHBondContact O-NZ 2.63Å
166	C	95	Very high	94.3	Very high	4 Å²	4	53.1 Å²	53.1	3%	0.027	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-103.7	14.2	167.6	-55.9	0	0	0	0	112.2	I159 Q163 K164 K263 Y422	I159-C166 HydrophobicContact CG2-CB 4.29Å; Q163-C166 HydrophobicContact CB-CB 4.31Å; Q163-C166 WeakPolarHBondContact O-CA 3.42Å; Q163-C166 WeakPolarHBondContact O-CB 3.35Å; Q163-C166 PolarHBondContact O-N 3.2Å; K164-C166 PolarHBondContact O-N 3.45Å; C166-K263 PolarHBondContact SG-NZ 2.99Å; C166-Y422 HydrophobicContact CB-CD1 4.19Å; C166-Y422 HydrophobicContact CB-CE1 3.99Å; C166-Y422 HydrophobicContact CB-CE2 4.46Å; C166-Y422 HydrophobicContact CB-CG 4.49Å; C166-Y422 WeakPolarHBondContact CB-O 3.36Å; C166-Y422 WeakPolarHBondContact O-CD1 3.5Å; C166-Y422 PolarHBondContact O-N 3.05Å
167	C	96.6	Very high	94.3	Very high	19 Å²	19	52.4 Å²	52.4	13%	0.128	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	113.8	161.9	-175.9	0	0	0	0	109.5	I159 L160 K164 L420 Y421	I159-C167 HydrophobicContact CG2-CB 4.32Å; L160-C167 HydrophobicContact CD2-CB 4.3Å; K164-C167 WeakPolarHBondContact O-CB 3.32Å; K164-C167 PolarHBondContact O-N 3.37Å; C167-L420 CarbonylContact C-O 3.51Å; C167-L420 VanDerWaalsContact CA-O 3.31Å; C167-L420 WeakPolarHBondContact CA-O 3.37Å; C167-Y421 HydrophobicContact CB-CD1 4.2Å; C167-Y421 HydrophobicContact CB-CE1 4.37Å; C167-Y421 VanDerWaalsContact SG-CE1 3.58Å
168	I	95.6	Very high	94.3	Very high	23 Å²	23	45.7 Å²	45.7	12%	0.118	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.1	-177.1	65.4	172.3	0	0	0	111.7	A176 V218 L420 Y422	I168-A176 HydrophobicContact CD1-CB 3.86Å; I168-V218 HydrophobicContact CD1-CG1 4.13Å; I168-L420 HydrophobicContact CD1-CD2 4.09Å; I168-L420 HydrophobicContact CG1-CB 4.06Å; I168-L420 HydrophobicContact CG1-CD2 4.05Å; I168-L420 HydrophobicContact CG1-CG 4.41Å; I168-L420 PolarHBondContact N-O 3.22Å; I168-L420 PolarHBondContact O-N 3.33Å; I168-Y422 HydrophobicContact CD1-CE1 4.39Å; I168-Y422 HydrophobicContact CG1-CE1 4.44Å; I168-Y422 HydrophobicContact CG2-CE1 4.34Å
169	K	96.6	Very high	94.3	Very high	100 Å²	100	44.6 Å²	44.6	44%	0.435	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.2	173.1	-173.7	-172.1	175.5	-165.2	0	109.4	S417 W419	K169-S417 VanDerWaalsContact CE-OG 3.3Å; K169-S417 WeakPolarHBondContact CE-OG 3.45Å; K169-W419 HydrophobicContact CB-CD2 4.13Å; K169-W419 HydrophobicContact CB-CE3 3.93Å; K169-W419 HydrophobicContact CB-CH2 4.03Å; K169-W419 HydrophobicContact CB-CZ2 4.22Å; K169-W419 HydrophobicContact CB-CZ3 3.89Å; K169-W419 HydrophobicContact CD-CZ2 4.42Å
170	I	95.8	Very high	94.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.8	170.4	-47.6	-179.5	0	0	0	107.4	A174 A176 L200 F408 N410 S417 K418 L420	I170-A174 HydrophobicContact CG2-CB 4.08Å; I170-A176 HydrophobicContact CD1-CB 3.71Å; I170-A176 HydrophobicContact CG1-CB 3.87Å; I170-L200 HydrophobicContact CD1-CD1 4.19Å; I170-L200 HydrophobicContact CD1-CD2 4.09Å; I170-F408 HydrophobicContact CD1-CB 3.6Å; I170-N410 HydrophobicContact CB-CB 4.37Å; I170-N410 HydrophobicContact CG2-CB 3.61Å; I170-N410 PolarHBondContact O-ND2 3.4Å; I170-S417 CarbonylContact O-C 3.55Å; I170-S417 WeakPolarHBondContact O-CA 2.86Å; I170-S417 WeakPolarHBondContact O-CB 3.21Å; I170-K418 PolarHBondContact N-O 2.9Å; I170-K418 PolarHBondContact O-N 3.48Å; I170-L420 HydrophobicContact CD1-CB 4.18Å; I170-L420 HydrophobicContact CD1-CD2 4.08Å; I170-L420 HydrophobicContact CG1-CB 4.47Å
171	S	94.9	Very high	94.3	Very high	26 Å²	26	42.5 Å²	42.5	18%	0.182	22%	0.219	C	C	.	.			trans	-61.5	165.5	179.3	-61.2	0	0	0	0	112.3	A174 E222 N410	S171-A174 WeakPolarHBondContact O-CB 3.42Å; S171-A174 PolarHBondContact O-N 2.81Å; S171-E222 WeakPolarHBondContact CB-OE1 2.99Å; S171-E222 PolarHBondContact OG-OE1 2.85Å; S171-N410 PolarHBondContact O-ND2 2.92Å
172	S	91.6	Very high	94.3	Very high	37 Å²	37	37.1 Å²	37.1	26%	0.259	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	148.6	166	26.5	0	0	0	0	109.7	A174 S413 L414	S172-A174 PolarHBondContact O-N 2.87Å; S172-S413 CarbonylContact C-O 3.57Å; S172-S413 VanDerWaalsContact CA-O 3.3Å; S172-S413 WeakPolarHBondContact CA-O 3.49Å; S172-S413 WeakPolarHBondContact CB-O 3.14Å; S172-L414 VanDerWaalsContact CB-O 3.24Å; S172-L414 WeakPolarHBondContact CB-O 3.35Å
173	L	90.8	Very high	94.3	Very high	50 Å²	50	35.8 Å²	35.8	26%	0.262	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	8.3	-178.4	-57.6	179.1	0	0	0	116.4	S223 N410 S411 S413 L414	L173-S223 VanDerWaalsContact CB-OG 3.22Å; L173-S223 WeakPolarHBondContact CB-OG 3.28Å; L173-N410 PolarHBondContact N-O 2.79Å; L173-S411 WeakPolarHBondContact CD2-O 3.28Å; L173-S413 PolarHBondContact N-O 3.24Å; L173-L414 HydrophobicContact CD2-CD2 4.19Å
174	A	90.6	Very high	94.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.			trans	-99.9	164.7	-175.8	0	0	0	0	0	113.5	I170 S171 S172 S221 E222 N410 S411	I170-A174 HydrophobicContact CG2-CB 4.08Å; S171-A174 WeakPolarHBondContact O-CB 3.42Å; S171-A174 PolarHBondContact O-N 2.81Å; S172-A174 PolarHBondContact O-N 2.87Å; A174-S221 CarbonylContact C-O 3.48Å; A174-S221 VanDerWaalsContact CA-O 3.23Å; A174-S221 WeakPolarHBondContact CA-O 3.23Å; A174-S221 WeakPolarHBondContact CB-O 3.31Å; A174-E222 HydrophobicContact CB-CB 4.48Å; A174-E222 HydrophobicContact CB-CG 4.05Å; A174-N410 CarbonylContact O-C 3.47Å; A174-N410 VanDerWaalsContact O-C 3.25Å; A174-N410 VanDerWaalsContact O-CA 3.24Å; A174-N410 WeakPolarHBondContact O-CA 3.33Å; A174-N410 VanDerWaalsContact O-CB 3.29Å; A174-N410 WeakPolarHBondContact O-CB 3.43Å; A174-N410 PolarHBondContact O-N 3.21Å; A174-S411 PolarHBondContact O-N 2.84Å
175	T	92.1	Very high	94.2	Very high	14 Å²	14	37.9 Å²	37.9	9%	0.086	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.9	170.7	-58.2	0	0	0	0	109.2	S221 I277 F408 D409	T175-S221 PolarHBondContact N-O 3.44Å; T175-S221 PolarHBondContact O-N 3.01Å; T175-I277 HydrophobicContact CG2-CD1 4.17Å; T175-F408 WeakPolarHBondContact CA-O 3.26Å; T175-D409 PolarHBondContact OG1-OD1 2.75Å
176	A	95.4	Very high	94.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.2	167.2	0	0	0	0	0	110.1	I168 I170 N219 I220 F408	I168-A176 HydrophobicContact CD1-CB 3.86Å; I170-A176 HydrophobicContact CD1-CB 3.71Å; I170-A176 HydrophobicContact CG1-CB 3.87Å; A176-N219 WeakPolarHBondContact CA-O 3.44Å; A176-I220 HydrophobicContact CB-CG1 4.12Å; A176-F408 HydrophobicContact CB-CB 4.25Å; A176-F408 PolarHBondContact N-O 2.75Å; A176-F408 PolarHBondContact O-N 3.14Å
177	T	96.2	Very high	93.9	Very high	16 Å²	16	41 Å²	41	10%	0.098	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.9	176.1	-55.7	0	0	0	0	108.8	R179 V218 N219 V405 F406	T177-R179 HydrophobicContact CG2-CG 4.25Å; T177-V218 WeakPolarHBondContact O-CA 3.48Å; T177-N219 PolarHBondContact N-O 3.47Å; T177-N219 PolarHBondContact O-N 3.34Å; T177-V405 HydrophobicContact CG2-CG1 3.45Å; T177-V405 VanDerWaalsContact CG2-CG1 3.45Å; T177-F406 CarbonylContact C-O 3.52Å; T177-F406 VanDerWaalsContact CA-O 3.32Å; T177-F406 WeakPolarHBondContact CA-O 3.38Å
178	V	96.7	Very high	93.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.2	172.4	-174	0	0	0	0	108	V180 I216 S217 V218 F406 F408 Y422 I424	V178-V180 HydrophobicContact CG1-CG2 3.89Å; V178-I216 HydrophobicContact CG1-CG2 3.97Å; V178-S217 WeakPolarHBondContact CA-O 3.17Å; V178-V218 HydrophobicContact CG1-CG2 4.19Å; V178-V218 HydrophobicContact CG2-CG1 4.33Å; V178-V218 HydrophobicContact CG2-CG2 4.24Å; V178-F406 HydrophobicContact CB-CB 4.2Å; V178-F406 PolarHBondContact N-O 3.37Å; V178-F406 PolarHBondContact O-N 2.94Å; V178-F408 HydrophobicContact CG2-CD2 4.28Å; V178-F408 HydrophobicContact CG2-CE2 3.99Å; V178-Y422 HydrophobicContact CG1-CE2 4.27Å; V178-Y422 HydrophobicContact CG2-CE2 4.3Å; V178-I424 HydrophobicContact CB-CD1 4.43Å; V178-I424 HydrophobicContact CG1-CD1 4.01Å
179	R	97.2	Very high	93.7	Very high	50 Å²	50	39.7 Å²	39.7	19%	0.189	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.7	179.2	-67.5	178.3	61.4	90.8	-3.1	109.1	T177 E207 I216 S217 V403 Y404 V405	T177-R179 HydrophobicContact CG2-CG 4.25Å; R179-E207 IonicContact CZ-OE1 2.7Å; R179-E207 IonicContact CZ-OE2 3.68Å; R179-E207 IonicContact NH1-OE1 2.85Å; R179-E207 PolarHBondContact NH1-OE1 3.44Å; R179-E207 IonicContact NH1-OE2 3.39Å; R179-E207 PolarHBondContact NH1-OE2 2.73Å; R179-E207 VanDerWaalsContact NH2-CD 3.35Å; R179-E207 IonicContact NH2-OE1 2.68Å; R179-E207 PolarHBondContact NH2-OE1 2.91Å; R179-E207 IonicContact NH2-OE2 3.97Å; R179-E207 PolarHBondContact NH2-OE2 3.45Å; R179-I216 WeakPolarHBondContact O-CA 3.36Å; R179-I216 WeakPolarHBondContact O-CG2 3.29Å; R179-S217 PolarHBondContact N-O 3.37Å; R179-S217 PolarHBondContact O-N 2.97Å; R179-S217 VanDerWaalsContact O-N 3.14Å; R179-V403 HydrophobicContact CB-CG1 3.8Å; R179-V403 HydrophobicContact CG-CG1 4.41Å; R179-Y404 CarbonylContact C-O 3.54Å; R179-Y404 WeakPolarHBondContact CA-O 3.4Å; R179-V405 HydrophobicContact CG-CG2 4.45Å
180	V	96.9	Very high	93.7	Very high	13 Å²	13	35.7 Å²	35.7	8%	0.079	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	104.4	-175.2	-174	0	0	0	0	110	V178 I189 I216 Y404 F406 I424	V178-V180 HydrophobicContact CG1-CG2 3.89Å; V180-I189 HydrophobicContact CB-CD1 4.02Å; V180-I189 HydrophobicContact CG1-CD1 3.78Å; V180-I216 HydrophobicContact CG1-CD1 4.24Å; V180-I216 HydrophobicContact CG1-CG1 4.22Å; V180-I216 HydrophobicContact CG2-CG1 4.38Å; V180-I216 HydrophobicContact CG2-CG2 4.26Å; V180-Y404 PolarHBondContact N-O 3.06Å; V180-Y404 PolarHBondContact O-N 3.12Å; V180-F406 HydrophobicContact CB-CE2 4.07Å; V180-F406 HydrophobicContact CG2-CD2 3.98Å; V180-F406 HydrophobicContact CG2-CE2 3.81Å; V180-I424 HydrophobicContact CG1-CG2 4.2Å; V180-I424 HydrophobicContact CG2-CD1 4.04Å; V180-I424 HydrophobicContact CG2-CG2 4.08Å
181	P	96.6	Very high	93.9	Very high	19 Å²	19	35.9 Å²	35.9	12%	0.123	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	146.6	173.7	-24.6	34.2	0	0	0	112.8	H183 P212 P213	P181-H183 PolarHBondContact O-N 2.8Å; P181-P212 HydrophobicContact CB-CB 4.31Å; P181-P213 WeakPolarHBondContact CB-O 3.21Å; P181-P213 HydrophobicContact CG-CG 4.26Å; P181-P213 WeakPolarHBondContact CG-O 3.24Å
182	T	94.3	Very high	94	Very high	12 Å²	12	35.8 Å²	35.8	7%	0.074	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-67.2	122.5	168.3	51.1	0	0	0	0	110.2	F206 Y398 V401 G402 Y404	T182-F206 HydrophobicContact CG2-CE2 3.67Å; T182-F206 HydrophobicContact CG2-CZ 3.96Å; T182-Y398 HydrophobicContact CG2-CD1 4.45Å; T182-Y398 HydrophobicContact CG2-CD2 4.07Å; T182-Y398 HydrophobicContact CG2-CE1 4.48Å; T182-Y398 HydrophobicContact CG2-CE2 4.12Å; T182-Y398 HydrophobicContact CG2-CG 4.23Å; T182-V401 WeakPolarHBondContact OG1-CA 3.4Å; T182-G402 PolarHBondContact N-O 2.7Å; T182-G402 PolarHBondContact OG1-N 3.22Å; T182-G402 PolarHBondContact OG1-O 2.68Å; T182-Y404 HydrophobicContact CG2-CD2 4.36Å; T182-Y404 HydrophobicContact CG2-CE2 4.01Å
183	H	92.5	Very high	94.3	Very high	68 Å²	68	34 Å²	34	32%	0.315	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-78.2	135.2	178.5	-174.4	-104.4	0	0	0	111	P181 N185 G186 Y398 Y426	P181-H183 PolarHBondContact O-N 2.8Å; H183-N185 PolarHBondContact ND1-N 2.9Å; H183-N185 PolarHBondContact O-N 3.24Å; H183-N185 VanDerWaalsContact O-N 3.08Å; H183-G186 PolarHBondContact O-N 2.9Å; H183-Y398 PolarHBondContact N-OH 3.23Å; H183-Y426 HydrophobicContact CB-CD1 3.7Å; H183-Y426 HydrophobicContact CB-CD2 4.43Å; H183-Y426 HydrophobicContact CB-CE1 3.83Å; H183-Y426 HydrophobicContact CB-CG 4.04Å; H183-Y426 AromaticContact CE1-CZ 3.75Å; H183-Y426 PolarHBondContact CE1-OH 2.97Å; H183-Y426 AromaticContact CG-CE1 3.61Å; H183-Y426 AromaticContact CG-CZ 3.75Å; H183-Y426 AromaticContact ND1-CE1 3.77Å; H183-Y426 AromaticContact ND1-CE2 3.63Å; H183-Y426 AromaticContact ND1-CZ 3.39Å
184	P	89.8	Confident	94.7	Very high	122 Å²	122	31.7 Å²	31.7	79%	0.792	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.5	-174.9	-28.5	35.8	0	0	0	115.6
185	N	89.5	Confident	95.1	Very high	112 Å²	112	31.7 Å²	31.7	60%	0.599	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	1	176.7	-59.2	-21.6	0	0	0	113.1	H183 H428	H183-N185 PolarHBondContact ND1-N 2.9Å; H183-N185 PolarHBondContact O-N 3.24Å; H183-N185 VanDerWaalsContact O-N 3.08Å; N185-H428 PolarHBondContact O-CE1 3.28Å; N185-H428 PolarHBondContact O-ND1 2.79Å
186	G	90.8	Very high	95.3	Very high	12 Å²	12	33.3 Å²	33.3	12%	0.124	17%	0.173	C	C	.	.			trans	-88.3	151.7	-178.9	0	0	0	0	0	112.5	H183 Y398 T427	H183-G186 PolarHBondContact O-N 2.9Å; G186-Y398 VanDerWaalsContact O-CD2 3.28Å; G186-Y398 WeakPolarHBondContact O-CD2 3.5Å; G186-Y398 WeakPolarHBondContact O-CE2 3.22Å; G186-T427 CarbonylContact C-O 3.45Å; G186-T427 WeakPolarHBondContact CA-O 3.28Å
187	R	90.6	Very high	95.2	Very high	169 Å²	169	38.8 Å²	38.8	64%	0.638	20%	0.202	S	C	*	.	S	Bend	trans	-117	-27.3	174.7	-70.5	-167.2	177.3	134.2	-15.7	114	Y398 T427 H428	R187-Y398 PolarHBondContact O-N 2.83Å; R187-T427 PolarHBondContact N-O 2.84Å; R187-H428 WeakPolarHBondContact CD-OXT 3.25Å; R187-H428 WeakPolarHBondContact CG-OXT 3.34Å; R187-H428 VanDerWaalsContact CZ-OXT 3.3Å; R187-H428 PolarHBondContact NE-OXT 2.72Å; R187-H428 PolarHBondContact NH1-OXT 3.47Å
188	A	93.2	Very high	95.2	Very high	12 Å²	12	42.1 Å²	42.1	10%	0.099	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.9	176.4	0	0	0	0	0	110.6	H396 Y426 T427	A188-H396 CarbonylContact C-O 3.58Å; A188-H396 VanDerWaalsContact CA-O 3.28Å; A188-H396 WeakPolarHBondContact CA-O 3.36Å; A188-H396 WeakPolarHBondContact CB-O 3.3Å; A188-Y426 CarbonylContact O-C 3.47Å; A188-Y426 WeakPolarHBondContact O-CA 3.38Å; A188-Y426 WeakPolarHBondContact O-CB 3.37Å; A188-T427 PolarHBondContact O-N 2.91Å
189	I	96.1	Very high	95.1	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	145.3	167.5	-161.4	158.3	0	0	0	108.9	V180 W191 T395 H396 Y398 Y404 F406 I424	V180-I189 HydrophobicContact CB-CD1 4.02Å; V180-I189 HydrophobicContact CG1-CD1 3.78Å; I189-W191 HydrophobicContact CG2-CE3 4.04Å; I189-W191 HydrophobicContact CG2-CZ3 3.86Å; I189-T395 CarbonylContact O-C 3.56Å; I189-T395 WeakPolarHBondContact O-CA 3.32Å; I189-T395 WeakPolarHBondContact O-CB 3.32Å; I189-T395 PolarHBondContact O-OG1 3.27Å; I189-H396 HydrophobicContact CG2-CB 4.11Å; I189-H396 PolarHBondContact N-O 2.82Å; I189-H396 PolarHBondContact O-N 3.36Å; I189-Y398 HydrophobicContact CB-CE1 4Å; I189-Y404 HydrophobicContact CB-CD2 4.3Å; I189-Y404 HydrophobicContact CB-CE2 4.06Å; I189-Y404 HydrophobicContact CD1-CD1 4.41Å; I189-Y404 HydrophobicContact CD1-CD2 3.6Å; I189-Y404 HydrophobicContact CD1-CE2 4.21Å; I189-Y404 HydrophobicContact CD1-CG 3.71Å; I189-Y404 HydrophobicContact CG2-CD1 3.91Å; I189-Y404 HydrophobicContact CG2-CD2 4.22Å; I189-Y404 HydrophobicContact CG2-CE1 3.56Å; I189-Y404 HydrophobicContact CG2-CE2 3.91Å; I189-Y404 HydrophobicContact CG2-CG 4.21Å; I189-F406 HydrophobicContact CD1-CE2 3.59Å; I189-F406 HydrophobicContact CD1-CZ 3.57Å; I189-F406 HydrophobicContact CG1-CZ 4.06Å; I189-I424 HydrophobicContact CD1-CG2 3.74Å; I189-I424 HydrophobicContact CG1-CG2 3.77Å
190	C	97.2	Very high	95	Very high	16 Å²	16	40.6 Å²	40.6	11%	0.108	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.7	172.5	-67.4	0	0	0	0	108.9	G394 T395 I424 F425	C190-G394 WeakPolarHBondContact CA-O 3.41Å; C190-T395 PolarHBondContact SG-OG1 3.06Å; C190-I424 WeakPolarHBondContact O-CA 3.44Å; C190-F425 HydrophobicContact CB-CD1 4.14Å; C190-F425 HydrophobicContact CB-CD2 3.79Å; C190-F425 HydrophobicContact CB-CE1 3.77Å; C190-F425 HydrophobicContact CB-CE2 3.38Å; C190-F425 HydrophobicContact CB-CG 4.16Å; C190-F425 HydrophobicContact CB-CZ 3.37Å; C190-F425 PolarHBondContact N-O 3.23Å; C190-F425 PolarHBondContact O-N 3.12Å
191	W	98.1	Very high	94.9	Very high	4 Å²	4	40 Å²	40	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.1	177.7	63.9	88.7	0	0	0	112	A144 V146 I189 F202 L204 I380 C393 G394 T395 H396 F406 R423 I424	A144-W191 HydrophobicContact CB-CH2 4.04Å; V146-W191 HydrophobicContact CG2-CZ2 4.28Å; I189-W191 HydrophobicContact CG2-CE3 4.04Å; I189-W191 HydrophobicContact CG2-CZ3 3.86Å; W191-F202 AromaticContact CD1-CZ 3.91Å; W191-F202 AromaticContact NE1-CE1 3.79Å; W191-F202 AromaticContact NE1-CZ 3.63Å; W191-L204 HydrophobicContact CE3-CD2 4.29Å; W191-L204 HydrophobicContact CH2-CD2 3.68Å; W191-L204 HydrophobicContact CZ2-CD2 4.18Å; W191-L204 HydrophobicContact CZ3-CD2 3.73Å; W191-I380 HydrophobicContact CH2-CD1 4.11Å; W191-I380 HydrophobicContact CZ2-CD1 3.57Å; W191-C393 CarbonylContact O-C 3.25Å; W191-C393 VanDerWaalsContact O-CA 3.28Å; W191-C393 WeakPolarHBondContact O-CA 3.36Å; W191-G394 VanDerWaalsContact CE2-CA 3.46Å; W191-G394 VanDerWaalsContact CZ2-CA 3.5Å; W191-G394 PolarHBondContact N-O 2.9Å; W191-G394 PolarHBondContact O-N 2.93Å; W191-T395 VanDerWaalsContact CZ3-C 3.45Å; W191-H396 HydrophobicContact CH2-CB 4.15Å; W191-H396 HydrophobicContact CZ3-CB 3.95Å; W191-F406 HydrophobicContact CB-CD1 4.46Å; W191-F406 HydrophobicContact CB-CE1 3.61Å; W191-F406 HydrophobicContact CB-CZ 4.24Å; W191-F406 AromaticContact CD2-CE1 3.79Å; W191-F406 HydrophobicContact CD2-CE1 3.79Å; W191-F406 AromaticContact CE3-CE1 3.88Å; W191-F406 HydrophobicContact CE3-CE1 3.88Å; W191-F406 HydrophobicContact CE3-CZ 4.18Å; W191-F406 HydrophobicContact CG-CD1 4.49Å; W191-F406 AromaticContact CG-CE1 3.69Å; W191-F406 HydrophobicContact CG-CE1 3.69Å; W191-R423 CarbonylContact C-O 3.52Å; W191-R423 VanDerWaalsContact CA-O 3.3Å; W191-R423 WeakPolarHBondContact CA-O 3.28Å; W191-I424 HydrophobicContact CB-CG1 3.99Å
192	E	98.1	Very high	94.8	Very high	24 Å²	24	39.2 Å²	39.2	11%	0.112	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.9	175.3	-54.2	-175.9	110.9	0	0	108.4	R149 F155 V391 Y392 C393 Y422 R423	R149-E192 IonicContact CZ-OE1 2.65Å; R149-E192 VanDerWaalsContact CZ-OE1 3.32Å; R149-E192 IonicContact NE-OE1 3.99Å; R149-E192 PolarHBondContact NE-OE1 2.82Å; R149-E192 IonicContact NH2-OE1 3.24Å; R149-E192 PolarHBondContact NH2-OE1 2.92Å; R149-E192 IonicContact NH2-OE2 3.32Å; F155-E192 HydrophobicContact CE2-CB 3.76Å; F155-E192 HydrophobicContact CZ-CB 3.98Å; E192-V391 HydrophobicContact CB-CG1 4.25Å; E192-Y392 CarbonylContact C-O 3.6Å; E192-Y392 VanDerWaalsContact CA-O 3.28Å; E192-Y392 WeakPolarHBondContact CA-O 3.15Å; E192-C393 HydrophobicContact CG-CB 4.5Å; E192-Y422 CarbonylContact O-C 3.45Å; E192-Y422 VanDerWaalsContact O-CA 3.26Å; E192-Y422 WeakPolarHBondContact O-CA 3.45Å; E192-R423 PolarHBondContact N-O 3.19Å; E192-R423 PolarHBondContact O-N 2.97Å; E192-R423 IonicContact OE2-CZ 3.37Å; E192-R423 IonicContact OE2-NE 3.61Å; E192-R423 PolarHBondContact OE2-NE 3.41Å; E192-R423 IonicContact OE2-NH2 3.08Å; E192-R423 PolarHBondContact OE2-NH2 3.46Å
193	F	98.4	Very high	94.8	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	154.1	174.5	68.1	-86.6	0	0	0	114.3	F202 R385 C387 Y392 F408 L420 Y421	F193-F202 HydrophobicContact CD1-CD2 4.29Å; F193-F202 HydrophobicContact CD1-CE2 4.22Å; F193-F202 HydrophobicContact CE1-CB 4.36Å; F193-F202 AromaticContact CE1-CD1 3.77Å; F193-F202 HydrophobicContact CE1-CD1 3.77Å; F193-F202 AromaticContact CE1-CD2 3.62Å; F193-F202 HydrophobicContact CE1-CD2 3.62Å; F193-F202 AromaticContact CE1-CE1 3.9Å; F193-F202 HydrophobicContact CE1-CE1 3.9Å; F193-F202 AromaticContact CE1-CE2 3.75Å; F193-F202 HydrophobicContact CE1-CE2 3.75Å; F193-F202 AromaticContact CE1-CG 3.63Å; F193-F202 HydrophobicContact CE1-CG 3.63Å; F193-F202 AromaticContact CE1-CZ 3.88Å; F193-F202 HydrophobicContact CE1-CZ 3.88Å; F193-F202 HydrophobicContact CE2-CB 4.13Å; F193-F202 HydrophobicContact CE2-CD2 4.4Å; F193-F202 HydrophobicContact CE2-CG 4.25Å; F193-F202 HydrophobicContact CZ-CB 3.59Å; F193-F202 AromaticContact CZ-CD1 3.74Å; F193-F202 HydrophobicContact CZ-CD1 3.74Å; F193-F202 AromaticContact CZ-CD2 3.69Å; F193-F202 HydrophobicContact CZ-CD2 3.69Å; F193-F202 HydrophobicContact CZ-CE1 4.35Å; F193-F202 HydrophobicContact CZ-CE2 4.29Å; F193-F202 AromaticContact CZ-CG 3.36Å; F193-F202 HydrophobicContact CZ-CG 3.36Å; F193-R385 HydrophobicContact CE2-CB 4.48Å; F193-R385 HydrophobicContact CZ-CG 4.33Å; F193-C387 HydrophobicContact CD2-CB 3.87Å; F193-C387 HydrophobicContact CE2-CB 3.7Å; F193-Y392 HydrophobicContact CE2-CG 4.32Å; F193-Y392 VanDerWaalsContact CZ-CB 3.44Å; F193-Y392 HydrophobicContact CZ-CD1 4.46Å; F193-Y392 HydrophobicContact CZ-CG 4.01Å; F193-Y392 PolarHBondContact N-O 2.86Å; F193-Y392 PolarHBondContact O-N 2.79Å; F193-F408 HydrophobicContact CB-CE1 4.09Å; F193-F408 HydrophobicContact CD1-CE1 4.09Å; F193-F408 HydrophobicContact CD2-CE1 4.07Å; F193-F408 AromaticContact CG-CE1 3.83Å; F193-F408 HydrophobicContact CG-CE1 3.83Å; F193-L420 HydrophobicContact CB-CD1 3.88Å; F193-L420 HydrophobicContact CD2-CD1 4.23Å; F193-L420 HydrophobicContact CG-CD1 4.44Å; F193-Y421 CarbonylContact C-O 3.59Å; F193-Y421 WeakPolarHBondContact CA-O 2.9Å; F193-Y421 WeakPolarHBondContact CB-O 3.15Å
194	A	98.4	Very high	95	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	160.7	175.8	0	0	0	0	0	111.1	I152 F155 C387 Y421	I152-A194 HydrophobicContact CD1-CB 3.96Å; I152-A194 HydrophobicContact CG1-CB 3.91Å; F155-A194 HydrophobicContact CD1-CB 3.77Å; F155-A194 HydrophobicContact CE1-CB 3.75Å; A194-C387 CarbonylContact C-O 3.47Å; A194-C387 VanDerWaalsContact CA-O 3.23Å; A194-C387 WeakPolarHBondContact CA-O 3.48Å; A194-Y421 PolarHBondContact N-O 3.3Å; A194-Y421 PolarHBondContact O-N 3.07Å
195	T	98.2	Very high	95.1	Very high	1 Å²	1	30 Å²	30	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	169.1	174.3	50	0	0	0	0	111.6	K156 Y198 L200 C387 H388 W419 L420	K156-T195 WeakPolarHBondContact CE-O 3.35Å; K156-T195 PolarHBondContact NZ-O 3.39Å; T195-Y198 WeakPolarHBondContact CB-O 3.41Å; T195-Y198 PolarHBondContact OG1-O 2.85Å; T195-L200 HydrophobicContact CG2-CB 4.02Å; T195-L200 HydrophobicContact CG2-CD2 3.82Å; T195-C387 PolarHBondContact N-O 2.89Å; T195-C387 PolarHBondContact OG1-O 3.31Å; T195-C387 PolarHBondContact OG1-SG 2.86Å; T195-H388 WeakPolarHBondContact O-CA 3.41Å; T195-H388 PolarHBondContact OG1-N 3.2Å; T195-W419 VanDerWaalsContact CA-O 3.22Å; T195-W419 WeakPolarHBondContact CA-O 3.42Å; T195-W419 WeakPolarHBondContact CB-O 3.35Å; T195-W419 WeakPolarHBondContact CG2-O 3.4Å; T195-L420 HydrophobicContact CG2-CD1 4.48Å
196	D	96.5	Very high	95.3	Very high	47 Å²	47	24.7 Å²	24.7	25%	0.251	12%	0.117	S	C	.	.	S	Bend	trans	-73.9	-67.2	-179.3	-81.2	-28.7	0	0	0	116	K156 Y421	K156-D196 VanDerWaalsContact NZ-CA 3.34Å; K156-D196 IonicContact NZ-OD1 3.46Å; K156-D196 PolarHBondContact NZ-OD1 3.5Å; D196-Y421 WeakPolarHBondContact OD1-CE2 3.28Å; D196-Y421 PolarHBondContact OD2-OH 3.47Å
197	N	94.7	Very high	95.3	Very high	115 Å²	115	25.4 Å²	25.4	62%	0.615	12%	0.117	S	C	*	.	S	Bend	trans	-126.1	-6.8	-162.9	-55.7	-58.6	0	0	0	113.8
198	Y	95.4	Very high	95.2	Very high	86 Å²	86	17.4 Å²	17.4	34%	0.337	9%	0.087	S	C	.	.	S	Bend	trans	-146.2	151.2	-169.5	-55.6	-64	0	0	0	111	T195 R416	T195-Y198 WeakPolarHBondContact CB-O 3.41Å; T195-Y198 PolarHBondContact OG1-O 2.85Å; Y198-R416 HydrophobicContact CD2-CB 3.93Å; Y198-R416 HydrophobicContact CD2-CG 4.23Å; Y198-R416 HydrophobicContact CE1-CG 4.46Å; Y198-R416 HydrophobicContact CE2-CB 3.85Å; Y198-R416 HydrophobicContact CE2-CG 3.76Å; Y198-R416 PolarHBondContact OH-NE 3.13Å
199	D	95.4	Very high	94.9	Very high	19 Å²	19	18.2 Å²	18.2	10%	0.102	9%	0.09	C	C	.	.			trans	-56.9	164.4	171	73.6	-71.7	0	0	0	112.5	R384 R385 H388 F412 K418	D199-R384 IonicContact OD1-CZ 3.62Å; D199-R384 IonicContact OD1-NH2 3.42Å; D199-R384 PolarHBondContact OD1-NH2 3.09Å; D199-R384 IonicContact OD2-CZ 2.75Å; D199-R384 IonicContact OD2-NE 3.21Å; D199-R384 PolarHBondContact OD2-NE 2.89Å; D199-R384 IonicContact OD2-NH2 2.67Å; D199-R384 PolarHBondContact OD2-NH2 2.66Å; D199-R385 CarbonylContact C-O 3.49Å; D199-R385 WeakPolarHBondContact CA-O 3.48Å; D199-R385 VanDerWaalsContact CB-O 3.31Å; D199-R385 WeakPolarHBondContact CB-O 3.4Å; D199-H388 PolarHBondContact N-ND1 3.08Å; D199-F412 WeakPolarHBondContact OD2-CE2 3.22Å; D199-F412 VanDerWaalsContact OD2-CZ 3.28Å; D199-F412 WeakPolarHBondContact OD2-CZ 2.89Å; D199-K418 WeakPolarHBondContact O-CD 3.39Å; D199-K418 WeakPolarHBondContact O-CE 3.09Å
200	L	94.4	Very high	94.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	144.6	176.6	-173.6	66.7	0	0	0	110.3	I170 T195 F202 R385 F408 D409 N410 K418 L420	I170-L200 HydrophobicContact CD1-CD1 4.19Å; I170-L200 HydrophobicContact CD1-CD2 4.09Å; T195-L200 HydrophobicContact CG2-CB 4.02Å; T195-L200 HydrophobicContact CG2-CD2 3.82Å; L200-F202 PolarHBondContact O-N 2.99Å; L200-R385 PolarHBondContact N-O 2.87Å; L200-R385 PolarHBondContact O-N 3.24Å; L200-F408 HydrophobicContact CD2-CB 4.09Å; L200-F408 HydrophobicContact CD2-CD1 3.93Å; L200-F408 HydrophobicContact CD2-CG 4.46Å; L200-D409 VanDerWaalsContact CD1-O 3.31Å; L200-D409 WeakPolarHBondContact CD1-O 3.48Å; L200-N410 HydrophobicContact CD1-CB 4.06Å; L200-K418 HydrophobicContact CB-CD 4.37Å; L200-K418 HydrophobicContact CD1-CB 4.49Å; L200-K418 HydrophobicContact CD1-CD 3.58Å; L200-L420 HydrophobicContact CD2-CD1 3.9Å
201	G	94.3	Very high	93.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	129.7	171.1	0	0	0	0	0	109.9	Y383 F408 D409	G201-Y383 CarbonylContact C-O 3.55Å; G201-Y383 WeakPolarHBondContact CA-O 3.37Å; G201-F408 CarbonylContact O-C 3.5Å; G201-F408 WeakPolarHBondContact O-CA 3.45Å; G201-D409 WeakPolarHBondContact CA-O 3.17Å; G201-D409 PolarHBondContact N-O 3.1Å; G201-D409 PolarHBondContact O-N 3.49Å
202	F	96.2	Very high	93.5	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.013	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.5	176.8	177.4	-103.4	0	0	0	111.3	W191 F193 L200 I380 I382 Y383 R385 F406 K407 F408	W191-F202 AromaticContact CD1-CZ 3.91Å; W191-F202 AromaticContact NE1-CE1 3.79Å; W191-F202 AromaticContact NE1-CZ 3.63Å; F193-F202 HydrophobicContact CD1-CD2 4.29Å; F193-F202 HydrophobicContact CD1-CE2 4.22Å; F193-F202 HydrophobicContact CE1-CB 4.36Å; F193-F202 AromaticContact CE1-CD1 3.77Å; F193-F202 HydrophobicContact CE1-CD1 3.77Å; F193-F202 AromaticContact CE1-CD2 3.62Å; F193-F202 HydrophobicContact CE1-CD2 3.62Å; F193-F202 AromaticContact CE1-CE1 3.9Å; F193-F202 HydrophobicContact CE1-CE1 3.9Å; F193-F202 AromaticContact CE1-CE2 3.75Å; F193-F202 HydrophobicContact CE1-CE2 3.75Å; F193-F202 AromaticContact CE1-CG 3.63Å; F193-F202 HydrophobicContact CE1-CG 3.63Å; F193-F202 AromaticContact CE1-CZ 3.88Å; F193-F202 HydrophobicContact CE1-CZ 3.88Å; F193-F202 HydrophobicContact CE2-CB 4.13Å; F193-F202 HydrophobicContact CE2-CD2 4.4Å; F193-F202 HydrophobicContact CE2-CG 4.25Å; F193-F202 HydrophobicContact CZ-CB 3.59Å; F193-F202 AromaticContact CZ-CD1 3.74Å; F193-F202 HydrophobicContact CZ-CD1 3.74Å; F193-F202 AromaticContact CZ-CD2 3.69Å; F193-F202 HydrophobicContact CZ-CD2 3.69Å; F193-F202 HydrophobicContact CZ-CE1 4.35Å; F193-F202 HydrophobicContact CZ-CE2 4.29Å; F193-F202 AromaticContact CZ-CG 3.36Å; F193-F202 HydrophobicContact CZ-CG 3.36Å; L200-F202 PolarHBondContact O-N 2.99Å; F202-I380 HydrophobicContact CE1-CD1 3.96Å; F202-I382 WeakPolarHBondContact O-CA 3.41Å; F202-Y383 PolarHBondContact N-O 3.31Å; F202-Y383 PolarHBondContact O-N 3.1Å; F202-R385 HydrophobicContact CB-CG 3.79Å; F202-F406 AromaticContact CE2-CD1 4Å; F202-F406 HydrophobicContact CE2-CD1 4Å; F202-F406 HydrophobicContact CZ-CD1 4.09Å; F202-K407 WeakPolarHBondContact CA-O 3.47Å; F202-F408 AromaticContact CD2-CD1 3.86Å; F202-F408 HydrophobicContact CD2-CD1 3.86Å; F202-F408 AromaticContact CD2-CE1 3.56Å; F202-F408 HydrophobicContact CD2-CE1 3.56Å; F202-F408 HydrophobicContact CD2-CZ 4.23Å; F202-F408 HydrophobicContact CE2-CD1 4.46Å; F202-F408 AromaticContact CE2-CE1 3.8Å; F202-F408 HydrophobicContact CE2-CE1 3.8Å; F202-F408 HydrophobicContact CE2-CZ 4.02Å
203	G	93.8	Very high	93.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	164.1	168.3	0	0	0	0	0	111.7	I380 K407	G203-I380 CarbonylContact C-O 3.47Å; G203-I380 WeakPolarHBondContact CA-O 3.11Å; G203-K407 PolarHBondContact N-O 2.85Å; G203-K407 PolarHBondContact O-N 2.96Å
204	L	95.3	Very high	92.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	129.8	-175.4	-176.4	63.4	0	0	0	109.4	W191 L379 I380 Y404 F406	W191-L204 HydrophobicContact CE3-CD2 4.29Å; W191-L204 HydrophobicContact CH2-CD2 3.68Å; W191-L204 HydrophobicContact CZ2-CD2 4.18Å; W191-L204 HydrophobicContact CZ3-CD2 3.73Å; L204-L379 HydrophobicContact CB-CB 4.43Å; L204-L379 HydrophobicContact CD2-CB 4.37Å; L204-L379 HydrophobicContact CD2-CD1 4.02Å; L204-L379 HydrophobicContact CG-CB 4.29Å; L204-L379 HydrophobicContact CG-CD1 4.07Å; L204-L379 WeakPolarHBondContact O-CA 3.48Å; L204-L379 WeakPolarHBondContact O-CB 3.46Å; L204-L379 PolarHBondContact O-N 3.28Å; L204-I380 HydrophobicContact CB-CB 3.92Å; L204-I380 HydrophobicContact CB-CD1 3.97Å; L204-I380 HydrophobicContact CB-CG1 4.01Å; L204-I380 HydrophobicContact CD2-CD1 4.12Å; L204-I380 PolarHBondContact N-O 2.83Å; L204-I380 PolarHBondContact O-N 2.8Å; L204-Y404 HydrophobicContact CD1-CD1 4.03Å; L204-Y404 HydrophobicContact CD2-CD1 4.26Å; L204-Y404 HydrophobicContact CG-CD1 4.3Å; L204-F406 HydrophobicContact CD1-CD1 3.59Å; L204-F406 HydrophobicContact CD1-CD2 3.95Å; L204-F406 HydrophobicContact CD1-CE1 3.59Å; L204-F406 HydrophobicContact CD1-CE2 3.96Å; L204-F406 HydrophobicContact CD1-CG 3.76Å; L204-F406 HydrophobicContact CD1-CZ 3.78Å
205	Y	93.4	Very high	92.1	Very high	9 Å²	9	41.1 Å²	41.1	4%	0.035	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	157.7	176	-54.6	-98.7	0	0	0	109.8	I376 D377 E378 I382 Y404 V405 K407	Y205-I376 HydrophobicContact CD1-CG2 4.16Å; Y205-I376 HydrophobicContact CG-CG2 4.41Å; Y205-D377 CarbonylContact C-O 3.12Å; Y205-D377 WeakPolarHBondContact CA-O 3.21Å; Y205-D377 WeakPolarHBondContact CB-O 3.25Å; Y205-E378 HydrophobicContact CD1-CB 3.74Å; Y205-E378 HydrophobicContact CD1-CG 3.99Å; Y205-E378 HydrophobicContact CE1-CB 3.59Å; Y205-E378 HydrophobicContact CE1-CG 3.47Å; Y205-E378 VanDerWaalsContact CE1-CG 3.47Å; Y205-E378 VanDerWaalsContact CE1-OE1 3.23Å; Y205-E378 WeakPolarHBondContact CE1-OE1 3.17Å; Y205-E378 VanDerWaalsContact CZ-OE1 3.29Å; Y205-E378 PolarHBondContact OH-OE1 3.32Å; Y205-I382 HydrophobicContact CE2-CD1 4.14Å; Y205-I382 HydrophobicContact CE2-CG1 4.3Å; Y205-Y404 WeakPolarHBondContact O-CA 3.4Å; Y205-V405 PolarHBondContact N-O 3.14Å; Y205-V405 PolarHBondContact O-N 3.38Å; Y205-K407 HydrophobicContact CD2-CD 4.29Å; Y205-K407 HydrophobicContact CD2-CG 4.3Å; Y205-K407 HydrophobicContact CE2-CB 4.44Å; Y205-K407 HydrophobicContact CE2-CD 3.89Å; Y205-K407 HydrophobicContact CE2-CG 4.2Å
206	F	92.7	Very high	91.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	114.3	169.7	-169.5	-99.4	0	0	0	109	T182 W208 I376 D377 L379 P399 Y404	T182-F206 HydrophobicContact CG2-CE2 3.67Å; T182-F206 HydrophobicContact CG2-CZ 3.96Å; F206-W208 AromaticContact CD1-CD2 3.91Å; F206-W208 HydrophobicContact CD1-CD2 3.91Å; F206-W208 AromaticContact CD1-CE2 3.73Å; F206-W208 HydrophobicContact CD1-CE3 4.46Å; F206-W208 HydrophobicContact CD1-CG 4.13Å; F206-W208 HydrophobicContact CD1-CZ2 4.09Å; F206-W208 AromaticContact CD1-NE1 3.9Å; F206-W208 AromaticContact CE1-CD2 3.7Å; F206-W208 HydrophobicContact CE1-CD2 3.7Å; F206-W208 AromaticContact CE1-CE2 3.86Å; F206-W208 AromaticContact CE1-CE3 3.8Å; F206-W208 HydrophobicContact CE1-CE3 3.8Å; F206-W208 HydrophobicContact CE1-CG 4.18Å; F206-W208 HydrophobicContact CE1-CH2 4.2Å; F206-W208 HydrophobicContact CE1-CZ2 4.09Å; F206-W208 HydrophobicContact CE1-CZ3 4.07Å; F206-I376 CarbonylContact O-C 3.56Å; F206-I376 VanDerWaalsContact O-CA 3.31Å; F206-I376 WeakPolarHBondContact O-CA 3.44Å; F206-D377 PolarHBondContact N-O 3.21Å; F206-D377 PolarHBondContact O-N 2.96Å; F206-L379 HydrophobicContact CB-CD1 3.98Å; F206-L379 HydrophobicContact CB-CD2 4.15Å; F206-L379 HydrophobicContact CB-CG 4.15Å; F206-P399 HydrophobicContact CD1-CG 3.77Å; F206-P399 HydrophobicContact CD2-CG 4.1Å; F206-P399 HydrophobicContact CE1-CG 3.71Å; F206-P399 HydrophobicContact CE2-CG 4.04Å; F206-P399 HydrophobicContact CG-CG 3.97Å; F206-P399 HydrophobicContact CZ-CG 3.84Å; F206-Y404 HydrophobicContact CD2-CD1 4.02Å; F206-Y404 AromaticContact CD2-CD2 4Å; F206-Y404 HydrophobicContact CD2-CD2 4Å; F206-Y404 AromaticContact CD2-CE1 3.88Å; F206-Y404 HydrophobicContact CD2-CE1 3.88Å; F206-Y404 AromaticContact CD2-CE2 3.84Å; F206-Y404 HydrophobicContact CD2-CE2 3.84Å; F206-Y404 HydrophobicContact CD2-CG 4.08Å; F206-Y404 AromaticContact CD2-CZ 3.78Å; F206-Y404 HydrophobicContact CE2-CD2 4.01Å; F206-Y404 AromaticContact CE2-CE2 3.69Å; F206-Y404 HydrophobicContact CE2-CE2 3.69Å; F206-Y404 AromaticContact CE2-CZ 3.97Å
207	E	90.7	Very high	91.6	Very high	26 Å²	26	41.6 Å²	41.6	12%	0.121	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	118.7	172.9	-174.9	177.3	119.4	0	0	108.4	R179 D209 L374 I376 G402 V403 V405	R179-E207 IonicContact CZ-OE1 2.7Å; R179-E207 IonicContact CZ-OE2 3.68Å; R179-E207 IonicContact NH1-OE1 2.85Å; R179-E207 PolarHBondContact NH1-OE1 3.44Å; R179-E207 IonicContact NH1-OE2 3.39Å; R179-E207 PolarHBondContact NH1-OE2 2.73Å; R179-E207 VanDerWaalsContact NH2-CD 3.35Å; R179-E207 IonicContact NH2-OE1 2.68Å; R179-E207 PolarHBondContact NH2-OE1 2.91Å; R179-E207 IonicContact NH2-OE2 3.97Å; R179-E207 PolarHBondContact NH2-OE2 3.45Å; E207-D209 PolarHBondContact O-N 2.8Å; E207-L374 HydrophobicContact CG-CB 3.9Å; E207-L374 HydrophobicContact CG-CD1 4.28Å; E207-I376 HydrophobicContact CB-CG1 4.09Å; E207-I376 HydrophobicContact CG-CD1 4.41Å; E207-I376 HydrophobicContact CG-CG1 3.94Å; E207-G402 CarbonylContact O-C 3.54Å; E207-G402 VanDerWaalsContact O-CA 3.31Å; E207-G402 WeakPolarHBondContact O-CA 3.31Å; E207-V403 HydrophobicContact CB-CB 4.42Å; E207-V403 PolarHBondContact N-O 3.28Å; E207-V403 PolarHBondContact O-N 3.01Å; E207-V405 HydrophobicContact CB-CG2 4.13Å
208	W	88.9	Confident	91.4	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	115.4	-178.4	-72.2	92.3	0	0	0	109.8	Q107 L111 L114 F206 L374 P375 D377 P399	Q107-W208 HydrophobicContact CG-CH2 3.72Å; Q107-W208 HydrophobicContact CG-CZ2 3.57Å; Q107-W208 VanDerWaalsContact NE2-CH2 3.3Å; L111-W208 HydrophobicContact CD1-CZ3 4.4Å; L111-W208 HydrophobicContact CD2-CE3 3.82Å; L111-W208 HydrophobicContact CD2-CZ3 3.94Å; L111-W208 HydrophobicContact CG-CE3 4.33Å; L111-W208 HydrophobicContact CG-CZ3 4.28Å; L114-W208 HydrophobicContact CD1-CB 3.53Å; L114-W208 WeakPolarHBondContact CD2-O 3.24Å; L114-W208 HydrophobicContact CG-CB 4.33Å; F206-W208 AromaticContact CD1-CD2 3.91Å; F206-W208 HydrophobicContact CD1-CD2 3.91Å; F206-W208 AromaticContact CD1-CE2 3.73Å; F206-W208 HydrophobicContact CD1-CE3 4.46Å; F206-W208 HydrophobicContact CD1-CG 4.13Å; F206-W208 HydrophobicContact CD1-CZ2 4.09Å; F206-W208 AromaticContact CD1-NE1 3.9Å; F206-W208 AromaticContact CE1-CD2 3.7Å; F206-W208 HydrophobicContact CE1-CD2 3.7Å; F206-W208 AromaticContact CE1-CE2 3.86Å; F206-W208 AromaticContact CE1-CE3 3.8Å; F206-W208 HydrophobicContact CE1-CE3 3.8Å; F206-W208 HydrophobicContact CE1-CG 4.18Å; F206-W208 HydrophobicContact CE1-CH2 4.2Å; F206-W208 HydrophobicContact CE1-CZ2 4.09Å; F206-W208 HydrophobicContact CE1-CZ3 4.07Å; W208-L374 WeakPolarHBondContact O-CB 3.33Å; W208-P375 HydrophobicContact CB-CB 4.5Å; W208-P375 PolarHBondContact N-O 3.35Å; W208-D377 PolarHBondContact NE1-OD2 2.95Å; W208-P399 HydrophobicContact CH2-CB 3.85Å; W208-P399 HydrophobicContact CH2-CG 4.14Å; W208-P399 WeakPolarHBondContact CH2-O 3.28Å; W208-P399 HydrophobicContact CZ2-CB 4.01Å; W208-P399 HydrophobicContact CZ2-CG 4.13Å
209	D	87.6	Confident	91.2	Very high	29 Å²	29	34.1 Å²	34.1	16%	0.155	18%	0.178	C	C	.	.			trans	-140.8	131.3	179.2	-167	-10.2	0	0	0	109.2	E207 E211 P212 L374 V401 G402 V403	E207-D209 PolarHBondContact O-N 2.8Å; D209-E211 PolarHBondContact OD1-N 3.45Å; D209-P212 HydrophobicContact CB-CB 4.24Å; D209-P212 WeakPolarHBondContact OD2-CA 3.34Å; D209-L374 HydrophobicContact CB-CD1 3.81Å; D209-V401 CarbonylContact O-C 3.56Å; D209-V401 WeakPolarHBondContact O-CG1 3.47Å; D209-G402 WeakPolarHBondContact O-CA 3.4Å; D209-G402 PolarHBondContact O-N 3.27Å; D209-V403 HydrophobicContact CB-CG2 4.43Å
210	L	85.2	Confident	90.9	Very high	33 Å²	33	36.8 Å²	36.8	17%	0.173	19%	0.192	C	C	.	.	S	Bend	trans	-92.1	-12.9	-179.8	-61.5	169.7	0	0	0	112.2	L114 K118 F135 P136 P212	L114-L210 HydrophobicContact CB-CD1 4.31Å; L114-L210 HydrophobicContact CD1-CD1 4.42Å; L114-L210 HydrophobicContact CD1-CG 4.14Å; K118-L210 HydrophobicContact CD-CD1 4.25Å; F135-L210 HydrophobicContact CD1-CD1 3.76Å; F135-L210 HydrophobicContact CD1-CD2 4.46Å; F135-L210 HydrophobicContact CE1-CD1 3.36Å; F135-L210 HydrophobicContact CZ-CD1 4.45Å; P136-L210 HydrophobicContact CG-CD2 4.43Å; L210-P212 VanDerWaalsContact C-CD 3.42Å
211	E	86.5	Confident	90.3	Very high	141 Å²	141	39 Å²	39	66%	0.659	21%	0.207	S	C	*	.	S	Bend	trans	-132	54	176.6	-66.4	176.6	-177.1	0	0	109.5	K118 D209	K118-E211 WeakPolarHBondContact CE-OE1 3.43Å; K118-E211 IonicContact NZ-OE1 3.83Å; K118-E211 PolarHBondContact NZ-OE1 3.12Å; D209-E211 PolarHBondContact OD1-N 3.45Å
212	P	88.8	Confident	89.1	Confident	29 Å²	29	44.7 Å²	44.7	19%	0.188	23%	0.234	C	C	.	.			trans	-61.9	148.9	-174	29.7	-37	0	0	0	111	P181 D209 L210 V401 V403	P181-P212 HydrophobicContact CB-CB 4.31Å; D209-P212 HydrophobicContact CB-CB 4.24Å; D209-P212 WeakPolarHBondContact OD2-CA 3.34Å; L210-P212 VanDerWaalsContact C-CD 3.42Å; P212-V401 HydrophobicContact CG-CG1 3.75Å; P212-V403 HydrophobicContact CB-CG2 3.73Å
213	P	90.5	Very high	87.2	Confident	66 Å²	66	47.4 Å²	47.4	43%	0.429	25%	0.253	S	S	.	.			trans	-60.7	149.2	179.9	25.3	-33.7	0	0	0	111.1	P181 N215	P181-P213 WeakPolarHBondContact CB-O 3.21Å; P181-P213 HydrophobicContact CG-CG 4.26Å; P181-P213 WeakPolarHBondContact CG-O 3.24Å; P213-N215 VanDerWaalsContact C-N 3.28Å; P213-N215 PolarHBondContact O-N 3.02Å
214	E	87.1	Confident	84.9	Confident	189 Å²	189	51.8 Å²	51.8	88%	0.883	28%	0.284	S	S	*	.	S	Bend	trans	-71.8	-21.1	179.9	-62.8	-178.1	162	0	0	113.7
215	N	88.6	Confident	82.7	Confident	69 Å²	69	59.2 Å²	59.2	37%	0.369	32%	0.323	S	S	.	.	S	Bend	trans	-110.3	143.2	-169.8	-62.9	-69.9	0	0	0	112.3	P213	P213-N215 VanDerWaalsContact C-N 3.28Å; P213-N215 PolarHBondContact O-N 3.02Å
216	I	91.9	Very high	80.3	Confident	28 Å²	28	66.1 Å²	66.1	14%	0.144	36%	0.356	C	S	.	.			trans	-70.1	130.1	169.7	-66.4	168.4	0	0	0	109.3	V178 R179 V180 L260	V178-I216 HydrophobicContact CG1-CG2 3.97Å; R179-I216 WeakPolarHBondContact O-CA 3.36Å; R179-I216 WeakPolarHBondContact O-CG2 3.29Å; V180-I216 HydrophobicContact CG1-CD1 4.24Å; V180-I216 HydrophobicContact CG1-CG1 4.22Å; V180-I216 HydrophobicContact CG2-CG1 4.38Å; V180-I216 HydrophobicContact CG2-CG2 4.26Å; I216-L260 HydrophobicContact CD1-CD2 3.59Å
217	S	91.7	Very high	78	Confident	30 Å²	30	76 Å²	76	21%	0.21	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	148.4	172.9	94.3	0	0	0	0	111.4	V178 R179 N219	V178-S217 WeakPolarHBondContact CA-O 3.17Å; R179-S217 PolarHBondContact N-O 3.37Å; R179-S217 PolarHBondContact O-N 2.97Å; R179-S217 VanDerWaalsContact O-N 3.14Å; S217-N219 PolarHBondContact OG-OD1 2.79Å
218	V	91.9	Very high	75.6	Confident	22 Å²	22	78.7 Å²	78.7	13%	0.133	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	117.8	172.7	-177.5	0	0	0	0	107.5	I168 T177 V178	I168-V218 HydrophobicContact CD1-CG1 4.13Å; T177-V218 WeakPolarHBondContact O-CA 3.48Å; V178-V218 HydrophobicContact CG1-CG2 4.19Å; V178-V218 HydrophobicContact CG2-CG1 4.33Å; V178-V218 HydrophobicContact CG2-CG2 4.24Å
219	N	91.1	Very high	73.3	Confident	23 Å²	23	81.7 Å²	81.7	12%	0.123	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	118	-174.1	-65.4	62.9	0	0	0	108.2	A176 T177 S217	A176-N219 WeakPolarHBondContact CA-O 3.44Å; T177-N219 PolarHBondContact N-O 3.47Å; T177-N219 PolarHBondContact O-N 3.34Å; S217-N219 PolarHBondContact OG-OD1 2.79Å
220	I	88.4	Confident	70.9	Confident	75 Å²	75	88.8 Å²	88.8	39%	0.385	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116	173.9	-56.1	178.6	0	0	0	107.5	A176 E222	A176-I220 HydrophobicContact CB-CG1 4.12Å; I220-E222 HydrophobicContact CG2-CG 4.21Å
221	S	82.9	Confident	68.7	Low	45 Å²	45	94.2 Å²	94.2	32%	0.315	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	108.7	175.3	-62.1	0	0	0	0	108.6	A174 T175	A174-S221 CarbonylContact C-O 3.48Å; A174-S221 VanDerWaalsContact CA-O 3.23Å; A174-S221 WeakPolarHBondContact CA-O 3.23Å; A174-S221 WeakPolarHBondContact CB-O 3.31Å; T175-S221 PolarHBondContact N-O 3.44Å; T175-S221 PolarHBondContact O-N 3.01Å
222	E	68.2	Low	66.4	Low	121 Å²	121	96 Å²	96	57%	0.565	54%	0.538	S	S	*	.			trans	-92.8	133.8	170.6	-58.5	-175.1	135.3	0	0	108.4	S171 A174 I220 S224	S171-E222 WeakPolarHBondContact CB-OE1 2.99Å; S171-E222 PolarHBondContact OG-OE1 2.85Å; A174-E222 HydrophobicContact CB-CB 4.48Å; A174-E222 HydrophobicContact CB-CG 4.05Å; I220-E222 HydrophobicContact CG2-CG 4.21Å; E222-S224 PolarHBondContact O-N 2.92Å; E222-S224 VanDerWaalsContact O-N 3.12Å
223	S	55.7	Low	64	Low	60 Å²	60	102.9 Å²	102.9	42%	0.42	57%	0.573	S	S	.	*			trans	-64.6	112.8	172.8	54.6	0	0	0	0	108.8	L173 D225	L173-S223 VanDerWaalsContact CB-OG 3.22Å; L173-S223 WeakPolarHBondContact CB-OG 3.28Å; S223-D225 PolarHBondContact O-N 2.9Å
224	S	46.8	Very low	61.6	Low	92 Å²	92	109 Å²	109	64%	0.643	60%	0.596	S	S	*	*	S	Bend	trans	-76.2	40.1	-165.9	-172.4	0	0	0	0	114.6	E222	E222-S224 PolarHBondContact O-N 2.92Å; E222-S224 VanDerWaalsContact O-N 3.12Å
225	D	49.4	Very low	59.3	Low	156 Å²	156	109.1 Å²	109.1	83%	0.834	60%	0.597	S	S	*	*			trans	-123.3	12.7	-166.1	-130	20.7	0	0	0	114.3	S223	S223-D225 PolarHBondContact O-N 2.9Å
226	E	42.3	Very low	56.7	Low	153 Å²	153	109.2 Å²	109.2	72%	0.715	61%	0.614	S	S	*	*			trans	-118.1	77.2	170.3	-70.5	-167.7	-163.5	0	0	111.8
227	E	43.5	Very low	54.2	Low	207 Å²	207	113.4 Å²	113.4	97%	0.967	64%	0.643	S	S	*	*			trans	-107	102.4	149.8	-80.3	-158.9	-163.1	0	0	109.1
228	G	40.4	Very low	51.5	Low	83 Å²	83	118.9 Å²	118.9	86%	0.856	67%	0.67	S	S	*	*			trans	154.2	106.9	168.9	0	0	0	0	0	116
229	G	40.5	Very low	48.8	Very low	65 Å²	65	123.1 Å²	123.1	67%	0.67	70%	0.701	S	S	*	*			trans	127.3	95.5	175.1	0	0	0	0	0	111.2
230	E	37.3	Very low	46.2	Very low	178 Å²	178	125.8 Å²	125.8	83%	0.832	73%	0.733	S	S	*	*				62.7	118.4	86.3	-65.1	174.3	-164.9	0	0	111.5
231	D	40.1	Very low	43.6	Very low	146 Å²	146	129.3 Å²	129.3	78%	0.781	75%	0.753	S	S	*	*			cis	-155.3	-179	4.5	-96.4	-30.4	0	0	0	111.7
232	E	36.9	Very low	41.6	Very low	180 Å²	180	132.6 Å²	132.6	84%	0.841	78%	0.775	S	S	*	*			trans	-65	150.9	-175.1	-55.8	167.2	161.6	0	0	115.3
233	D	38.3	Very low	40.5	Very low	173 Å²	173	131.9 Å²	131.9	93%	0.925	78%	0.779	S	S	*	*			trans	-158.8	74.8	154	-101.5	-27.6	0	0	0	109.9
234	E	40.2	Very low	39.7	Very low	193 Å²	193	137 Å²	137	90%	0.902	80%	0.797	S	S	*	*			trans	-87.6	112.1	161.7	-90.1	-153.2	175.7	0	0	110.3
235	E	39.3	Very low	39.1	Very low	193 Å²	193	141.4 Å²	141.4	90%	0.902	81%	0.807	S	S	*	*			trans	-129.2	98	154.4	-78.8	-152.9	165.4	0	0	111.5
236	G	33.8	Very low	38.4	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	81%	0.81	S	S	*	*			trans	-101.7	149.2	151.1	0	0	0	0	0	109.8
237	P	39.8	Very low	37.9	Very low	115 Å²	115	139 Å²	139	75%	0.747	81%	0.813	S	S	*	*				-145.9	155.9	129.3	33.1	-16.9	0	0	0	117.1
238	N	35.8	Very low	37.8	Very low	146 Å²	146	134.3 Å²	134.3	78%	0.781	80%	0.801	S	S	*	*			trans	77	91.9	148.1	-72.9	-13.7	0	0	0	122
239	S	35.1	Very low	37.6	Very low	111 Å²	111	140 Å²	140	78%	0.776	80%	0.802	S	S	*	*				51.3	120.2	109.8	70.5	0	0	0	0	120.8
240	G	34.7	Very low	37.1	Very low	78 Å²	78	143.5 Å²	143.5	80%	0.804	81%	0.806	S	S	*	*			trans	-166.9	60.7	172	0	0	0	0	0	116.2
241	N	35	Very low	37.1	Very low	150 Å²	150	144.4 Å²	144.4	80%	0.802	81%	0.81	S	S	*	*			trans	10.6	132.6	161.5	-62.8	-13	0	0	0	122.4
242	S	39.8	Very low	36.7	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	81%	0.81	S	S	*	*			trans	69.9	149.7	134.6	-64.9	0	0	0	0	119.6
243	V	46.2	Very low	36.7	Very low	107 Å²	107	145.8 Å²	145.8	65%	0.648	81%	0.813	S	S	*	*			cis	-166.2	159	-2.5	122.4	0	0	0	0	109.4
244	E	39.4	Very low	36.2	Very low	167 Å²	167	147.2 Å²	147.2	78%	0.78	81%	0.814	S	S	*	*			trans	53.8	112.8	162.6	-76.3	157.4	-173.4	0	0	120
245	Q	32.8	Very low	35.8	Very low	184 Å²	184	142.6 Å²	142.6	86%	0.86	80%	0.804	S	S	*	*				60.1	107.5	84.9	-73.1	-164.1	16.7	0	0	116.8
246	T	35.3	Very low	35.3	Very low	145 Å²	145	141.8 Å²	141.8	89%	0.89	80%	0.799	S	S	*	*				-167.6	140.4	124.8	22.2	0	0	0	0	111.1
247	S	32.2	Very low	35.5	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	80%	0.797	S	S	*	*			trans	-121.2	-173.4	161.2	-44.2	0	0	0	0	107
248	P	40.4	Very low	35.4	Very low	110 Å²	110	144.5 Å²	144.5	71%	0.714	79%	0.79	S	S	*	*			cis	-134.6	-176.2	-9.8	40.5	-23.7	0	0	0	113.5
249	K	36.2	Very low	35.4	Very low	201 Å²	201	146.7 Å²	146.7	87%	0.874	80%	0.796	S	S	*	*				175.7	146.2	125.3	-97.3	165.5	-177.1	-179.8	0	114.4
250	N	30.7	Very low	35.6	Very low	140 Å²	140	145 Å²	145	75%	0.749	78%	0.778	S	S	*	*			trans	-64.8	153.5	177.4	-57.5	-0.1	0	0	0	113.8
251	E	36.3	Very low	35.4	Very low	197 Å²	197	143.1 Å²	143.1	92%	0.921	76%	0.758	S	S	*	*				-137.8	144.3	128.6	-70.7	-160.5	151.7	0	0	109.9
252	N	31.5	Very low	35.3	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	76%	0.758	S	S	*	*			trans	-86.8	145.8	-171.8	-61.5	-16.2	0	0	0	112.2
253	K	37.2	Very low	35.3	Very low	206 Å²	206	142.9 Å²	142.9	90%	0.896	74%	0.736	S	S	*	*			trans	-145.3	127.3	150.1	-101.8	179.5	-178.9	177.4	0	110.2
254	E	27.5	Very low	34.6	Very low	203 Å²	203	140.6 Å²	140.6	95%	0.949	72%	0.724	S	S	*	*			trans	-77.1	125.3	174.5	-68.2	160.9	114.9	0	0	110.3
255	S	32.2	Very low	34.3	Very low	97 Å²	97	140.4 Å²	140.4	68%	0.678	73%	0.728	S	S	*	*			trans	-135.1	127.2	157.4	53.9	0	0	0	0	107.3	D257	S255-D257 VanDerWaalsContact C-N 3.31Å; S255-D257 PolarHBondContact O-N 2.96Å; S255-D257 VanDerWaalsContact O-N 3.1Å
256	H	29.7	Very low	34.3	Very low	175 Å²	175	138 Å²	138	81%	0.81	72%	0.717	S	S	*	*			trans	-93.7	52.3	-156.8	-155.3	-67.2	0	0	0	112.7	L258	H256-L258 PolarHBondContact O-N 3.2Å
257	D	38	Very low	34	Very low	128 Å²	128	140.2 Å²	140.2	68%	0.684	72%	0.717	S	S	*	*			trans	-79.2	118.1	176.4	-66.5	-46	0	0	0	110.3	S255 E259	S255-D257 VanDerWaalsContact C-N 3.31Å; S255-D257 PolarHBondContact O-N 2.96Å; S255-D257 VanDerWaalsContact O-N 3.1Å; D257-E259 PolarHBondContact O-N 3.38Å
258	L	37.6	Very low	33.8	Very low	116 Å²	116	145.2 Å²	145.2	61%	0.607	72%	0.718	S	S	*	*			trans	-69.7	119.3	-177	-80.9	154.8	0	0	0	110.7	H256 L260	H256-L258 PolarHBondContact O-N 3.2Å; L258-L260 PolarHBondContact O-N 3.24Å; L258-L260 VanDerWaalsContact O-N 3.1Å
259	E	34.8	Very low	33.3	Very low	192 Å²	192	144 Å²	144	90%	0.897	71%	0.705	S	S	*	*			trans	-57.9	107.1	-176.1	-165.2	175.9	-166.1	0	0	111.4	D257 G261	D257-E259 PolarHBondContact O-N 3.38Å; E259-G261 PolarHBondContact O-N 2.91Å
260	L	40.4	Very low	32.8	Very low	75 Å²	75	137.9 Å²	137.9	39%	0.393	69%	0.686	S	S	.	*			trans	-60.9	124.4	177.6	-81.9	157.5	0	0	0	110.2	I216 L258	I216-L260 HydrophobicContact CD1-CD2 3.59Å; L258-L260 PolarHBondContact O-N 3.24Å; L258-L260 VanDerWaalsContact O-N 3.1Å
261	G	31	Very low	32.7	Very low	38 Å²	38	137.7 Å²	137.7	39%	0.392	68%	0.684	S	S	.	*			trans	-53	150.4	-171.7	0	0	0	0	0	115	E259 K263	E259-G261 PolarHBondContact O-N 2.91Å; G261-K263 PolarHBondContact O-N 2.93Å
262	K	32.7	Very low	32.3	Very low	187 Å²	187	134.5 Å²	134.5	81%	0.813	67%	0.673	S	S	*	*			trans	-49.8	96.3	-172.5	-65.7	165.3	-177.2	165.2	0	112.9	S264	K262-S264 PolarHBondContact O-N 3.49Å
263	K	38.7	Very low	32.4	Very low	72 Å²	72	132.1 Å²	132.1	31%	0.313	66%	0.657	S	S	.	*			trans	-57.1	117.1	173.4	-61.7	-177.6	-173.9	179.9	0	110.2	E165 C166 G261 Y422	E165-K263 HydrophobicContact CG-CD 4.47Å; E165-K263 PolarHBondContact O-NZ 2.63Å; C166-K263 PolarHBondContact SG-NZ 2.99Å; G261-K263 PolarHBondContact O-N 2.93Å; K263-Y422 PolarHBondContact NZ-OH 3.03Å
264	S	33.1	Very low	32.2	Very low	58 Å²	58	125.9 Å²	125.9	41%	0.406	63%	0.633	S	S	.	*			trans	-95.8	115	166.2	70.4	0	0	0	0	110.2	K262 Q266	K262-S264 PolarHBondContact O-N 3.49Å; S264-Q266 PolarHBondContact O-N 3.33Å
265	L	31.2	Very low	32.5	Very low	164 Å²	164	117.6 Å²	117.6	86%	0.859	60%	0.595	S	S	*	*			trans	-68.8	96.7	167.8	-102.4	156.4	0	0	0	109.2
266	Q	33.6	Very low	32.5	Very low	134 Å²	134	115.7 Å²	115.7	63%	0.626	58%	0.58	S	S	*	*			trans	-92.4	125.9	171.7	-69.1	-173.4	3.9	0	0	109.9	S264	S264-Q266 PolarHBondContact O-N 3.33Å
267	Q	29.2	Very low	32.7	Very low	191 Å²	191	109.8 Å²	109.8	89%	0.893	55%	0.554	S	S	*	*			trans	-79.3	127.6	177.6	-74.1	178.8	-34.1	0	0	111
268	R	28.8	Very low	32.3	Very low	217 Å²	217	108.5 Å²	108.5	82%	0.819	54%	0.54	S	S	*	.			trans	49.4	102.4	170.4	-66	-172.3	-179	-161.2	-1.6	116.4
269	L	28.7	Very low	32.2	Very low	85 Å²	85	108.1 Å²	108.1	45%	0.445	53%	0.531	S	S	.	.			trans	-72.6	151.9	149	-65.4	171.4	0	0	0	109.3	E273	L269-E273 WeakPolarHBondContact CD1-OE2 3.19Å; L269-E273 WeakPolarHBondContact CD2-OE2 3.17Å
270	P	26.5	Very low	32.4	Very low	72 Å²	72	102.8 Å²	102.8	47%	0.468	50%	0.503	S	S	.	.			trans	-57.8	146.6	174.7	-22.7	33.9	0	0	0	112.4	D272 E273	P270-D272 PolarHBondContact O-N 3.4Å; P270-D272 VanDerWaalsContact O-N 3.1Å; P270-E273 PolarHBondContact O-N 2.99Å; P270-E273 VanDerWaalsContact O-N 3.09Å
271	I	28.8	Very low	32.3	Very low	137 Å²	137	105.2 Å²	105.2	70%	0.703	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-54.7	-32.3	178.6	-71.5	166.8	0	0	0	111.6	E273 L274	I271-E273 PolarHBondContact O-N 3.22Å; I271-E273 VanDerWaalsContact O-N 3.17Å; I271-L274 HydrophobicContact CG2-CD1 4.33Å; I271-L274 WeakPolarHBondContact O-CB 3.4Å; I271-L274 PolarHBondContact O-N 3.38Å; I271-L274 VanDerWaalsContact O-N 3.11Å
272	D	26.8	Very low	32.5	Very low	130 Å²	130	106.9 Å²	106.9	70%	0.695	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-63.5	-20.2	-178	-51.9	-37.9	0	0	0	113.7	P270 L274 R373	P270-D272 PolarHBondContact O-N 3.4Å; P270-D272 VanDerWaalsContact O-N 3.1Å; D272-L274 VanDerWaalsContact C-N 3.34Å; D272-R373 PolarHBondContact O-NH1 2.97Å; D272-R373 PolarHBondContact O-NH2 2.94Å
273	E	33.5	Very low	32.5	Very low	97 Å²	97	103.9 Å²	103.9	45%	0.453	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-80.7	-10.4	177.3	-70.1	-179.7	-157.8	0	0	113.7	L269 P270 I271 I275 R373	L269-E273 WeakPolarHBondContact CD1-OE2 3.19Å; L269-E273 WeakPolarHBondContact CD2-OE2 3.17Å; P270-E273 PolarHBondContact O-N 2.99Å; P270-E273 VanDerWaalsContact O-N 3.09Å; I271-E273 PolarHBondContact O-N 3.22Å; I271-E273 VanDerWaalsContact O-N 3.17Å; E273-I275 PolarHBondContact O-N 2.58Å; E273-R373 PolarHBondContact O-NH2 3.18Å
274	L	33.3	Very low	32.1	Very low	75 Å²	75	106.2 Å²	106.2	39%	0.393	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-64	120	178	-73.1	164	0	0	0	111.5	I271 D272 R373	I271-L274 HydrophobicContact CG2-CD1 4.33Å; I271-L274 WeakPolarHBondContact O-CB 3.4Å; I271-L274 PolarHBondContact O-N 3.38Å; I271-L274 VanDerWaalsContact O-N 3.11Å; D272-L274 VanDerWaalsContact C-N 3.34Å; L274-R373 PolarHBondContact O-NH2 3.5Å
275	I	35.1	Very low	31.8	Very low	30 Å²	30	110.9 Å²	110.9	15%	0.154	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-61.5	124.9	163.1	-52.1	163	0	0	0	107.2	E273 I277 I376 V405 K407	E273-I275 PolarHBondContact O-N 2.58Å; I275-I277 PolarHBondContact O-N 2.77Å; I275-I376 HydrophobicContact CD1-CD1 3.74Å; I275-I376 HydrophobicContact CD1-CG2 4.36Å; I275-I376 HydrophobicContact CG1-CD1 3.8Å; I275-V405 HydrophobicContact CD1-CG1 4.4Å; I275-K407 PolarHBondContact O-NZ 2.84Å
276	P	30.8	Very low	31.5	Very low	56 Å²	56	109 Å²	109	36%	0.364	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-59.9	133.4	179.1	23.7	-32.8	0	0	0	110.9	Y278	P276-Y278 HydrophobicContact CB-CD2 4.4Å; P276-Y278 HydrophobicContact CB-CE2 3.91Å; P276-Y278 HydrophobicContact CG-CE2 3.97Å; P276-Y278 PolarHBondContact O-N 3.39Å
277	I	34.6	Very low	31.1	Very low	52 Å²	52	111.6 Å²	111.6	27%	0.267	55%	0.546	S	S	.	.			trans	-90.7	101.2	179.4	-64.4	173	0	0	0	108	T175 I275 R279 I382 K407	T175-I277 HydrophobicContact CG2-CD1 4.17Å; I275-I277 PolarHBondContact O-N 2.77Å; I277-R279 HydrophobicContact CG2-CG 4.47Å; I277-I382 HydrophobicContact CB-CD1 4.25Å; I277-I382 HydrophobicContact CD1-CD1 4.31Å; I277-I382 HydrophobicContact CG1-CD1 3.86Å; I277-I382 HydrophobicContact CG2-CB 4.45Å; I277-I382 HydrophobicContact CG2-CD1 3.67Å; I277-I382 HydrophobicContact CG2-CG2 4.29Å; I277-K407 HydrophobicContact CG1-CD 4.39Å
278	Y	30.3	Very low	30.8	Very low	100 Å²	100	107.8 Å²	107.8	39%	0.392	54%	0.539	S	S	.	.			trans	-87.5	127.4	166.2	-70.3	-82.6	0	0	0	109	P276 H353	P276-Y278 HydrophobicContact CB-CD2 4.4Å; P276-Y278 HydrophobicContact CB-CE2 3.91Å; P276-Y278 HydrophobicContact CG-CE2 3.97Å; P276-Y278 PolarHBondContact O-N 3.39Å; Y278-H353 AromaticContact CE2-CD2 3.75Å; Y278-H353 AromaticContact CE2-NE2 3.71Å; Y278-H353 AromaticContact CZ-NE2 3.77Å; Y278-H353 PolarHBondContact OH-NE2 2.81Å
279	R	33.5	Very low	30.7	Very low	108 Å²	108	104.6 Å²	104.6	41%	0.408	53%	0.534	S	S	.	.			trans	-96	139.3	171.4	-63.5	-172.7	-168.4	139.4	7	109.2	I277 D409 S411	I277-R279 HydrophobicContact CG2-CG 4.47Å; R279-D409 IonicContact NE-OD2 3.73Å; R279-D409 IonicContact NH2-OD2 3.2Å; R279-S411 PolarHBondContact NH2-OG 3.46Å
280	R	40.4	Very low	30.5	Very low	80 Å²	80	105.8 Å²	105.8	30%	0.302	55%	0.549	S	S	.	.			trans	-100.4	114.4	157	-70.2	176.6	-168.7	167	12	106.5	C282 Y383	R280-C282 PolarHBondContact O-N 2.88Å; R280-Y383 HydrophobicContact CB-CD1 4.46Å; R280-Y383 HydrophobicContact CB-CE1 3.5Å; R280-Y383 VanDerWaalsContact CB-CE1 3.5Å; R280-Y383 VanDerWaalsContact CD-OH 3.3Å; R280-Y383 WeakPolarHBondContact CD-OH 3.31Å; R280-Y383 VanDerWaalsContact O-CD1 3.3Å; R280-Y383 WeakPolarHBondContact O-CD1 2.7Å; R280-Y383 VanDerWaalsContact O-CE1 3.22Å; R280-Y383 WeakPolarHBondContact O-CE1 3.37Å
281	D	37.9	Very low	30.5	Very low	126 Å²	126	110.6 Å²	110.6	67%	0.674	57%	0.565	S	S	*	*			trans	-72.3	100.3	-175.5	-71.7	-35.5	0	0	0	110.9	H283	D281-H283 PolarHBondContact O-N 3.14Å
282	C	35.9	Very low	30.5	Very low	74 Å²	74	111.4 Å²	111.4	50%	0.5	57%	0.571	S	S	.	*			trans	-77.4	72	170.4	63.9	0	0	0	0	110.8	R280 Y383	R280-C282 PolarHBondContact O-N 2.88Å; C282-Y383 HydrophobicContact CB-CD1 4.17Å; C282-Y383 HydrophobicContact CB-CE1 4.39Å
283	H	31.1	Very low	30.7	Very low	124 Å²	124	112.8 Å²	112.8	57%	0.574	58%	0.577	S	S	*	*			trans	-110.3	49	171.9	-77	-47.6	0	0	0	112.2	D281 E285	D281-H283 PolarHBondContact O-N 3.14Å; H283-E285 VanDerWaalsContact C-N 3.35Å
284	T	30.3	Very low	30.4	Very low	120 Å²	120	117.5 Å²	117.5	74%	0.736	60%	0.599	S	S	*	*			trans	-98.2	42.8	168.2	-40.2	0	0	0	0	111.6
285	E	28.3	Very low	30.3	Very low	156 Å²	156	122.4 Å²	122.4	73%	0.729	63%	0.625	S	S	*	*			trans	-167.4	99.1	152.3	-113.7	178.4	-139.2	0	0	109.6	H283 Y287	H283-E285 VanDerWaalsContact C-N 3.35Å; E285-Y287 PolarHBondContact O-N 3.23Å
286	V	25.1	Very low	29.9	Very low	126 Å²	126	124.6 Å²	124.6	76%	0.764	66%	0.655	S	S	*	*			trans	-82	92.2	169.3	-179.2	0	0	0	0	107.8	C288	V286-C288 PolarHBondContact O-N 3.13Å
287	Y	24.4	Very low	29.7	Very low	188 Å²	188	132 Å²	132	74%	0.737	68%	0.681	S	S	*	*			trans	-65.9	92.2	160	-105.6	-93.3	0	0	0	108.6	E285 E289	E285-Y287 PolarHBondContact O-N 3.23Å; Y287-E289 HydrophobicContact CD1-CG 4.48Å; Y287-E289 PolarHBondContact O-N 2.96Å
288	C	23.7	Very low	29.7	Very low	110 Å²	110	139.3 Å²	139.3	74%	0.743	71%	0.711	S	S	*	*			trans	-74.4	75.7	167.5	-170.1	0	0	0	0	108.4	V286 S290	V286-C288 PolarHBondContact O-N 3.13Å; C288-S290 PolarHBondContact O-N 2.68Å
289	E	25.3	Very low	29.5	Very low	151 Å²	151	139.4 Å²	139.4	71%	0.706	73%	0.726	S	S	*	*			trans	-65.1	107.1	165.6	-77.5	-157.6	141.8	0	0	108.5	Y287 H291	Y287-E289 HydrophobicContact CD1-CG 4.48Å; Y287-E289 PolarHBondContact O-N 2.96Å; E289-H291 PolarHBondContact O-N 3.26Å
290	S	26.1	Very low	29.3	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	74%	0.741	S	S	*	*			trans	-71.8	76.1	-179.3	59.4	0	0	0	0	111.3	C288 D292	C288-S290 PolarHBondContact O-N 2.68Å; S290-D292 PolarHBondContact O-N 2.91Å
291	H	25.4	Very low	28.7	Very low	174 Å²	174	144.4 Å²	144.4	81%	0.806	76%	0.761	S	S	*	*			trans	-89.7	78	161.6	-96.2	-91.6	0	0	0	109.4	E289	E289-H291 PolarHBondContact O-N 3.26Å
292	D	29.3	Very low	28.3	Very low	154 Å²	154	146 Å²	146	82%	0.824	77%	0.765	S	S	*	*			trans	-136.8	141	166.7	-117.5	-32.4	0	0	0	112.2	S290	S290-D292 PolarHBondContact O-N 2.91Å
293	L	30.8	Very low	28	Very low	159 Å²	159	154.4 Å²	154.4	83%	0.832	79%	0.786	S	S	*	*			trans	-70.1	156.9	-166.9	-74.2	92	0	0	0	113.5	L295	L293-L295 PolarHBondContact O-N 2.87Å
294	E	26.1	Very low	28	Very low	195 Å²	195	155.2 Å²	155.2	91%	0.911	79%	0.794	S	S	*	*			trans	-52.5	100.7	179	-60.2	-176.8	122.7	0	0	114.3
295	L	31.2	Very low	28.1	Very low	178 Å²	178	154.6 Å²	154.6	93%	0.932	79%	0.792	S	S	*	*			trans	-142.7	115.5	160.1	-88.9	179.5	0	0	0	113.8	L293	L293-L295 PolarHBondContact O-N 2.87Å
296	G	27.3	Very low	28.4	Very low	76 Å²	76	154.8 Å²	154.8	78%	0.784	80%	0.796	S	S	*	*			trans	74.9	90.8	142.4	0	0	0	0	0	118.6	K298	G296-K298 PolarHBondContact O-N 2.69Å
297	K	27.4	Very low	28.8	Very low	211 Å²	211	155.7 Å²	155.7	92%	0.917	80%	0.797	S	S	*	*			trans	-52.4	123.4	163.1	-63.2	172.2	-179.6	174.1	0	111.9
298	K	33.3	Very low	29.4	Very low	207 Å²	207	155.7 Å²	155.7	90%	0.9	80%	0.803	S	S	*	*			trans	-162.9	136.3	142.9	-110.2	160.2	-171.6	178.4	0	112.9	G296	G296-K298 PolarHBondContact O-N 2.69Å
299	S	27.8	Very low	29.8	Very low	102 Å²	102	158.5 Å²	158.5	71%	0.713	81%	0.81	S	S	*	*			trans	-70.4	146.9	173.3	52.7	0	0	0	0	112.7
300	L	27.6	Very low	29.9	Very low	136 Å²	136	158.9 Å²	158.9	71%	0.712	82%	0.815	S	S	*	*				170.2	121.2	128.9	-89.8	157.7	0	0	0	108.5
301	Q	27.8	Very low	30	Very low	156 Å²	156	158.9 Å²	158.9	73%	0.729	81%	0.813	S	S	*	*				50.2	103.8	109.2	-72	-176.8	1	0	0	115.6
302	Q	31.1	Very low	30	Very low	160 Å²	160	157.5 Å²	157.5	75%	0.748	81%	0.81	S	S	*	*				-179.6	140.7	100.4	-95.3	162.1	14.7	0	0	110.6
303	R	28.6	Very low	29.9	Very low	250 Å²	250	161 Å²	161	94%	0.943	81%	0.813	S	S	*	*			trans	-80.8	123.6	160.1	-70.1	-177.4	-178.9	-170.9	-1.5	106.7
304	L	30.6	Very low	29.7	Very low	142 Å²	142	164 Å²	164	74%	0.743	81%	0.813	S	S	*	*			trans	-115.8	151.9	164.4	-71.1	170	0	0	0	108.8
305	P	34	Very low	29.7	Very low	106 Å²	106	165.4 Å²	165.4	69%	0.688	81%	0.81	S	S	*	*			trans	-67.2	160.4	-179.9	-16.2	31.8	0	0	0	112	D307	P305-D307 VanDerWaalsContact C-N 3.28Å; P305-D307 PolarHBondContact O-N 2.95Å
306	I	34.1	Very low	29.6	Very low	161 Å²	161	162.7 Å²	162.7	83%	0.826	80%	0.797	S	S	*	*	S	Bend	trans	-81.7	1.3	-168	-99.6	169.3	0	0	0	114.4	E308	I306-E308 PolarHBondContact O-N 3.47Å; I306-E308 VanDerWaalsContact O-N 3.16Å
307	D	33.4	Very low	29.6	Very low	145 Å²	145	164.2 Å²	164.2	78%	0.775	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	9.5	-160.6	-54.1	-39.4	0	0	0	116.6	P305	P305-D307 VanDerWaalsContact C-N 3.28Å; P305-D307 PolarHBondContact O-N 2.95Å
308	E	37.2	Very low	29.7	Very low	188 Å²	188	161.6 Å²	161.6	88%	0.879	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.4	15.3	-173.4	-72.8	-164.7	153.1	0	0	117	I306	I306-E308 PolarHBondContact O-N 3.47Å; I306-E308 VanDerWaalsContact O-N 3.16Å
309	L	31.4	Very low	29.6	Very low	168 Å²	168	156.9 Å²	156.9	88%	0.88	77%	0.774	S	S	*	*			trans	-111.4	81	178.6	-75.2	173.2	0	0	0	114.3
310	I	27.4	Very low	29.6	Very low	160 Å²	160	158.8 Å²	158.8	82%	0.821	77%	0.771	S	S	*	*			trans	-94.8	125.2	159.7	-63.2	173	0	0	0	109
311	P	27.7	Very low	29.6	Very low	108 Å²	108	157.1 Å²	157.1	70%	0.701	77%	0.766	S	S	*	*			trans	-137.4	100.9	141.6	22.2	-1.1	0	0	0	114
312	I	26.3	Very low	29.4	Very low	146 Å²	146	159.4 Å²	159.4	75%	0.749	77%	0.77	S	S	*	*			trans	46.4	86.5	130	-51.3	162.9	0	0	0	117.3
313	Y	26.9	Very low	29.3	Very low	228 Å²	228	157.1 Å²	157.1	89%	0.894	77%	0.77	S	S	*	*			trans	-174.7	144	143.2	-90.9	-82.5	0	0	0	106.4
314	R	27.2	Very low	29.2	Very low	222 Å²	222	153.6 Å²	153.6	84%	0.838	76%	0.764	S	S	*	*			cis	-163.1	81.8	-17.9	-173.1	-165.3	-177.2	-178	1.3	112.5
315	R	25.7	Very low	29	Very low	223 Å²	223	152.2 Å²	152.2	84%	0.842	77%	0.767	S	S	*	*			trans	59	111.5	171.3	-77.2	-162.6	170.6	105.4	1.3	119.6
316	D	28.7	Very low	28.9	Very low	122 Å²	122	155.9 Å²	155.9	65%	0.652	77%	0.774	S	S	*	*				66.7	95.7	122.8	-44.5	-24.2	0	0	0	121.2
317	C	28.6	Very low	28.6	Very low	108 Å²	108	155.7 Å²	155.7	73%	0.73	78%	0.775	S	S	*	*			trans	-135	65.8	135.7	59.4	0	0	0	0	110.8	T319	C317-T319 PolarHBondContact O-N 3.39Å; C317-T319 VanDerWaalsContact O-N 3.08Å
318	H	28.9	Very low	28.6	Very low	156 Å²	156	156 Å²	156	72%	0.722	78%	0.776	S	S	*	*			trans	-72.2	97.6	175.1	-85.7	-85.7	0	0	0	111.7	E320	H318-E320 PolarHBondContact O-N 3.38Å
319	T	31.2	Very low	28.2	Very low	108 Å²	108	156.2 Å²	156.2	66%	0.663	78%	0.777	S	S	*	*			trans	-84.9	88.8	154.5	-58.6	0	0	0	0	108.3	C317 V321	C317-T319 PolarHBondContact O-N 3.39Å; C317-T319 VanDerWaalsContact O-N 3.08Å; T319-V321 HydrophobicContact CG2-CG2 4.22Å; T319-V321 PolarHBondContact O-N 2.83Å
320	E	27	Very low	28.3	Very low	141 Å²	141	155.6 Å²	155.6	66%	0.659	77%	0.774	S	S	*	*			trans	-65.6	99.3	167.4	-71.4	-169.8	160.5	0	0	109.5	H318 Y322	H318-E320 PolarHBondContact O-N 3.38Å; E320-Y322 PolarHBondContact O-N 3.37Å; E320-Y322 VanDerWaalsContact O-N 3.08Å
321	V	28	Very low	28.4	Very low	101 Å²	101	151.4 Å²	151.4	61%	0.612	77%	0.769	S	S	*	*			trans	-76.5	94.2	166	-177.1	0	0	0	0	107.9	T319 C323	T319-V321 HydrophobicContact CG2-CG2 4.22Å; T319-V321 PolarHBondContact O-N 2.83Å; V321-C323 VanDerWaalsContact C-N 3.27Å; V321-C323 PolarHBondContact O-N 2.92Å
322	Y	24.7	Very low	28.4	Very low	204 Å²	204	156.7 Å²	156.7	80%	0.8	78%	0.782	S	S	*	*			trans	-63.1	92.7	160	-96.2	-100	0	0	0	108.6	E320 E324	E320-Y322 PolarHBondContact O-N 3.37Å; E320-Y322 VanDerWaalsContact O-N 3.08Å; Y322-E324 PolarHBondContact O-N 2.82Å
323	C	27.5	Very low	28.6	Very low	113 Å²	113	159.1 Å²	159.1	76%	0.764	79%	0.787	S	S	*	*			trans	-81	98.5	163.7	-164.8	0	0	0	0	107.3	V321 S325	V321-C323 VanDerWaalsContact C-N 3.27Å; V321-C323 PolarHBondContact O-N 2.92Å; C323-S325 PolarHBondContact O-N 2.81Å
324	E	27.4	Very low	28.7	Very low	175 Å²	175	153.2 Å²	153.2	82%	0.818	78%	0.779	S	S	*	*			trans	-58.8	124.3	171.4	-78.1	-168.9	136	0	0	109.5	Y322 H326	Y322-E324 PolarHBondContact O-N 2.82Å; E324-H326 PolarHBondContact O-N 2.96Å; E324-H326 VanDerWaalsContact O-N 3.12Å
325	S	26.8	Very low	28.8	Very low	113 Å²	113	151.7 Å²	151.7	79%	0.79	79%	0.786	S	S	*	*			trans	-64.4	111	-180	53	0	0	0	0	110.8	C323	C323-S325 PolarHBondContact O-N 2.81Å
326	H	31	Very low	29	Very low	184 Å²	184	148.9 Å²	148.9	85%	0.852	78%	0.783	S	S	*	*			trans	-114.2	111.1	164.5	-120.3	-103	0	0	0	109.6	E324 L328	E324-H326 PolarHBondContact O-N 2.96Å; E324-H326 VanDerWaalsContact O-N 3.12Å; H326-L328 PolarHBondContact O-N 2.99Å
327	D	27.7	Very low	29.1	Very low	156 Å²	156	150.1 Å²	150.1	83%	0.834	78%	0.784	S	S	*	*			trans	-59.1	124	-178.2	-78.4	-51.5	0	0	0	112.3
328	L	32.8	Very low	29.5	Very low	151 Å²	151	156.5 Å²	156.5	79%	0.791	79%	0.793	S	S	*	*			trans	-141.5	89	161.8	-99.6	164.6	0	0	0	109.6	H326 L330	H326-L328 PolarHBondContact O-N 2.99Å; L328-L330 HydrophobicContact CD2-CD1 4.48Å; L328-L330 PolarHBondContact O-N 2.95Å
329	E	29.9	Very low	29.9	Very low	194 Å²	194	151.7 Å²	151.7	91%	0.907	77%	0.773	S	S	*	*			trans	-64.6	91.3	171.1	-72.6	-167.1	122.2	0	0	111.2
330	L	33.6	Very low	30.3	Very low	155 Å²	155	149.2 Å²	149.2	81%	0.812	76%	0.758	S	S	*	*			trans	-129.1	100.7	170.5	-84.7	171.2	0	0	0	113.2	L328	L328-L330 HydrophobicContact CD2-CD1 4.48Å; L328-L330 PolarHBondContact O-N 2.95Å
331	G	28.8	Very low	30.9	Very low	71 Å²	71	146.5 Å²	146.5	73%	0.732	75%	0.748	S	S	*	*			trans	74	84.5	137.6	0	0	0	0	0	118	K333	G331-K333 PolarHBondContact O-N 3.48Å
332	K	27.9	Very low	31.5	Very low	220 Å²	220	147.9 Å²	147.9	96%	0.957	75%	0.751	S	S	*	*			trans	-58	100.9	159.7	-68.6	175.9	178.6	173.9	0	111.3
333	K	30.3	Very low	32.3	Very low	196 Å²	196	144.9 Å²	144.9	85%	0.852	75%	0.745	S	S	*	*			trans	-150.8	137.9	161.2	-99	169.4	-172.5	178.7	0	110.5	G331	G331-K333 PolarHBondContact O-N 3.48Å
334	S	30.1	Very low	32.9	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	71%	0.714	S	S	*	*			trans	47.1	82	173.6	54.7	0	0	0	0	117.9	Q336	S334-Q336 VanDerWaalsContact C-N 3.33Å; S334-Q336 PolarHBondContact O-N 2.75Å
335	L	27.8	Very low	33.4	Very low	189 Å²	189	133 Å²	133	99%	0.99	68%	0.679	S	S	*	*			trans	-74.5	88.2	147.1	-93.6	160.4	0	0	0	108.5
336	Q	31	Very low	33.9	Very low	165 Å²	165	129.5 Å²	129.5	77%	0.771	65%	0.653	S	S	*	*			trans	-130	114	163.8	-84.7	-178.3	-43.8	0	0	108.4	S334 R338	S334-Q336 VanDerWaalsContact C-N 3.33Å; S334-Q336 PolarHBondContact O-N 2.75Å; Q336-R338 PolarHBondContact O-N 2.9Å
337	Q	30.9	Very low	34.1	Very low	147 Å²	147	124 Å²	124	69%	0.687	63%	0.63	S	S	*	*			trans	36.8	80.4	159.9	-66.6	173.9	-15.6	0	0	116
338	R	35.5	Very low	34.4	Very low	242 Å²	242	118.8 Å²	118.8	91%	0.913	60%	0.599	S	S	*	*			trans	-75.6	123.5	150.8	-67.3	-173.4	-172.1	-167.5	1.3	107.6	Q336	Q336-R338 PolarHBondContact O-N 2.9Å
339	L	38.9	Very low	34.6	Very low	55 Å²	55	118.8 Å²	118.8	29%	0.288	59%	0.588	S	S	.	*			trans	-59.3	149.1	156.3	-78.9	165.2	0	0	0	108.8	Y68 M87 I341	Y68-L339 HydrophobicContact CD1-CD1 3.93Å; Y68-L339 HydrophobicContact CD2-CD1 4.37Å; Y68-L339 HydrophobicContact CD2-CD2 3.77Å; Y68-L339 HydrophobicContact CD2-CG 4.39Å; Y68-L339 HydrophobicContact CE1-CD1 3.77Å; Y68-L339 HydrophobicContact CE1-CG 4.38Å; Y68-L339 HydrophobicContact CE2-CD1 4.22Å; Y68-L339 HydrophobicContact CE2-CD2 3.74Å; Y68-L339 HydrophobicContact CE2-CG 4.03Å; Y68-L339 HydrophobicContact CG-CD1 4.21Å; Y68-L339 HydrophobicContact CG-CD2 4.28Å; M87-L339 HydrophobicContact SD-CD1 4.01Å; L339-I341 VanDerWaalsContact C-N 3.25Å; L339-I341 PolarHBondContact O-N 2.93Å
340	P	39.3	Very low	34.7	Very low	56 Å²	56	116.7 Å²	116.7	36%	0.364	57%	0.572	S	S	.	*			trans	-71.6	85.2	170	31.5	-33.4	0	0	0	109.1	D342 E343	P340-D342 PolarHBondContact O-N 2.9Å; P340-D342 VanDerWaalsContact O-N 3.13Å; P340-E343 HydrophobicContact CB-CB 4.35Å; P340-E343 HydrophobicContact CB-CG 3.98Å; P340-E343 HydrophobicContact CG-CB 4.31Å; P340-E343 HydrophobicContact CG-CG 4.11Å; P340-E343 VanDerWaalsContact CG-OE2 3.25Å; P340-E343 WeakPolarHBondContact CG-OE2 3.16Å; P340-E343 PolarHBondContact O-N 3.32Å
341	I	39.3	Very low	34.7	Very low	85 Å²	85	112.7 Å²	112.7	44%	0.436	55%	0.551	S	S	.	*	H	α-helix	trans	-55.4	-28.3	172	-67.2	171	0	0	0	110.2	L339 E343 L344 I345	L339-I341 VanDerWaalsContact C-N 3.25Å; L339-I341 PolarHBondContact O-N 2.93Å; I341-E343 PolarHBondContact O-N 2.81Å; I341-L344 PolarHBondContact O-N 3.19Å; I341-L344 VanDerWaalsContact O-N 3.16Å; I341-I345 HydrophobicContact CG2-CD1 3.99Å; I341-I345 PolarHBondContact O-N 2.97Å
342	D	39.3	Very low	34.7	Very low	129 Å²	129	114.2 Å²	114.2	69%	0.69	55%	0.549	S	S	*	.	H	α-helix	trans	-60.6	-21.3	173.4	-55.4	-48.2	0	0	0	114.9	P340	P340-D342 PolarHBondContact O-N 2.9Å; P340-D342 VanDerWaalsContact O-N 3.13Å
343	E	41.5	Very low	34.8	Very low	142 Å²	142	109.4 Å²	109.4	66%	0.664	53%	0.53	S	S	*	.	H	α-helix	trans	-88	-18.8	176.5	-73.3	-179.1	169.2	0	0	113.1	P340 I341	P340-E343 HydrophobicContact CB-CB 4.35Å; P340-E343 HydrophobicContact CB-CG 3.98Å; P340-E343 HydrophobicContact CG-CB 4.31Å; P340-E343 HydrophobicContact CG-CG 4.11Å; P340-E343 VanDerWaalsContact CG-OE2 3.25Å; P340-E343 WeakPolarHBondContact CG-OE2 3.16Å; P340-E343 PolarHBondContact O-N 3.32Å; I341-E343 PolarHBondContact O-N 2.81Å
344	L	40.7	Very low	34.9	Very low	22 Å²	22	103.4 Å²	103.4	12%	0.115	51%	0.51	C	S	.	.	H	α-helix	trans	-93.6	-34.7	-173.7	-88.6	165.5	0	0	0	113.8	T61 L64 Y65 Y91 I341 P346	T61-L344 HydrophobicContact CG2-CD2 3.98Å; L64-L344 HydrophobicContact CD2-CD1 3.79Å; L64-L344 HydrophobicContact CD2-CD2 3.44Å; L64-L344 VanDerWaalsContact CD2-CD2 3.44Å; L64-L344 HydrophobicContact CD2-CG 3.71Å; Y65-L344 HydrophobicContact CE1-CD1 3.58Å; Y91-L344 HydrophobicContact CE2-CB 4.31Å; Y91-L344 PolarHBondContact OH-O 2.67Å; I341-L344 PolarHBondContact O-N 3.19Å; I341-L344 VanDerWaalsContact O-N 3.16Å; L344-P346 WeakPolarHBondContact O-CD 3.28Å
345	I	39	Very low	34.9	Very low	16 Å²	16	104.2 Å²	104.2	8%	0.082	50%	0.502	C	S	.	.	S	Bend	trans	-80	118.9	172.9	-54.3	170.8	0	0	0	106.6	Y91 V99 I341 I347	Y91-I345 HydrophobicContact CE2-CG1 3.71Å; V99-I345 HydrophobicContact CG2-CG2 3.94Å; I341-I345 HydrophobicContact CG2-CD1 3.99Å; I341-I345 PolarHBondContact O-N 2.97Å; I345-I347 HydrophobicContact CB-CG1 4.02Å; I345-I347 HydrophobicContact CG2-CB 4.49Å; I345-I347 HydrophobicContact CG2-CG1 3.85Å; I345-I347 PolarHBondContact O-N 3.38Å
346	P	36.7	Very low	34.8	Very low	39 Å²	39	101.1 Å²	101.1	25%	0.253	49%	0.491	S	S	.	.			trans	-65.7	87.5	153.3	1.3	16.4	0	0	0	104.6	L344 Y348	L344-P346 WeakPolarHBondContact O-CD 3.28Å; P346-Y348 WeakPolarHBondContact O-CD2 3.3Å; P346-Y348 PolarHBondContact O-N 3.4Å
347	I	36	Very low	34.8	Very low	69 Å²	69	100.7 Å²	100.7	35%	0.354	48%	0.483	S	S	.	.			trans	-60.5	114.5	173.8	-55.2	178.1	0	0	0	103.4	I345 R349	I345-I347 HydrophobicContact CB-CG1 4.02Å; I345-I347 HydrophobicContact CG2-CB 4.49Å; I345-I347 HydrophobicContact CG2-CG1 3.85Å; I345-I347 PolarHBondContact O-N 3.38Å; I347-R349 HydrophobicContact CB-CB 4.2Å; I347-R349 HydrophobicContact CG2-CB 3.77Å; I347-R349 HydrophobicContact CG2-CG 4.28Å; I347-R349 PolarHBondContact O-N 3.4Å
348	Y	33.6	Very low	34.5	Very low	47 Å²	47	97.7 Å²	97.7	18%	0.184	48%	0.478	C	S	.	.			trans	-63.2	65.5	165	-79.9	-98.3	0	0	0	107.1	V99 L141 P346 R350 E378	V99-Y348 HydrophobicContact CG1-CD2 4.49Å; L141-Y348 HydrophobicContact CD2-CD1 4.37Å; L141-Y348 HydrophobicContact CD2-CE1 3.56Å; P346-Y348 WeakPolarHBondContact O-CD2 3.3Å; P346-Y348 PolarHBondContact O-N 3.4Å; Y348-R350 PolarHBondContact O-N 3.38Å; Y348-E378 WeakPolarHBondContact CE1-O 3.43Å
349	R	35.8	Very low	34.2	Very low	151 Å²	151	94.4 Å²	94.4	57%	0.57	47%	0.473	S	S	*	.			trans	-87.8	103	-170.2	-162.9	176.8	-162.9	162	6.9	105.1	I347 D351	I347-R349 HydrophobicContact CB-CB 4.2Å; I347-R349 HydrophobicContact CG2-CB 3.77Å; I347-R349 HydrophobicContact CG2-CG 4.28Å; I347-R349 PolarHBondContact O-N 3.4Å; R349-D351 VanDerWaalsContact C-N 3.34Å; R349-D351 PolarHBondContact O-N 3.13Å
350	R	31.7	Very low	33.8	Very low	150 Å²	150	96.7 Å²	96.7	57%	0.566	49%	0.494	S	S	*	.			trans	-29.8	87.2	172.3	-166.2	-168	-152.5	110.4	-4.8	112.6	Y348 E355	Y348-R350 PolarHBondContact O-N 3.38Å; R350-E355 IonicContact CZ-OE2 3.47Å; R350-E355 IonicContact NE-OE2 2.68Å; R350-E355 PolarHBondContact NE-OE2 3.3Å; R350-E355 VanDerWaalsContact NH2-CD 3.34Å; R350-E355 IonicContact NH2-OE1 2.61Å; R350-E355 PolarHBondContact NH2-OE1 2.9Å; R350-E355 IonicContact NH2-OE2 3.57Å; R350-E355 PolarHBondContact NH2-OE2 2.94Å
351	D	33.9	Very low	33.4	Very low	71 Å²	71	101.4 Å²	101.4	38%	0.38	51%	0.51	S	S	.	.			trans	-75.1	131.8	165.1	-81.7	-14	0	0	0	107.7	R349 H353	R349-D351 VanDerWaalsContact C-N 3.34Å; R349-D351 PolarHBondContact O-N 3.13Å; D351-H353 VanDerWaalsContact C-N 3.3Å; D351-H353 PolarHBondContact O-N 2.98Å
352	C	29.2	Very low	33.4	Very low	102 Å²	102	101.8 Å²	101.8	69%	0.689	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	58.3	-157.1	-64.4	0	0	0	0	115.6
353	H	30.4	Very low	33.5	Very low	120 Å²	120	103.6 Å²	103.6	56%	0.556	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-5.5	176.3	-77.9	-78.5	0	0	0	116.3	Y278 D351	Y278-H353 AromaticContact CE2-CD2 3.75Å; Y278-H353 AromaticContact CE2-NE2 3.71Å; Y278-H353 AromaticContact CZ-NE2 3.77Å; Y278-H353 PolarHBondContact OH-NE2 2.81Å; D351-H353 VanDerWaalsContact C-N 3.3Å; D351-H353 PolarHBondContact O-N 2.98Å
354	T	33	Very low	33.8	Very low	70 Å²	70	105.3 Å²	105.3	43%	0.429	53%	0.53	S	S	.	.	S	Bend	trans	-88.5	-13.9	176.9	-45.6	0	0	0	0	113.6
355	E	28.8	Very low	33.8	Very low	122 Å²	122	110 Å²	110	57%	0.57	56%	0.555	S	S	*	*			trans	-137.8	68.5	-174.4	-72.1	177.3	149.4	0	0	113.6	R350	R350-E355 IonicContact CZ-OE2 3.47Å; R350-E355 IonicContact NE-OE2 2.68Å; R350-E355 PolarHBondContact NE-OE2 3.3Å; R350-E355 VanDerWaalsContact NH2-CD 3.34Å; R350-E355 IonicContact NH2-OE1 2.61Å; R350-E355 PolarHBondContact NH2-OE1 2.9Å; R350-E355 IonicContact NH2-OE2 3.57Å; R350-E355 PolarHBondContact NH2-OE2 2.94Å
356	V	26.2	Very low	33.3	Very low	123 Å²	123	111.8 Å²	111.8	75%	0.745	58%	0.577	S	S	*	*			trans	-122.6	75.9	135.9	-171.4	0	0	0	0	107.9	C358	V356-C358 HydrophobicContact CG1-CB 4.17Å; V356-C358 PolarHBondContact O-N 2.85Å
357	Y	30.2	Very low	33.3	Very low	156 Å²	156	120 Å²	120	61%	0.612	61%	0.609	S	S	*	*			trans	-63.3	87.8	150.5	-82.8	-86.8	0	0	0	106.8	E359	Y357-E359 PolarHBondContact O-N 3.29Å
358	C	25.6	Very low	33.4	Very low	85 Å²	85	126.5 Å²	126.5	57%	0.574	63%	0.634	S	S	*	*			trans	-65.3	108.5	172	-165.7	0	0	0	0	107.2	V356 S360	V356-C358 HydrophobicContact CG1-CB 4.17Å; V356-C358 PolarHBondContact O-N 2.85Å; C358-S360 PolarHBondContact O-N 3.18Å
359	E	28	Very low	33.5	Very low	172 Å²	172	128.2 Å²	128.2	80%	0.804	65%	0.653	S	S	*	*			trans	-63.5	92.4	-176.3	-71.8	-173.8	129.6	0	0	111.5	Y357 H361	Y357-E359 PolarHBondContact O-N 3.29Å; E359-H361 VanDerWaalsContact C-N 3.34Å; E359-H361 PolarHBondContact O-N 2.98Å; E359-H361 PolarHBondContact O-ND1 3.49Å
360	S	30.5	Very low	33.5	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	66%	0.663	S	S	*	*	S	Bend	trans	65.3	10.2	152.1	63.1	0	0	0	0	119.3	C358	C358-S360 PolarHBondContact O-N 3.18Å
361	H	31.6	Very low	34.1	Very low	154 Å²	154	129.1 Å²	129.1	71%	0.713	67%	0.674	S	S	*	*			trans	-132.3	4.2	-172.8	-67.1	91.5	0	0	0	117.9	E359 L363	E359-H361 VanDerWaalsContact C-N 3.34Å; E359-H361 PolarHBondContact O-N 2.98Å; E359-H361 PolarHBondContact O-ND1 3.49Å; H361-L363 PolarHBondContact O-N 3.41Å
362	D	38.8	Very low	35.1	Very low	94 Å²	94	130 Å²	130	50%	0.503	68%	0.676	S	S	.	*			trans	-79.5	116.3	172	-158.8	-21.2	0	0	0	111.2	E364	D362-E364 PolarHBondContact OD1-N 3.07Å; D362-E364 VanDerWaalsContact OD1-N 3.08Å
363	L	42.7	Very low	37.1	Very low	167 Å²	167	132.4 Å²	132.4	87%	0.874	67%	0.671	S	S	*	*			trans	-90	-11.9	-176.2	-77.6	161.2	0	0	0	113.2	H361	H361-L363 PolarHBondContact O-N 3.41Å
364	E	46.9	Very low	39.6	Very low	177 Å²	177	129 Å²	129	83%	0.827	66%	0.656	S	S	*	*			trans	-85.4	-13	-175.5	-67.4	-72.7	134	0	0	113	D362 G366	D362-E364 PolarHBondContact OD1-N 3.07Å; D362-E364 VanDerWaalsContact OD1-N 3.08Å; E364-G366 PolarHBondContact O-N 3.06Å
365	L	40.6	Very low	42.1	Very low	122 Å²	122	126.2 Å²	126.2	64%	0.639	64%	0.639	S	S	*	*	S	Bend	trans	-71.1	94.7	173.4	-79.5	165.3	0	0	0	111	K367	L365-K367 PolarHBondContact O-N 3.37Å
366	G	27.9	Very low	44.8	Very low	53 Å²	53	122.5 Å²	122.5	55%	0.546	62%	0.623	S	S	.	*			trans	-51	136.4	174.6	0	0	0	0	0	112.1	E364 K368	E364-G366 PolarHBondContact O-N 3.06Å; G366-K368 PolarHBondContact O-N 2.93Å
367	K	36.9	Very low	47.6	Very low	211 Å²	211	116.9 Å²	116.9	92%	0.917	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	31.9	-168.5	-59.7	-178	175.8	-178.3	0	116.5	L365	L365-K367 PolarHBondContact O-N 3.37Å
368	K	38.9	Very low	50.2	Low	206 Å²	206	111.7 Å²	111.7	90%	0.896	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	-7.7	-175.7	-71.2	-169.1	173.9	-173.7	0	115.3	G366	G366-K368 PolarHBondContact O-N 2.93Å
369	S	35.5	Very low	53.1	Low	82 Å²	82	108 Å²	108	57%	0.573	54%	0.544	S	S	*	.			trans	-101.3	23.2	176.4	63.7	0	0	0	0	113.8	Q371	S369-Q371 PolarHBondContact O-N 2.98Å; S369-Q371 VanDerWaalsContact O-N 3.13Å
370	L	36.8	Very low	56	Low	149 Å²	149	100.3 Å²	100.3	78%	0.78	51%	0.509	S	S	*	.			trans	-79.6	21.5	179.1	-109.8	169.7	0	0	0	114	Q372	L370-Q372 VanDerWaalsContact C-N 3.31Å; L370-Q372 PolarHBondContact O-N 2.87Å; L370-Q372 VanDerWaalsContact O-N 3.09Å
371	Q	44	Very low	58.7	Low	171 Å²	171	96 Å²	96	80%	0.799	48%	0.478	S	S	*	.			trans	-70.8	96.1	153.7	-83.3	175.7	-44.7	0	0	106.7	S369 R373	S369-Q371 PolarHBondContact O-N 2.98Å; S369-Q371 VanDerWaalsContact O-N 3.13Å; Q371-R373 PolarHBondContact O-N 3.44Å; Q371-R373 VanDerWaalsContact O-N 3.12Å
372	Q	54.6	Low	61.4	Low	90 Å²	90	88.9 Å²	88.9	42%	0.421	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-54.4	119.3	169.9	-74	176.1	-63.8	0	0	108	V117 L370 L374	V117-Q372 HydrophobicContact CG1-CB 4.29Å; V117-Q372 HydrophobicContact CG2-CB 3.97Å; L370-Q372 VanDerWaalsContact C-N 3.31Å; L370-Q372 PolarHBondContact O-N 2.87Å; L370-Q372 VanDerWaalsContact O-N 3.09Å; Q372-L374 PolarHBondContact O-N 3.47Å
373	R	70.5	Confident	63.6	Low	153 Å²	153	87.2 Å²	87.2	58%	0.577	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-57.4	134.7	-179.4	-65.2	173.9	93.7	143.9	2.5	108.5	D272 E273 L274 Q371	D272-R373 PolarHBondContact O-NH1 2.97Å; D272-R373 PolarHBondContact O-NH2 2.94Å; E273-R373 PolarHBondContact O-NH2 3.18Å; L274-R373 PolarHBondContact O-NH2 3.5Å; Q371-R373 PolarHBondContact O-N 3.44Å; Q371-R373 VanDerWaalsContact O-N 3.12Å
374	L	82.8	Confident	66	Low	47 Å²	47	84.2 Å²	84.2	25%	0.246	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-61.2	146.8	175.6	-61.6	-180	0	0	0	109.7	L114 E207 W208 D209 Q372	L114-L374 HydrophobicContact CD2-CD2 3.7Å; E207-L374 HydrophobicContact CG-CB 3.9Å; E207-L374 HydrophobicContact CG-CD1 4.28Å; W208-L374 WeakPolarHBondContact O-CB 3.33Å; D209-L374 HydrophobicContact CB-CD1 3.81Å; Q372-L374 PolarHBondContact O-N 3.47Å
375	P	85.3	Confident	68.2	Low	13 Å²	13	78.3 Å²	78.3	8%	0.084	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-64.7	145.1	176.6	-20.7	34	0	0	0	111.9	Q110 Q113 L114 W208	Q110-P375 HydrophobicContact CB-CB 3.71Å; Q110-P375 HydrophobicContact CB-CG 4.19Å; Q110-P375 HydrophobicContact CG-CB 3.74Å; Q113-P375 HydrophobicContact CB-CG 4.25Å; L114-P375 HydrophobicContact CD2-CG 4.36Å; L114-P375 HydrophobicContact CG-CG 4.08Å; W208-P375 HydrophobicContact CB-CB 4.5Å; W208-P375 PolarHBondContact N-O 3.35Å
376	I	85.5	Confident	70.7	Confident	44 Å²	44	76.5 Å²	76.5	23%	0.226	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.8	-175.4	-60.4	172	0	0	0	109.7	Q110 Y205 F206 E207 I275	Q110-I376 PolarHBondContact NE2-O 2.97Å; Y205-I376 HydrophobicContact CD1-CG2 4.16Å; Y205-I376 HydrophobicContact CG-CG2 4.41Å; F206-I376 CarbonylContact O-C 3.56Å; F206-I376 VanDerWaalsContact O-CA 3.31Å; F206-I376 WeakPolarHBondContact O-CA 3.44Å; E207-I376 HydrophobicContact CB-CG1 4.09Å; E207-I376 HydrophobicContact CG-CD1 4.41Å; E207-I376 HydrophobicContact CG-CG1 3.94Å; I275-I376 HydrophobicContact CD1-CD1 3.74Å; I275-I376 HydrophobicContact CD1-CG2 4.36Å; I275-I376 HydrophobicContact CG1-CD1 3.8Å
377	D	85.3	Confident	73.9	Confident	4 Å²	4	74 Å²	74	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	141.8	165.9	-72.8	-42.4	0	0	0	111.3	H106 Q110 L141 Y205 F206 W208 L379	H106-D377 IonicContact CE1-OD1 2.91Å; H106-D377 PolarHBondContact CE1-OD1 3.34Å; H106-D377 IonicContact ND1-OD1 2.87Å; H106-D377 PolarHBondContact ND1-OD1 3.02Å; H106-D377 VanDerWaalsContact ND1-OD1 3.08Å; Q110-D377 PolarHBondContact NE2-OD1 2.82Å; Q110-D377 PolarHBondContact OE1-OD1 2.9Å; Q110-D377 PolarHBondContact OE1-OD2 2.85Å; Q110-D377 VanDerWaalsContact OE1-OD2 3.11Å; L141-D377 HydrophobicContact CD2-CB 4.2Å; Y205-D377 CarbonylContact C-O 3.12Å; Y205-D377 WeakPolarHBondContact CA-O 3.21Å; Y205-D377 WeakPolarHBondContact CB-O 3.25Å; F206-D377 PolarHBondContact N-O 3.21Å; F206-D377 PolarHBondContact O-N 2.96Å; W208-D377 PolarHBondContact NE1-OD2 2.95Å; D377-L379 HydrophobicContact CB-CD2 4.18Å
378	E	84.8	Confident	76.7	Confident	48 Å²	48	66.8 Å²	66.8	22%	0.224	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	107.9	168	-179.4	171.1	-110.5	0	0	109.8	Y205 Y348 P381	Y205-E378 HydrophobicContact CD1-CB 3.74Å; Y205-E378 HydrophobicContact CD1-CG 3.99Å; Y205-E378 HydrophobicContact CE1-CB 3.59Å; Y205-E378 HydrophobicContact CE1-CG 3.47Å; Y205-E378 VanDerWaalsContact CE1-CG 3.47Å; Y205-E378 VanDerWaalsContact CE1-OE1 3.23Å; Y205-E378 WeakPolarHBondContact CE1-OE1 3.17Å; Y205-E378 VanDerWaalsContact CZ-OE1 3.29Å; Y205-E378 PolarHBondContact OH-OE1 3.32Å; Y348-E378 WeakPolarHBondContact CE1-O 3.43Å; E378-P381 HydrophobicContact CG-CB 4.46Å; E378-P381 HydrophobicContact CG-CG 4.23Å; E378-P381 WeakPolarHBondContact OE1-CA 3.16Å; E378-P381 WeakPolarHBondContact OE2-CG 3Å
379	L	88.2	Confident	79.4	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-38.2	-179.8	-51.2	-175.6	0	0	0	112	L141 L204 F206 D377 H396 Y404	L141-L379 HydrophobicContact CD1-CD2 3.67Å; L141-L379 HydrophobicContact CD2-CD2 4.23Å; L141-L379 HydrophobicContact CG-CD2 4.22Å; L204-L379 HydrophobicContact CB-CB 4.43Å; L204-L379 HydrophobicContact CD2-CB 4.37Å; L204-L379 HydrophobicContact CD2-CD1 4.02Å; L204-L379 HydrophobicContact CG-CB 4.29Å; L204-L379 HydrophobicContact CG-CD1 4.07Å; L204-L379 WeakPolarHBondContact O-CA 3.48Å; L204-L379 WeakPolarHBondContact O-CB 3.46Å; L204-L379 PolarHBondContact O-N 3.28Å; F206-L379 HydrophobicContact CB-CD1 3.98Å; F206-L379 HydrophobicContact CB-CD2 4.15Å; F206-L379 HydrophobicContact CB-CG 4.15Å; D377-L379 HydrophobicContact CB-CD2 4.18Å; L379-H396 VanDerWaalsContact CD1-CE1 3.45Å; L379-H396 WeakPolarHBondContact CD1-CE1 3.44Å; L379-Y404 HydrophobicContact CD1-CD1 3.95Å; L379-Y404 HydrophobicContact CD1-CE1 3.56Å
380	I	88.6	Confident	82.3	Confident	11 Å²	11	58.8 Å²	58.8	6%	0.056	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	113.1	176.9	-56.3	174.2	0	0	0	107.4	A144 V146 W191 F202 G203 L204	A144-I380 HydrophobicContact CB-CD1 3.74Å; A144-I380 HydrophobicContact CB-CG1 3.65Å; V146-I380 HydrophobicContact CG2-CD1 3.8Å; W191-I380 HydrophobicContact CH2-CD1 4.11Å; W191-I380 HydrophobicContact CZ2-CD1 3.57Å; F202-I380 HydrophobicContact CE1-CD1 3.96Å; G203-I380 CarbonylContact C-O 3.47Å; G203-I380 WeakPolarHBondContact CA-O 3.11Å; L204-I380 HydrophobicContact CB-CB 3.92Å; L204-I380 HydrophobicContact CB-CD1 3.97Å; L204-I380 HydrophobicContact CB-CG1 4.01Å; L204-I380 HydrophobicContact CD2-CD1 4.12Å; L204-I380 PolarHBondContact N-O 2.83Å; L204-I380 PolarHBondContact O-N 2.8Å
381	P	87.5	Confident	85.1	Confident	14 Å²	14	51.7 Å²	51.7	9%	0.091	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	150.9	174.5	-19.5	29.7	0	0	0	112.1	E378 Y383	E378-P381 HydrophobicContact CG-CB 4.46Å; E378-P381 HydrophobicContact CG-CG 4.23Å; E378-P381 WeakPolarHBondContact OE1-CA 3.16Å; E378-P381 WeakPolarHBondContact OE2-CG 3Å; P381-Y383 HydrophobicContact CB-CD2 4.24Å; P381-Y383 HydrophobicContact CB-CE2 3.86Å; P381-Y383 HydrophobicContact CG-CE2 4.26Å; P381-Y383 VanDerWaalsContact O-CD2 3.29Å; P381-Y383 WeakPolarHBondContact O-CD2 3.41Å; P381-Y383 PolarHBondContact O-N 3.3Å; P381-Y383 VanDerWaalsContact O-N 3.1Å
382	I	87.4	Confident	87.7	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	110	-179.2	-68.3	167.8	0	0	0	110.3	F202 Y205 I277 K407 D409	F202-I382 WeakPolarHBondContact O-CA 3.41Å; Y205-I382 HydrophobicContact CE2-CD1 4.14Å; Y205-I382 HydrophobicContact CE2-CG1 4.3Å; I277-I382 HydrophobicContact CB-CD1 4.25Å; I277-I382 HydrophobicContact CD1-CD1 4.31Å; I277-I382 HydrophobicContact CG1-CD1 3.86Å; I277-I382 HydrophobicContact CG2-CB 4.45Å; I277-I382 HydrophobicContact CG2-CD1 3.67Å; I277-I382 HydrophobicContact CG2-CG2 4.29Å; I382-K407 HydrophobicContact CD1-CB 3.96Å; I382-K407 HydrophobicContact CD1-CD 3.85Å; I382-K407 HydrophobicContact CG1-CB 4.47Å; I382-D409 HydrophobicContact CG2-CB 4.07Å
383	Y	85.7	Confident	89.7	Confident	60 Å²	60	41.1 Å²	41.1	24%	0.235	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	150.4	172.6	-71.8	-76.8	0	0	0	110.7	G201 F202 R280 C282 P381	G201-Y383 CarbonylContact C-O 3.55Å; G201-Y383 WeakPolarHBondContact CA-O 3.37Å; F202-Y383 PolarHBondContact N-O 3.31Å; F202-Y383 PolarHBondContact O-N 3.1Å; R280-Y383 HydrophobicContact CB-CD1 4.46Å; R280-Y383 HydrophobicContact CB-CE1 3.5Å; R280-Y383 VanDerWaalsContact CB-CE1 3.5Å; R280-Y383 VanDerWaalsContact CD-OH 3.3Å; R280-Y383 WeakPolarHBondContact CD-OH 3.31Å; R280-Y383 VanDerWaalsContact O-CD1 3.3Å; R280-Y383 WeakPolarHBondContact O-CD1 2.7Å; R280-Y383 VanDerWaalsContact O-CE1 3.22Å; R280-Y383 WeakPolarHBondContact O-CE1 3.37Å; C282-Y383 HydrophobicContact CB-CD1 4.17Å; C282-Y383 HydrophobicContact CB-CE1 4.39Å; P381-Y383 HydrophobicContact CB-CD2 4.24Å; P381-Y383 HydrophobicContact CB-CE2 3.86Å; P381-Y383 HydrophobicContact CG-CE2 4.26Å; P381-Y383 VanDerWaalsContact O-CD2 3.29Å; P381-Y383 WeakPolarHBondContact O-CD2 3.41Å; P381-Y383 PolarHBondContact O-N 3.3Å; P381-Y383 VanDerWaalsContact O-N 3.1Å
384	R	92.7	Very high	90.8	Very high	104 Å²	104	33.9 Å²	33.9	39%	0.392	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	132.5	171.6	-63.4	177.7	68.2	-167.6	-3.9	109.4	D199 F412	D199-R384 IonicContact OD1-CZ 3.62Å; D199-R384 IonicContact OD1-NH2 3.42Å; D199-R384 PolarHBondContact OD1-NH2 3.09Å; D199-R384 IonicContact OD2-CZ 2.75Å; D199-R384 IonicContact OD2-NE 3.21Å; D199-R384 PolarHBondContact OD2-NE 2.89Å; D199-R384 IonicContact OD2-NH2 2.67Å; D199-R384 PolarHBondContact OD2-NH2 2.66Å; R384-F412 HydrophobicContact CG-CE1 4.09Å; R384-F412 HydrophobicContact CG-CZ 4.14Å
385	R	91.8	Very high	91.4	Very high	53 Å²	53	33.2 Å²	33.2	20%	0.2	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.1	-178.7	-53.6	-56.1	-180	170.4	3	109.3	F193 D199 L200 F202 C387 Y392	F193-R385 HydrophobicContact CE2-CB 4.48Å; F193-R385 HydrophobicContact CZ-CG 4.33Å; D199-R385 CarbonylContact C-O 3.49Å; D199-R385 WeakPolarHBondContact CA-O 3.48Å; D199-R385 VanDerWaalsContact CB-O 3.31Å; D199-R385 WeakPolarHBondContact CB-O 3.4Å; L200-R385 PolarHBondContact N-O 2.87Å; L200-R385 PolarHBondContact O-N 3.24Å; F202-R385 HydrophobicContact CB-CG 3.79Å; R385-C387 PolarHBondContact O-N 3.18Å; R385-Y392 HydrophobicContact CB-CD1 4.15Å; R385-Y392 HydrophobicContact CB-CD2 4.28Å; R385-Y392 HydrophobicContact CB-CE1 3.87Å; R385-Y392 HydrophobicContact CB-CE2 3.99Å; R385-Y392 HydrophobicContact CB-CG 4.34Å; R385-Y392 HydrophobicContact CG-CD1 4.23Å; R385-Y392 HydrophobicContact CG-CE1 4.09Å
386	D	93.5	Very high	91.8	Very high	83 Å²	83	32.7 Å²	32.7	44%	0.444	16%	0.156	S	C	.	.			trans	-78.4	46.7	178.2	-68.5	-53.1	0	0	0	112.4	H388 T389 Y392	D386-H388 PolarHBondContact O-N 2.82Å; D386-H388 IonicContact OD1-CE1 2.84Å; D386-H388 PolarHBondContact OD1-CE1 2.88Å; D386-T389 HydrophobicContact CB-CG2 4.34Å; D386-T389 PolarHBondContact O-N 2.82Å; D386-T389 PolarHBondContact O-OG1 2.86Å; D386-Y392 PolarHBondContact N-OH 3.48Å
387	C	94.9	Very high	92	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	6.2	-175.7	59.5	0	0	0	0	114.6	I152 F193 A194 T195 R385 E390 Y392	I152-C387 WeakPolarHBondContact CD1-O 3.43Å; F193-C387 HydrophobicContact CD2-CB 3.87Å; F193-C387 HydrophobicContact CE2-CB 3.7Å; A194-C387 CarbonylContact C-O 3.47Å; A194-C387 VanDerWaalsContact CA-O 3.23Å; A194-C387 WeakPolarHBondContact CA-O 3.48Å; T195-C387 PolarHBondContact N-O 2.89Å; T195-C387 PolarHBondContact OG1-O 3.31Å; T195-C387 PolarHBondContact OG1-SG 2.86Å; R385-C387 PolarHBondContact O-N 3.18Å; C387-E390 CarbonylContact C-O 3.55Å; C387-E390 WeakPolarHBondContact CA-O 3.38Å; C387-Y392 HydrophobicContact CB-CD2 3.51Å; C387-Y392 HydrophobicContact CB-CE2 4.03Å; C387-Y392 HydrophobicContact CB-CG 4.33Å
388	H	96	Very high	92.3	Very high	60 Å²	60	34.4 Å²	34.4	28%	0.278	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-14	166.3	66	-77	0	0	0	112.8	I152 T195 D199 D386	I152-H388 WeakPolarHBondContact CD1-O 3.37Å; T195-H388 WeakPolarHBondContact O-CA 3.41Å; T195-H388 PolarHBondContact OG1-N 3.2Å; D199-H388 PolarHBondContact N-ND1 3.08Å; D386-H388 PolarHBondContact O-N 2.82Å; D386-H388 IonicContact OD1-CE1 2.84Å; D386-H388 PolarHBondContact OD1-CE1 2.88Å
389	T	96	Very high	92.4	Very high	75 Å²	75	32.1 Å²	32.1	46%	0.46	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-42	178	68.1	0	0	0	0	111.9	D386	D386-T389 HydrophobicContact CB-CG2 4.34Å; D386-T389 PolarHBondContact O-N 2.82Å; D386-T389 PolarHBondContact O-OG1 2.86Å
390	E	95.7	Very high	92.4	Very high	46 Å²	46	32.3 Å²	32.3	22%	0.215	16%	0.155	C	C	.	.	S	Bend	trans	-136.7	156.2	180	-61.2	-170.3	144.7	0	0	111.1	T148 K150 C387 Y392	T148-E390 WeakPolarHBondContact CB-OE2 3.3Å; T148-E390 HydrophobicContact CG2-CB 4.44Å; T148-E390 PolarHBondContact OG1-OE2 3.43Å; K150-E390 WeakPolarHBondContact CE-OE1 3.43Å; K150-E390 HydrophobicContact CG-CG 4.37Å; K150-E390 WeakPolarHBondContact CG-OE1 3.22Å; C387-E390 CarbonylContact C-O 3.55Å; C387-E390 WeakPolarHBondContact CA-O 3.38Å; E390-Y392 PolarHBondContact O-N 2.99Å
391	V	97.4	Very high	92.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	118.1	172.1	-171.3	0	0	0	0	108.4	T148 R149 I152 F155 E192	T148-V391 CarbonylContact C-O 3.54Å; T148-V391 VanDerWaalsContact CA-O 3.22Å; T148-V391 WeakPolarHBondContact CA-O 3.23Å; R149-V391 HydrophobicContact CB-CB 4.32Å; R149-V391 PolarHBondContact N-O 2.91Å; R149-V391 PolarHBondContact O-N 2.82Å; I152-V391 HydrophobicContact CB-CG2 4Å; I152-V391 HydrophobicContact CG1-CG2 4.27Å; F155-V391 HydrophobicContact CB-CG2 3.73Å; F155-V391 HydrophobicContact CD1-CB 4.49Å; F155-V391 HydrophobicContact CD1-CG1 3.81Å; F155-V391 HydrophobicContact CD1-CG2 3.85Å; F155-V391 HydrophobicContact CD2-CG1 4.26Å; F155-V391 HydrophobicContact CE1-CG1 3.95Å; F155-V391 HydrophobicContact CE2-CG1 4.37Å; F155-V391 HydrophobicContact CG-CG1 3.97Å; F155-V391 HydrophobicContact CG-CG2 3.9Å; F155-V391 HydrophobicContact CZ-CG1 4.22Å; E192-V391 HydrophobicContact CB-CG1 4.25Å
392	Y	97.1	Very high	92.6	Very high	38 Å²	38	33.7 Å²	33.7	15%	0.149	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.2	172.7	-84.2	-105.2	0	0	0	109.5	T148 E192 F193 R385 D386 C387 E390	T148-Y392 HydrophobicContact CG2-CD1 4.05Å; T148-Y392 HydrophobicContact CG2-CD2 4.16Å; T148-Y392 HydrophobicContact CG2-CE1 3.93Å; T148-Y392 HydrophobicContact CG2-CE2 4.07Å; T148-Y392 HydrophobicContact CG2-CG 4.18Å; E192-Y392 CarbonylContact C-O 3.6Å; E192-Y392 VanDerWaalsContact CA-O 3.28Å; E192-Y392 WeakPolarHBondContact CA-O 3.15Å; F193-Y392 HydrophobicContact CE2-CG 4.32Å; F193-Y392 VanDerWaalsContact CZ-CB 3.44Å; F193-Y392 HydrophobicContact CZ-CD1 4.46Å; F193-Y392 HydrophobicContact CZ-CG 4.01Å; F193-Y392 PolarHBondContact N-O 2.86Å; F193-Y392 PolarHBondContact O-N 2.79Å; R385-Y392 HydrophobicContact CB-CD1 4.15Å; R385-Y392 HydrophobicContact CB-CD2 4.28Å; R385-Y392 HydrophobicContact CB-CE1 3.87Å; R385-Y392 HydrophobicContact CB-CE2 3.99Å; R385-Y392 HydrophobicContact CB-CG 4.34Å; R385-Y392 HydrophobicContact CG-CD1 4.23Å; R385-Y392 HydrophobicContact CG-CE1 4.09Å; D386-Y392 PolarHBondContact N-OH 3.48Å; C387-Y392 HydrophobicContact CB-CD2 3.51Å; C387-Y392 HydrophobicContact CB-CE2 4.03Å; C387-Y392 HydrophobicContact CB-CG 4.33Å; E390-Y392 PolarHBondContact O-N 2.99Å
393	C	96.6	Very high	93	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	156.9	-175.9	-56.8	0	0	0	0	109.7	V146 W147 R149 W191 E192	V146-C393 WeakPolarHBondContact CA-O 3.49Å; W147-C393 HydrophobicContact CD2-CB 4.01Å; W147-C393 VanDerWaalsContact CE2-CB 3.48Å; W147-C393 HydrophobicContact CG-CB 4.15Å; W147-C393 HydrophobicContact CZ2-CB 3.94Å; W147-C393 PolarHBondContact N-O 3.42Å; W147-C393 VanDerWaalsContact NE1-CB 3.3Å; W147-C393 PolarHBondContact O-N 2.77Å; W147-C393 VanDerWaalsContact O-O 3.06Å; R149-C393 PolarHBondContact NE-SG 2.81Å; R149-C393 VanDerWaalsContact NE-SG 3.36Å; W191-C393 CarbonylContact O-C 3.25Å; W191-C393 VanDerWaalsContact O-CA 3.28Å; W191-C393 WeakPolarHBondContact O-CA 3.36Å; E192-C393 HydrophobicContact CG-CB 4.5Å
394	G	95.1	Very high	93.5	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	171.5	169.7	0	0	0	0	0	114.5	T145 W147 C190 W191	T145-G394 CarbonylContact O-C 3.51Å; T145-G394 WeakPolarHBondContact O-CA 3.49Å; W147-G394 VanDerWaalsContact CZ3-CA 3.48Å; C190-G394 WeakPolarHBondContact CA-O 3.41Å; W191-G394 VanDerWaalsContact CE2-CA 3.46Å; W191-G394 VanDerWaalsContact CZ2-CA 3.5Å; W191-G394 PolarHBondContact N-O 2.9Å; W191-G394 PolarHBondContact O-N 2.93Å
395	T	94.7	Very high	93.7	Very high	33 Å²	33	25.8 Å²	25.8	20%	0.202	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	152.9	172.5	-171.3	0	0	0	0	111.8	T145 W147 I189 C190 W191	T145-T395 PolarHBondContact N-O 2.87Å; T145-T395 PolarHBondContact O-N 2.89Å; W147-T395 HydrophobicContact CH2-CG2 4.03Å; W147-T395 HydrophobicContact CZ3-CG2 4Å; I189-T395 CarbonylContact O-C 3.56Å; I189-T395 WeakPolarHBondContact O-CA 3.32Å; I189-T395 WeakPolarHBondContact O-CB 3.32Å; I189-T395 PolarHBondContact O-OG1 3.27Å; C190-T395 PolarHBondContact SG-OG1 3.06Å; W191-T395 VanDerWaalsContact CZ3-C 3.45Å
396	H	93.3	Very high	94	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.009	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	128.5	174	-177.6	-95.3	0	0	0	109.5	I142 A144 A188 I189 W191 L379 Y404	I142-H396 PolarHBondContact O-CD2 2.86Å; I142-H396 PolarHBondContact O-NE2 2.59Å; A144-H396 HydrophobicContact CB-CB 4.24Å; A188-H396 CarbonylContact C-O 3.58Å; A188-H396 VanDerWaalsContact CA-O 3.28Å; A188-H396 WeakPolarHBondContact CA-O 3.36Å; A188-H396 WeakPolarHBondContact CB-O 3.3Å; I189-H396 HydrophobicContact CG2-CB 4.11Å; I189-H396 PolarHBondContact N-O 2.82Å; I189-H396 PolarHBondContact O-N 3.36Å; W191-H396 HydrophobicContact CH2-CB 4.15Å; W191-H396 HydrophobicContact CZ3-CB 3.95Å; L379-H396 VanDerWaalsContact CD1-CE1 3.45Å; L379-H396 WeakPolarHBondContact CD1-CE1 3.44Å; H396-Y404 HydrophobicContact CB-CE1 4.27Å; H396-Y404 AromaticContact ND1-CE1 3.46Å; H396-Y404 WeakPolarHBondContact ND1-CE1 3.13Å; H396-Y404 AromaticContact ND1-CZ 3.61Å; H396-Y404 PolarHBondContact ND1-OH 3.24Å
397	Q	91	Very high	94.1	Very high	66 Å²	66	19.5 Å²	19.5	31%	0.308	10%	0.104	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	144	176.8	-168.4	164	-1.8	0	0	109.9	E52 P399 Y404	E52-Q397 PolarHBondContact OE2-NE2 3.47Å; E52-Q397 PolarHBondContact OE2-OE1 2.79Å; Q397-P399 VanDerWaalsContact O-CD 3.27Å; Q397-P399 WeakPolarHBondContact O-CD 3.36Å; Q397-Y404 PolarHBondContact O-OH 3.02Å
398	Y	91.2	Very high	94.2	Very high	17 Å²	17	19.7 Å²	19.7	7%	0.067	10%	0.104	C	C	.	.			trans	-65.6	118.9	-178.6	-73.2	5.8	0	0	0	109.9	L139 T182 H183 G186 R187 I189 G400 Y404 Y426	L139-Y398 WeakPolarHBondContact CD1-O 3.47Å; T182-Y398 HydrophobicContact CG2-CD1 4.45Å; T182-Y398 HydrophobicContact CG2-CD2 4.07Å; T182-Y398 HydrophobicContact CG2-CE1 4.48Å; T182-Y398 HydrophobicContact CG2-CE2 4.12Å; T182-Y398 HydrophobicContact CG2-CG 4.23Å; H183-Y398 PolarHBondContact N-OH 3.23Å; G186-Y398 VanDerWaalsContact O-CD2 3.28Å; G186-Y398 WeakPolarHBondContact O-CD2 3.5Å; G186-Y398 WeakPolarHBondContact O-CE2 3.22Å; R187-Y398 PolarHBondContact O-N 2.83Å; I189-Y398 HydrophobicContact CB-CE1 4Å; Y398-G400 PolarHBondContact O-N 3.31Å; Y398-Y404 AromaticContact CD1-CE2 3.79Å; Y398-Y404 HydrophobicContact CD1-CE2 3.79Å; Y398-Y404 AromaticContact CE1-CE2 3.79Å; Y398-Y404 HydrophobicContact CE1-CE2 3.79Å; Y398-Y426 VanDerWaalsContact OH-CB 3.29Å; Y398-Y426 WeakPolarHBondContact OH-CB 3.31Å
399	P	86.9	Confident	94.1	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.091	C	C	.	.			trans	-77.8	-14.8	176	33.8	-34.8	0	0	0	111.9	L139 L141 F206 W208 Q397	L139-P399 WeakPolarHBondContact CB-O 3.08Å; L139-P399 PolarHBondContact N-O 3.17Å; L139-P399 VanDerWaalsContact N-O 3.12Å; L141-P399 HydrophobicContact CD1-CB 3.59Å; L141-P399 HydrophobicContact CD1-CG 3.89Å; F206-P399 HydrophobicContact CD1-CG 3.77Å; F206-P399 HydrophobicContact CD2-CG 4.1Å; F206-P399 HydrophobicContact CE1-CG 3.71Å; F206-P399 HydrophobicContact CE2-CG 4.04Å; F206-P399 HydrophobicContact CG-CG 3.97Å; F206-P399 HydrophobicContact CZ-CG 3.84Å; W208-P399 HydrophobicContact CH2-CB 3.85Å; W208-P399 HydrophobicContact CH2-CG 4.14Å; W208-P399 WeakPolarHBondContact CH2-O 3.28Å; W208-P399 HydrophobicContact CZ2-CB 4.01Å; W208-P399 HydrophobicContact CZ2-CG 4.13Å; Q397-P399 VanDerWaalsContact O-CD 3.27Å; Q397-P399 WeakPolarHBondContact O-CD 3.36Å
400	G	87.4	Confident	94	Very high	11 Å²	11	13.3 Å²	13.3	11%	0.113	7%	0.069	C	C	.	.	S	Bend	trans	169.9	-157.5	179.2	0	0	0	0	0	110.3	Y398	Y398-G400 PolarHBondContact O-N 3.31Å
401	V	89.2	Confident	93.7	Very high	53 Å²	53	12.9 Å²	12.9	32%	0.321	7%	0.071	S	C	.	.	S	Bend	trans	-86.1	138.4	172.2	-172.9	0	0	0	0	109.1	P136 T182 D209 P212	P136-V401 HydrophobicContact CG-CG2 4.21Å; T182-V401 WeakPolarHBondContact OG1-CA 3.4Å; D209-V401 CarbonylContact O-C 3.56Å; D209-V401 WeakPolarHBondContact O-CG1 3.47Å; P212-V401 HydrophobicContact CG-CG1 3.75Å
402	G	92.1	Very high	93.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.1	-155.6	-179.9	0	0	0	0	0	113.8	T182 E207 D209	T182-G402 PolarHBondContact N-O 2.7Å; T182-G402 PolarHBondContact OG1-N 3.22Å; T182-G402 PolarHBondContact OG1-O 2.68Å; E207-G402 CarbonylContact O-C 3.54Å; E207-G402 VanDerWaalsContact O-CA 3.31Å; E207-G402 WeakPolarHBondContact O-CA 3.31Å; D209-G402 WeakPolarHBondContact O-CA 3.4Å; D209-G402 PolarHBondContact O-N 3.27Å
403	V	94.8	Very high	92.5	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	119.2	-176.9	-176	0	0	0	0	109.9	R179 E207 D209 P212	R179-V403 HydrophobicContact CB-CG1 3.8Å; R179-V403 HydrophobicContact CG-CG1 4.41Å; E207-V403 HydrophobicContact CB-CB 4.42Å; E207-V403 PolarHBondContact N-O 3.28Å; E207-V403 PolarHBondContact O-N 3.01Å; D209-V403 HydrophobicContact CB-CG2 4.43Å; P212-V403 HydrophobicContact CB-CG2 3.73Å
404	Y	96.8	Very high	92.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	130.6	167.5	-74.6	-89.3	0	0	0	110.3	R179 V180 T182 I189 L204 Y205 F206 L379 H396 Q397 Y398 F406	R179-Y404 CarbonylContact C-O 3.54Å; R179-Y404 WeakPolarHBondContact CA-O 3.4Å; V180-Y404 PolarHBondContact N-O 3.06Å; V180-Y404 PolarHBondContact O-N 3.12Å; T182-Y404 HydrophobicContact CG2-CD2 4.36Å; T182-Y404 HydrophobicContact CG2-CE2 4.01Å; I189-Y404 HydrophobicContact CB-CD2 4.3Å; I189-Y404 HydrophobicContact CB-CE2 4.06Å; I189-Y404 HydrophobicContact CD1-CD1 4.41Å; I189-Y404 HydrophobicContact CD1-CD2 3.6Å; I189-Y404 HydrophobicContact CD1-CE2 4.21Å; I189-Y404 HydrophobicContact CD1-CG 3.71Å; I189-Y404 HydrophobicContact CG2-CD1 3.91Å; I189-Y404 HydrophobicContact CG2-CD2 4.22Å; I189-Y404 HydrophobicContact CG2-CE1 3.56Å; I189-Y404 HydrophobicContact CG2-CE2 3.91Å; I189-Y404 HydrophobicContact CG2-CG 4.21Å; L204-Y404 HydrophobicContact CD1-CD1 4.03Å; L204-Y404 HydrophobicContact CD2-CD1 4.26Å; L204-Y404 HydrophobicContact CG-CD1 4.3Å; Y205-Y404 WeakPolarHBondContact O-CA 3.4Å; F206-Y404 HydrophobicContact CD2-CD1 4.02Å; F206-Y404 AromaticContact CD2-CD2 4Å; F206-Y404 HydrophobicContact CD2-CD2 4Å; F206-Y404 AromaticContact CD2-CE1 3.88Å; F206-Y404 HydrophobicContact CD2-CE1 3.88Å; F206-Y404 AromaticContact CD2-CE2 3.84Å; F206-Y404 HydrophobicContact CD2-CE2 3.84Å; F206-Y404 HydrophobicContact CD2-CG 4.08Å; F206-Y404 AromaticContact CD2-CZ 3.78Å; F206-Y404 HydrophobicContact CE2-CD2 4.01Å; F206-Y404 AromaticContact CE2-CE2 3.69Å; F206-Y404 HydrophobicContact CE2-CE2 3.69Å; F206-Y404 AromaticContact CE2-CZ 3.97Å; L379-Y404 HydrophobicContact CD1-CD1 3.95Å; L379-Y404 HydrophobicContact CD1-CE1 3.56Å; H396-Y404 HydrophobicContact CB-CE1 4.27Å; H396-Y404 AromaticContact ND1-CE1 3.46Å; H396-Y404 WeakPolarHBondContact ND1-CE1 3.13Å; H396-Y404 AromaticContact ND1-CZ 3.61Å; H396-Y404 PolarHBondContact ND1-OH 3.24Å; Q397-Y404 PolarHBondContact O-OH 3.02Å; Y398-Y404 AromaticContact CD1-CE2 3.79Å; Y398-Y404 HydrophobicContact CD1-CE2 3.79Å; Y398-Y404 AromaticContact CE1-CE2 3.79Å; Y398-Y404 HydrophobicContact CE1-CE2 3.79Å; Y404-F406 HydrophobicContact CG-CE2 4.49Å
405	V	96.5	Very high	91.8	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.018	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	95.3	179.5	-173.6	0	0	0	0	108.4	T177 R179 Y205 E207 I275 K407	T177-V405 HydrophobicContact CG2-CG1 3.45Å; T177-V405 VanDerWaalsContact CG2-CG1 3.45Å; R179-V405 HydrophobicContact CG-CG2 4.45Å; Y205-V405 PolarHBondContact N-O 3.14Å; Y205-V405 PolarHBondContact O-N 3.38Å; E207-V405 HydrophobicContact CB-CG2 4.13Å; I275-V405 HydrophobicContact CD1-CG1 4.4Å; V405-K407 HydrophobicContact CG1-CG 4.41Å
406	F	97.8	Very high	91.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	120.4	174.6	-64.3	-99.6	0	0	0	108.9	T177 V178 V180 I189 W191 F202 L204 Y404 F408 I424	T177-F406 CarbonylContact C-O 3.52Å; T177-F406 VanDerWaalsContact CA-O 3.32Å; T177-F406 WeakPolarHBondContact CA-O 3.38Å; V178-F406 HydrophobicContact CB-CB 4.2Å; V178-F406 PolarHBondContact N-O 3.37Å; V178-F406 PolarHBondContact O-N 2.94Å; V180-F406 HydrophobicContact CB-CE2 4.07Å; V180-F406 HydrophobicContact CG2-CD2 3.98Å; V180-F406 HydrophobicContact CG2-CE2 3.81Å; I189-F406 HydrophobicContact CD1-CE2 3.59Å; I189-F406 HydrophobicContact CD1-CZ 3.57Å; I189-F406 HydrophobicContact CG1-CZ 4.06Å; W191-F406 HydrophobicContact CB-CD1 4.46Å; W191-F406 HydrophobicContact CB-CE1 3.61Å; W191-F406 HydrophobicContact CB-CZ 4.24Å; W191-F406 AromaticContact CD2-CE1 3.79Å; W191-F406 HydrophobicContact CD2-CE1 3.79Å; W191-F406 AromaticContact CE3-CE1 3.88Å; W191-F406 HydrophobicContact CE3-CE1 3.88Å; W191-F406 HydrophobicContact CE3-CZ 4.18Å; W191-F406 HydrophobicContact CG-CD1 4.49Å; W191-F406 AromaticContact CG-CE1 3.69Å; W191-F406 HydrophobicContact CG-CE1 3.69Å; F202-F406 AromaticContact CE2-CD1 4Å; F202-F406 HydrophobicContact CE2-CD1 4Å; F202-F406 HydrophobicContact CZ-CD1 4.09Å; L204-F406 HydrophobicContact CD1-CD1 3.59Å; L204-F406 HydrophobicContact CD1-CD2 3.95Å; L204-F406 HydrophobicContact CD1-CE1 3.59Å; L204-F406 HydrophobicContact CD1-CE2 3.96Å; L204-F406 HydrophobicContact CD1-CG 3.76Å; L204-F406 HydrophobicContact CD1-CZ 3.78Å; Y404-F406 HydrophobicContact CG-CE2 4.49Å; F406-F408 HydrophobicContact CB-CE2 3.89Å; F406-F408 HydrophobicContact CB-CZ 4.41Å; F406-I424 HydrophobicContact CD1-CD1 4.06Å; F406-I424 HydrophobicContact CD2-CD1 3.74Å; F406-I424 HydrophobicContact CE1-CD1 4.13Å; F406-I424 HydrophobicContact CE1-CG1 4.27Å; F406-I424 HydrophobicContact CE2-CD1 3.81Å; F406-I424 HydrophobicContact CE2-CG1 4.4Å; F406-I424 HydrophobicContact CE2-CG2 4.03Å; F406-I424 HydrophobicContact CG-CD1 3.89Å; F406-I424 HydrophobicContact CZ-CD1 4.01Å; F406-I424 HydrophobicContact CZ-CG1 4.17Å; F406-I424 HydrophobicContact CZ-CG2 3.89Å
407	K	96.5	Very high	91.7	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.017	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.2	176.7	-75.4	-161.7	167.4	-162.9	0	111.1	F202 G203 Y205 I275 I277 I382 V405	F202-K407 WeakPolarHBondContact CA-O 3.47Å; G203-K407 PolarHBondContact N-O 2.85Å; G203-K407 PolarHBondContact O-N 2.96Å; Y205-K407 HydrophobicContact CD2-CD 4.29Å; Y205-K407 HydrophobicContact CD2-CG 4.3Å; Y205-K407 HydrophobicContact CE2-CB 4.44Å; Y205-K407 HydrophobicContact CE2-CD 3.89Å; Y205-K407 HydrophobicContact CE2-CG 4.2Å; I275-K407 PolarHBondContact O-NZ 2.84Å; I277-K407 HydrophobicContact CG1-CD 4.39Å; I382-K407 HydrophobicContact CD1-CB 3.96Å; I382-K407 HydrophobicContact CD1-CD 3.85Å; I382-K407 HydrophobicContact CG1-CB 4.47Å; V405-K407 HydrophobicContact CG1-CG 4.41Å
408	F	96.6	Very high	91.9	Very high	3 Å²	3	32.6 Å²	32.6	1%	0.013	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	95.4	175.1	-64	-75.9	0	0	0	108.8	I170 T175 A176 V178 F193 L200 G201 F202 F406 L420	I170-F408 HydrophobicContact CD1-CB 3.6Å; T175-F408 WeakPolarHBondContact CA-O 3.26Å; A176-F408 HydrophobicContact CB-CB 4.25Å; A176-F408 PolarHBondContact N-O 2.75Å; A176-F408 PolarHBondContact O-N 3.14Å; V178-F408 HydrophobicContact CG2-CD2 4.28Å; V178-F408 HydrophobicContact CG2-CE2 3.99Å; F193-F408 HydrophobicContact CB-CE1 4.09Å; F193-F408 HydrophobicContact CD1-CE1 4.09Å; F193-F408 HydrophobicContact CD2-CE1 4.07Å; F193-F408 AromaticContact CG-CE1 3.83Å; F193-F408 HydrophobicContact CG-CE1 3.83Å; L200-F408 HydrophobicContact CD2-CB 4.09Å; L200-F408 HydrophobicContact CD2-CD1 3.93Å; L200-F408 HydrophobicContact CD2-CG 4.46Å; G201-F408 CarbonylContact O-C 3.5Å; G201-F408 WeakPolarHBondContact O-CA 3.45Å; F202-F408 AromaticContact CD2-CD1 3.86Å; F202-F408 HydrophobicContact CD2-CD1 3.86Å; F202-F408 AromaticContact CD2-CE1 3.56Å; F202-F408 HydrophobicContact CD2-CE1 3.56Å; F202-F408 HydrophobicContact CD2-CZ 4.23Å; F202-F408 HydrophobicContact CE2-CD1 4.46Å; F202-F408 AromaticContact CE2-CE1 3.8Å; F202-F408 HydrophobicContact CE2-CE1 3.8Å; F202-F408 HydrophobicContact CE2-CZ 4.02Å; F406-F408 HydrophobicContact CB-CE2 3.89Å; F406-F408 HydrophobicContact CB-CZ 4.41Å; F408-L420 HydrophobicContact CB-CD2 3.99Å; F408-L420 HydrophobicContact CD1-CD1 3.86Å; F408-L420 HydrophobicContact CD1-CD2 3.58Å; F408-L420 HydrophobicContact CD1-CG 4.4Å; F408-L420 HydrophobicContact CD2-CD2 3.55Å; F408-L420 HydrophobicContact CE1-CD1 3.83Å; F408-L420 HydrophobicContact CE1-CD2 3.85Å; F408-L420 HydrophobicContact CE1-CG 4.49Å; F408-L420 HydrophobicContact CE2-CD2 3.81Å; F408-L420 HydrophobicContact CG-CD2 3.42Å; F408-L420 VanDerWaalsContact CG-CD2 3.42Å; F408-L420 HydrophobicContact CZ-CD1 4.49Å; F408-L420 HydrophobicContact CZ-CD2 3.95Å
409	D	93.9	Very high	92.2	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.5	-170.9	-178.4	26.7	0	0	0	112	T175 L200 G201 R279 I382 S411 F412	T175-D409 PolarHBondContact OG1-OD1 2.75Å; L200-D409 VanDerWaalsContact CD1-O 3.31Å; L200-D409 WeakPolarHBondContact CD1-O 3.48Å; G201-D409 WeakPolarHBondContact CA-O 3.17Å; G201-D409 PolarHBondContact N-O 3.1Å; G201-D409 PolarHBondContact O-N 3.49Å; R279-D409 IonicContact NE-OD2 3.73Å; R279-D409 IonicContact NH2-OD2 3.2Å; I382-D409 HydrophobicContact CG2-CB 4.07Å; D409-S411 WeakPolarHBondContact OD1-CA 3.5Å; D409-S411 WeakPolarHBondContact OD1-CB 3.28Å; D409-S411 PolarHBondContact OD1-N 2.7Å; D409-S411 PolarHBondContact OD1-OG 2.83Å; D409-S411 PolarHBondContact OD2-OG 2.72Å; D409-F412 VanDerWaalsContact O-CE1 3.23Å; D409-F412 WeakPolarHBondContact O-CE1 3.11Å
410	N	93.9	Very high	92.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.176	C	C	.	.			trans	-116.2	13.3	169.5	-163.1	28.2	0	0	0	112.4	I170 S171 L173 A174 L200 F412 S413 R416 K418	I170-N410 HydrophobicContact CB-CB 4.37Å; I170-N410 HydrophobicContact CG2-CB 3.61Å; I170-N410 PolarHBondContact O-ND2 3.4Å; S171-N410 PolarHBondContact O-ND2 2.92Å; L173-N410 PolarHBondContact N-O 2.79Å; A174-N410 CarbonylContact O-C 3.47Å; A174-N410 VanDerWaalsContact O-C 3.25Å; A174-N410 VanDerWaalsContact O-CA 3.24Å; A174-N410 WeakPolarHBondContact O-CA 3.33Å; A174-N410 VanDerWaalsContact O-CB 3.29Å; A174-N410 WeakPolarHBondContact O-CB 3.43Å; A174-N410 PolarHBondContact O-N 3.21Å; L200-N410 HydrophobicContact CD1-CB 4.06Å; N410-F412 PolarHBondContact O-N 3.28Å; N410-S413 PolarHBondContact O-N 2.65Å; N410-S413 WeakPolarHBondContact OD1-CB 3.29Å; N410-R416 PolarHBondContact ND2-O 3.41Å; N410-K418 VanDerWaalsContact OD1-CD 3.28Å; N410-K418 WeakPolarHBondContact OD1-CD 3.4Å; N410-K418 WeakPolarHBondContact OD1-CE 3.23Å; N410-K418 PolarHBondContact OD1-NZ 3.06Å
411	S	87.9	Confident	93.3	Very high	37 Å²	37	38.2 Å²	38.2	26%	0.259	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-12.3	-176.5	64.5	0	0	0	0	114.4	L173 A174 R279 D409	L173-S411 WeakPolarHBondContact CD2-O 3.28Å; A174-S411 PolarHBondContact O-N 2.84Å; R279-S411 PolarHBondContact NH2-OG 3.46Å; D409-S411 WeakPolarHBondContact OD1-CA 3.5Å; D409-S411 WeakPolarHBondContact OD1-CB 3.28Å; D409-S411 PolarHBondContact OD1-N 2.7Å; D409-S411 PolarHBondContact OD1-OG 2.83Å; D409-S411 PolarHBondContact OD2-OG 2.72Å
412	F	86.6	Confident	93.7	Very high	47 Å²	47	36 Å²	36	21%	0.206	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-13.6	172.3	57.4	-91.7	0	0	0	113.8	D199 R384 D409 N410	D199-F412 WeakPolarHBondContact OD2-CE2 3.22Å; D199-F412 VanDerWaalsContact OD2-CZ 3.28Å; D199-F412 WeakPolarHBondContact OD2-CZ 2.89Å; R384-F412 HydrophobicContact CG-CE1 4.09Å; R384-F412 HydrophobicContact CG-CZ 4.14Å; D409-F412 VanDerWaalsContact O-CE1 3.23Å; D409-F412 WeakPolarHBondContact O-CE1 3.11Å; N410-F412 PolarHBondContact O-N 3.28Å
413	S	84.6	Confident	93.9	Very high	15 Å²	15	38.2 Å²	38.2	11%	0.105	17%	0.168	C	C	.	.			trans	-96.6	105	-173.8	-158.4	0	0	0	0	111.8	S172 L173 N410 R416 K418	S172-S413 CarbonylContact C-O 3.57Å; S172-S413 VanDerWaalsContact CA-O 3.3Å; S172-S413 WeakPolarHBondContact CA-O 3.49Å; S172-S413 WeakPolarHBondContact CB-O 3.14Å; L173-S413 PolarHBondContact N-O 3.24Å; N410-S413 PolarHBondContact O-N 2.65Å; N410-S413 WeakPolarHBondContact OD1-CB 3.29Å; S413-R416 WeakPolarHBondContact OG-CB 3.43Å; S413-R416 PolarHBondContact OG-N 2.94Å; S413-R416 PolarHBondContact OG-O 2.86Å; S413-R416 VanDerWaalsContact OG-O 3.14Å; S413-K418 VanDerWaalsContact CB-NZ 3.31Å; S413-K418 PolarHBondContact OG-NZ 3.35Å; S413-K418 VanDerWaalsContact OG-NZ 3.13Å
414	L	86.5	Confident	94	Very high	99 Å²	99	38.8 Å²	38.8	52%	0.518	17%	0.171	S	C	.	.	S	Bend	trans	-62.8	-43.3	175.4	-64.1	167.2	0	0	0	112.3	S172 L173	S172-L414 VanDerWaalsContact CB-O 3.24Å; S172-L414 WeakPolarHBondContact CB-O 3.35Å; L173-L414 HydrophobicContact CD2-CD2 4.19Å
415	W	88.7	Confident	94	Very high	209 Å²	209	43 Å²	43	79%	0.792	19%	0.19	S	C	*	.	S	Bend	trans	-120.4	-6.7	-164.5	-45.5	114.3	0	0	0	115.5
416	R	91.1	Very high	93.9	Very high	135 Å²	135	45.9 Å²	45.9	51%	0.509	20%	0.201	S	C	.	.			trans	-124.4	104.8	-170.9	-54.8	-61.9	-175.6	-165.1	2.8	111.6	Y198 N410 S413 K418	Y198-R416 HydrophobicContact CD2-CB 3.93Å; Y198-R416 HydrophobicContact CD2-CG 4.23Å; Y198-R416 HydrophobicContact CE1-CG 4.46Å; Y198-R416 HydrophobicContact CE2-CB 3.85Å; Y198-R416 HydrophobicContact CE2-CG 3.76Å; Y198-R416 PolarHBondContact OH-NE 3.13Å; N410-R416 PolarHBondContact ND2-O 3.41Å; S413-R416 WeakPolarHBondContact OG-CB 3.43Å; S413-R416 PolarHBondContact OG-N 2.94Å; S413-R416 PolarHBondContact OG-O 2.86Å; S413-R416 VanDerWaalsContact OG-O 3.14Å; R416-K418 PolarHBondContact O-NZ 3.49Å
417	S	95.3	Very high	93.6	Very high	44 Å²	44	48.4 Å²	48.4	31%	0.308	22%	0.216	S	C	.	.			trans	-60.4	155.2	157.9	-39.5	0	0	0	0	110.6	K169 I170	K169-S417 VanDerWaalsContact CE-OG 3.3Å; K169-S417 WeakPolarHBondContact CE-OG 3.45Å; I170-S417 CarbonylContact O-C 3.55Å; I170-S417 WeakPolarHBondContact O-CA 2.86Å; I170-S417 WeakPolarHBondContact O-CB 3.21Å
418	K	96.1	Very high	93.2	Very high	7 Å²	7	54.3 Å²	54.3	3%	0.03	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130.4	-179.8	-67	170.1	178.4	55.9	0	109.6	I170 D199 L200 N410 S413 R416	I170-K418 PolarHBondContact N-O 2.9Å; I170-K418 PolarHBondContact O-N 3.48Å; D199-K418 WeakPolarHBondContact O-CD 3.39Å; D199-K418 WeakPolarHBondContact O-CE 3.09Å; L200-K418 HydrophobicContact CB-CD 4.37Å; L200-K418 HydrophobicContact CD1-CB 4.49Å; L200-K418 HydrophobicContact CD1-CD 3.58Å; N410-K418 VanDerWaalsContact OD1-CD 3.28Å; N410-K418 WeakPolarHBondContact OD1-CD 3.4Å; N410-K418 WeakPolarHBondContact OD1-CE 3.23Å; N410-K418 PolarHBondContact OD1-NZ 3.06Å; S413-K418 VanDerWaalsContact CB-NZ 3.31Å; S413-K418 PolarHBondContact OG-NZ 3.35Å; S413-K418 VanDerWaalsContact OG-NZ 3.13Å; R416-K418 PolarHBondContact O-NZ 3.49Å
419	W	97.5	Very high	93	Very high	124 Å²	124	56.9 Å²	56.9	47%	0.47	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.8	164.6	-74.5	105.7	0	0	0	108.2	K169 T195 Y421	K169-W419 HydrophobicContact CB-CD2 4.13Å; K169-W419 HydrophobicContact CB-CE3 3.93Å; K169-W419 HydrophobicContact CB-CH2 4.03Å; K169-W419 HydrophobicContact CB-CZ2 4.22Å; K169-W419 HydrophobicContact CB-CZ3 3.89Å; K169-W419 HydrophobicContact CD-CZ2 4.42Å; T195-W419 VanDerWaalsContact CA-O 3.22Å; T195-W419 WeakPolarHBondContact CA-O 3.42Å; T195-W419 WeakPolarHBondContact CB-O 3.35Å; T195-W419 WeakPolarHBondContact CG2-O 3.4Å; W419-Y421 HydrophobicContact CB-CE2 4.11Å
420	L	97.9	Very high	93	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.9	174.9	171.6	68.4	0	0	0	108.5	C167 I168 I170 F193 T195 L200 F408 Y422	C167-L420 CarbonylContact C-O 3.51Å; C167-L420 VanDerWaalsContact CA-O 3.31Å; C167-L420 WeakPolarHBondContact CA-O 3.37Å; I168-L420 HydrophobicContact CD1-CD2 4.09Å; I168-L420 HydrophobicContact CG1-CB 4.06Å; I168-L420 HydrophobicContact CG1-CD2 4.05Å; I168-L420 HydrophobicContact CG1-CG 4.41Å; I168-L420 PolarHBondContact N-O 3.22Å; I168-L420 PolarHBondContact O-N 3.33Å; I170-L420 HydrophobicContact CD1-CB 4.18Å; I170-L420 HydrophobicContact CD1-CD2 4.08Å; I170-L420 HydrophobicContact CG1-CB 4.47Å; F193-L420 HydrophobicContact CB-CD1 3.88Å; F193-L420 HydrophobicContact CD2-CD1 4.23Å; F193-L420 HydrophobicContact CG-CD1 4.44Å; T195-L420 HydrophobicContact CG2-CD1 4.48Å; L200-L420 HydrophobicContact CD2-CD1 3.9Å; F408-L420 HydrophobicContact CB-CD2 3.99Å; F408-L420 HydrophobicContact CD1-CD1 3.86Å; F408-L420 HydrophobicContact CD1-CD2 3.58Å; F408-L420 HydrophobicContact CD1-CG 4.4Å; F408-L420 HydrophobicContact CD2-CD2 3.55Å; F408-L420 HydrophobicContact CE1-CD1 3.83Å; F408-L420 HydrophobicContact CE1-CD2 3.85Å; F408-L420 HydrophobicContact CE1-CG 4.49Å; F408-L420 HydrophobicContact CE2-CD2 3.81Å; F408-L420 HydrophobicContact CG-CD2 3.42Å; F408-L420 VanDerWaalsContact CG-CD2 3.42Å; F408-L420 HydrophobicContact CZ-CD1 4.49Å; F408-L420 HydrophobicContact CZ-CD2 3.95Å; L420-Y422 HydrophobicContact CD2-CD1 4.25Å; L420-Y422 HydrophobicContact CG-CD1 4.37Å
421	Y	98.4	Very high	92.9	Very high	21 Å²	21	63.2 Å²	63.2	8%	0.082	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.8	166.5	-57.3	-100.1	0	0	0	106.4	K156 I159 L160 C167 F193 A194 D196 W419	K156-Y421 HydrophobicContact CB-CD1 4.07Å; K156-Y421 HydrophobicContact CB-CE1 4.09Å; K156-Y421 HydrophobicContact CB-CG 4.39Å; K156-Y421 HydrophobicContact CD-CD2 4.16Å; K156-Y421 HydrophobicContact CD-CE2 3.99Å; K156-Y421 HydrophobicContact CG-CD1 4.02Å; K156-Y421 HydrophobicContact CG-CD2 3.85Å; K156-Y421 HydrophobicContact CG-CE1 4.21Å; K156-Y421 HydrophobicContact CG-CE2 4.07Å; K156-Y421 HydrophobicContact CG-CG 3.84Å; I159-Y421 HydrophobicContact CB-CD1 4.27Å; I159-Y421 HydrophobicContact CG2-CD1 4.18Å; L160-Y421 HydrophobicContact CD1-CE1 3.91Å; L160-Y421 HydrophobicContact CD2-CE1 3.92Å; L160-Y421 HydrophobicContact CG-CD1 4.41Å; L160-Y421 HydrophobicContact CG-CE1 3.75Å; C167-Y421 HydrophobicContact CB-CD1 4.2Å; C167-Y421 HydrophobicContact CB-CE1 4.37Å; C167-Y421 VanDerWaalsContact SG-CE1 3.58Å; F193-Y421 CarbonylContact C-O 3.59Å; F193-Y421 WeakPolarHBondContact CA-O 2.9Å; F193-Y421 WeakPolarHBondContact CB-O 3.15Å; A194-Y421 PolarHBondContact N-O 3.3Å; A194-Y421 PolarHBondContact O-N 3.07Å; D196-Y421 WeakPolarHBondContact OD1-CE2 3.28Å; D196-Y421 PolarHBondContact OD2-OH 3.47Å; W419-Y421 HydrophobicContact CB-CE2 4.11Å
422	Y	98.2	Very high	93.2	Very high	7 Å²	7	64.7 Å²	64.7	3%	0.027	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.6	179.7	77.9	-83.5	0	0	0	112.1	C166 I168 V178 E192 K263 L420 I424	C166-Y422 HydrophobicContact CB-CD1 4.19Å; C166-Y422 HydrophobicContact CB-CE1 3.99Å; C166-Y422 HydrophobicContact CB-CE2 4.46Å; C166-Y422 HydrophobicContact CB-CG 4.49Å; C166-Y422 WeakPolarHBondContact CB-O 3.36Å; C166-Y422 WeakPolarHBondContact O-CD1 3.5Å; C166-Y422 PolarHBondContact O-N 3.05Å; I168-Y422 HydrophobicContact CD1-CE1 4.39Å; I168-Y422 HydrophobicContact CG1-CE1 4.44Å; I168-Y422 HydrophobicContact CG2-CE1 4.34Å; V178-Y422 HydrophobicContact CG1-CE2 4.27Å; V178-Y422 HydrophobicContact CG2-CE2 4.3Å; E192-Y422 CarbonylContact O-C 3.45Å; E192-Y422 VanDerWaalsContact O-CA 3.26Å; E192-Y422 WeakPolarHBondContact O-CA 3.45Å; K263-Y422 PolarHBondContact NZ-OH 3.03Å; L420-Y422 HydrophobicContact CD2-CD1 4.25Å; L420-Y422 HydrophobicContact CG-CD1 4.37Å; Y422-I424 HydrophobicContact CD2-CD1 3.84Å; Y422-I424 HydrophobicContact CD2-CG1 4.05Å; Y422-I424 HydrophobicContact CE2-CD1 4.01Å
423	R	97	Very high	93.6	Very high	46 Å²	46	65.8 Å²	65.8	17%	0.174	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	133.5	167.9	173.5	162.4	63.1	-165.5	-5.4	108.1	F155 E158 I159 W191 E192 F425	F155-R423 HydrophobicContact CE2-CB 4.36Å; E158-R423 IonicContact OE1-CZ 3.13Å; E158-R423 IonicContact OE1-NH1 2.71Å; E158-R423 PolarHBondContact OE1-NH1 2.9Å; E158-R423 IonicContact OE1-NH2 3.07Å; E158-R423 IonicContact OE2-CZ 2.62Å; E158-R423 IonicContact OE2-NH1 3.54Å; E158-R423 PolarHBondContact OE2-NH1 3.38Å; E158-R423 IonicContact OE2-NH2 3.89Å; E158-R423 PolarHBondContact OE2-NH2 3.48Å; I159-R423 HydrophobicContact CD1-CB 3.91Å; W191-R423 CarbonylContact C-O 3.52Å; W191-R423 VanDerWaalsContact CA-O 3.3Å; W191-R423 WeakPolarHBondContact CA-O 3.28Å; E192-R423 PolarHBondContact N-O 3.19Å; E192-R423 PolarHBondContact O-N 2.97Å; E192-R423 IonicContact OE2-CZ 3.37Å; E192-R423 IonicContact OE2-NE 3.61Å; E192-R423 PolarHBondContact OE2-NE 3.41Å; E192-R423 IonicContact OE2-NH2 3.08Å; E192-R423 PolarHBondContact OE2-NH2 3.46Å; R423-F425 HydrophobicContact CG-CD1 3.98Å; R423-F425 HydrophobicContact CG-CE1 4.37Å
424	I	97.1	Very high	94.2	Very high	12 Å²	12	69.2 Å²	69.2	6%	0.062	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	133.3	177.1	-59.8	161.3	0	0	0	107.7	V178 V180 I189 C190 W191 F406 Y422	V178-I424 HydrophobicContact CB-CD1 4.43Å; V178-I424 HydrophobicContact CG1-CD1 4.01Å; V180-I424 HydrophobicContact CG1-CG2 4.2Å; V180-I424 HydrophobicContact CG2-CD1 4.04Å; V180-I424 HydrophobicContact CG2-CG2 4.08Å; I189-I424 HydrophobicContact CD1-CG2 3.74Å; I189-I424 HydrophobicContact CG1-CG2 3.77Å; C190-I424 WeakPolarHBondContact O-CA 3.44Å; W191-I424 HydrophobicContact CB-CG1 3.99Å; F406-I424 HydrophobicContact CD1-CD1 4.06Å; F406-I424 HydrophobicContact CD2-CD1 3.74Å; F406-I424 HydrophobicContact CE1-CD1 4.13Å; F406-I424 HydrophobicContact CE1-CG1 4.27Å; F406-I424 HydrophobicContact CE2-CD1 3.81Å; F406-I424 HydrophobicContact CE2-CG1 4.4Å; F406-I424 HydrophobicContact CE2-CG2 4.03Å; F406-I424 HydrophobicContact CG-CD1 3.89Å; F406-I424 HydrophobicContact CZ-CD1 4.01Å; F406-I424 HydrophobicContact CZ-CG1 4.17Å; F406-I424 HydrophobicContact CZ-CG2 3.89Å; Y422-I424 HydrophobicContact CD2-CD1 3.84Å; Y422-I424 HydrophobicContact CD2-CG1 4.05Å; Y422-I424 HydrophobicContact CE2-CD1 4.01Å
425	F	95	Very high	94.8	Very high	88 Å²	88	67.1 Å²	67.1	39%	0.386	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	166	-178.3	55.9	-80	0	0	0	110	C190 R423 T427	C190-F425 HydrophobicContact CB-CD1 4.14Å; C190-F425 HydrophobicContact CB-CD2 3.79Å; C190-F425 HydrophobicContact CB-CE1 3.77Å; C190-F425 HydrophobicContact CB-CE2 3.38Å; C190-F425 HydrophobicContact CB-CG 4.16Å; C190-F425 HydrophobicContact CB-CZ 3.37Å; C190-F425 PolarHBondContact N-O 3.23Å; C190-F425 PolarHBondContact O-N 3.12Å; R423-F425 HydrophobicContact CG-CD1 3.98Å; R423-F425 HydrophobicContact CG-CE1 4.37Å; F425-T427 HydrophobicContact CE2-CG2 4.45Å
426	Y	94.8	Very high	95.2	Very high	64 Å²	64	56.2 Å²	56.2	25%	0.251	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	157.3	172.7	65.2	-98.2	0	0	0	110.6	H183 A188 Y398 H428	H183-Y426 HydrophobicContact CB-CD1 3.7Å; H183-Y426 HydrophobicContact CB-CD2 4.43Å; H183-Y426 HydrophobicContact CB-CE1 3.83Å; H183-Y426 HydrophobicContact CB-CG 4.04Å; H183-Y426 AromaticContact CE1-CZ 3.75Å; H183-Y426 PolarHBondContact CE1-OH 2.97Å; H183-Y426 AromaticContact CG-CE1 3.61Å; H183-Y426 AromaticContact CG-CZ 3.75Å; H183-Y426 AromaticContact ND1-CE1 3.77Å; H183-Y426 AromaticContact ND1-CE2 3.63Å; H183-Y426 AromaticContact ND1-CZ 3.39Å; A188-Y426 CarbonylContact O-C 3.47Å; A188-Y426 WeakPolarHBondContact O-CA 3.38Å; A188-Y426 WeakPolarHBondContact O-CB 3.37Å; Y398-Y426 VanDerWaalsContact OH-CB 3.29Å; Y398-Y426 WeakPolarHBondContact OH-CB 3.31Å; Y426-H428 AromaticContact CE2-CE1 3.63Å; Y426-H428 AromaticContact CE2-NE2 3.72Å
427	T	92.2	Very high	95.6	Very high	54 Å²	54	49.6 Å²	49.6	33%	0.331	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	160.2	171.1	64.4	0	0	0	0	110.9	G186 R187 A188 F425	G186-T427 CarbonylContact C-O 3.45Å; G186-T427 WeakPolarHBondContact CA-O 3.28Å; R187-T427 PolarHBondContact N-O 2.84Å; A188-T427 PolarHBondContact O-N 2.91Å; F425-T427 HydrophobicContact CE2-CG2 4.45Å
428	H	87.7	Confident	95.6	Very high	128 Å²	128	50.1 Å²	50.1	59%	0.593	22%	0.219	S	C	*	.			trans	-97.1	0	178.9	-70.4	-67.3	0	0	0	112.6	N185 R187 Y426	N185-H428 PolarHBondContact O-CE1 3.28Å; N185-H428 PolarHBondContact O-ND1 2.79Å; R187-H428 WeakPolarHBondContact CD-OXT 3.25Å; R187-H428 WeakPolarHBondContact CG-OXT 3.34Å; R187-H428 VanDerWaalsContact CZ-OXT 3.3Å; R187-H428 PolarHBondContact NE-OXT 2.72Å; R187-H428 PolarHBondContact NH1-OXT 3.47Å; Y426-H428 AromaticContact CE2-CE1 3.63Å; Y426-H428 AromaticContact CE2-NE2 3.72Å

Retrieved 428 of 428 residues in 120.8 ms (Link to these results)

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