A0A087X0A2_HUMAN Loading...

Zinc finger protein 254

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087X0A2, Species HUMAN (Homo sapiens, Human), Gene ZNF254, Length 586 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.3	Very low	28.2	Very low	232 Å²	232	171.1 Å²	171.1	100%	1.143	85%	0.848	S	S	*	*				0	121.7	0	-108.2	-174.3	170.6	0	0	108.6
2	K	31.5	Very low	28.2	Very low	207 Å²	207	163.6 Å²	163.6	90%	0.9	85%	0.847	S	S	*	*			trans	59.3	159.3	171.5	-54.2	176.3	-179.9	177.4	0	116.4
3	R	26	Very low	28	Very low	240 Å²	240	165.4 Å²	165.4	91%	0.906	85%	0.852	S	S	*	*			cis	-155.5	151.2	-47.5	172.8	178.1	-88.3	-143.5	0.8	105.9
4	H	26	Very low	27.7	Very low	175 Å²	175	160.2 Å²	160.2	81%	0.81	84%	0.836	S	S	*	*			trans	-70.5	177.9	179.5	-99.1	-98.9	0	0	0	115.6
5	E	27.4	Very low	27.7	Very low	177 Å²	177	157.9 Å²	157.9	83%	0.827	84%	0.835	S	S	*	*			trans	92.1	105.7	164.5	-55.5	-179.1	159.7	0	0	114.8
6	M	27.7	Very low	27.7	Very low	153 Å²	153	158.1 Å²	158.1	75%	0.754	83%	0.829	S	S	*	*				73.7	110.1	65.1	-71.6	-171.3	85.4	0	0	114.4
7	V	27.3	Very low	27.6	Very low	145 Å²	145	161.1 Å²	161.1	88%	0.879	84%	0.835	S	S	*	*			trans	-134.2	126.8	148.8	176.7	0	0	0	0	106.4
8	D	25.5	Very low	27.4	Very low	128 Å²	128	157 Å²	157	68%	0.684	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-72.9	133.4	-171.4	-59.1	-76.7	0	0	0	113.7
9	E	28.1	Very low	27.6	Very low	186 Å²	186	158.9 Å²	158.9	87%	0.869	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-79.1	127.6	158.7	-73	-169.7	133	0	0	109.8
10	P	29.5	Very low	27.8	Very low	121 Å²	121	158.9 Å²	158.9	79%	0.786	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-71.4	130.1	178.9	27.5	-33	0	0	0	111.2
11	P	30.4	Very low	27.9	Very low	118 Å²	118	157.9 Å²	157.9	77%	0.766	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-67.6	137.7	-175.4	26	-34.3	0	0	0	112.4	M13	P11-M13 PolarHBondContact O-N 3.22Å
12	G	28.2	Very low	27.6	Very low	81 Å²	81	157.4 Å²	157.4	84%	0.835	81%	0.813	S	S	*	*			trans	-56.5	109	-177.2	0	0	0	0	0	113.7	C14	G12-C14 PolarHBondContact O-N 2.95Å; G12-C14 VanDerWaalsContact O-N 3.13Å
13	M	25.7	Very low	27.4	Very low	187 Å²	187	152.8 Å²	152.8	92%	0.921	80%	0.804	S	S	*	*			trans	-67.6	107.6	175.2	-80.3	-108.1	-179.2	0	0	111.3	P11 P15	P11-M13 PolarHBondContact O-N 3.22Å; M13-P15 WeakPolarHBondContact O-CD 3.08Å
14	C	24.1	Very low	27.4	Very low	93 Å²	93	150.3 Å²	150.3	63%	0.628	80%	0.803	S	S	*	*			trans	-74.1	117.5	174.7	-171.9	0	0	0	0	111.4	G12 H16	G12-C14 PolarHBondContact O-N 2.95Å; G12-C14 VanDerWaalsContact O-N 3.13Å; C14-H16 VanDerWaalsContact C-N 3.32Å; C14-H16 PolarHBondContact O-N 3.21Å; C14-H16 PolarHBondContact SG-CD2 2.96Å
15	P	27.3	Very low	27.9	Very low	125 Å²	125	151.8 Å²	151.8	81%	0.812	81%	0.81	S	S	*	*			trans	-85.9	64.2	-174.8	35.1	-35.4	0	0	0	112.8	M13 F17	M13-P15 WeakPolarHBondContact O-CD 3.08Å; P15-F17 PolarHBondContact O-N 2.71Å
16	H	27.9	Very low	28.2	Very low	162 Å²	162	146.6 Å²	146.6	75%	0.75	80%	0.804	S	S	*	*			trans	-91.6	60.8	174.3	-83.4	-46.1	0	0	0	113.7	C14	C14-H16 VanDerWaalsContact C-N 3.32Å; C14-H16 PolarHBondContact O-N 3.21Å; C14-H16 PolarHBondContact SG-CD2 2.96Å
17	F	24.7	Very low	28.4	Very low	209 Å²	209	146.9 Å²	146.9	92%	0.917	81%	0.805	S	S	*	*	S	Bend	trans	-176	127.2	156.2	-96.8	-72.4	0	0	0	107.2	P15	P15-F17 PolarHBondContact O-N 2.71Å
18	A	25.5	Very low	28.6	Very low	87 Å²	87	147.8 Å²	147.8	72%	0.719	80%	0.8	S	S	*	*			cis	-144.1	123.1	4.8	0	0	0	0	0	111.6	D20	A18-D20 PolarHBondContact O-N 2.81Å
19	Q	29.6	Very low	29	Very low	193 Å²	193	147 Å²	147	90%	0.902	80%	0.796	S	S	*	*			trans	-75.2	107	154.8	-73.5	169	-32.5	0	0	107.8
20	D	31.8	Very low	29.3	Very low	158 Å²	158	142 Å²	142	85%	0.845	78%	0.782	S	S	*	*			trans	-175.8	57.1	158.7	-101.6	-20	0	0	0	110.8	A18	A18-D20 PolarHBondContact O-N 2.81Å
21	L	31.2	Very low	29.4	Very low	138 Å²	138	142.8 Å²	142.8	72%	0.723	77%	0.773	S	S	*	*			trans	-152.2	46.8	170.5	-109.4	-175.3	0	0	0	114.1	M410	L21-M410 HydrophobicContact CD1-CE 4.4Å
22	W	23.9	Very low	29.6	Very low	223 Å²	223	143.6 Å²	143.6	85%	0.845	77%	0.767	S	S	*	*			trans	-122.8	125.5	163.2	-81.3	64.7	0	0	0	109.5
23	P	28.2	Very low	29.8	Very low	110 Å²	110	146.1 Å²	146.1	71%	0.714	76%	0.755	S	S	*	*			trans	-74.2	120	157.8	-1	18.8	0	0	0	107.7
24	E	26.1	Very low	30	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	74%	0.735	S	S	*	*			trans	-61.9	138.1	167	-74.1	-176.6	144.3	0	0	110.1	G26	E24-G26 VanDerWaalsContact C-N 3.31Å; E24-G26 PolarHBondContact O-N 2.87Å
25	Q	36.2	Very low	30.4	Very low	206 Å²	206	141.3 Å²	141.3	96%	0.963	73%	0.734	S	S	*	*	S	Bend	trans	-80.3	76.4	-171	-165.8	141.6	-46.5	0	0	110.7
26	G	34.1	Very low	30.6	Very low	68 Å²	68	141.6 Å²	141.6	70%	0.701	73%	0.728	S	S	*	*	S	Bend	trans	-174.8	18.3	-173.3	0	0	0	0	0	120	E24	E24-G26 VanDerWaalsContact C-N 3.31Å; E24-G26 PolarHBondContact O-N 2.87Å
27	M	30.4	Very low	30.7	Very low	158 Å²	158	145 Å²	145	78%	0.778	73%	0.734	S	S	*	*			trans	-149.4	24.8	174.7	-98.4	-147.3	-69.2	0	0	117	D29	M27-D29 VanDerWaalsContact C-N 3.29Å; M27-D29 PolarHBondContact O-N 3.4Å
28	E	32.4	Very low	31.1	Very low	165 Å²	165	143.7 Å²	143.7	77%	0.771	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-18.1	-178.2	-154.2	71.2	-147.8	0	0	114
29	D	34.5	Very low	31.3	Very low	111 Å²	111	150 Å²	150	59%	0.594	73%	0.73	S	S	*	*	H	α-helix	trans	-93	-9.4	-167.9	-149	61	0	0	0	115.5	M27 K33	M27-D29 VanDerWaalsContact C-N 3.29Å; M27-D29 PolarHBondContact O-N 3.4Å; D29-K33 IonicContact OD2-NZ 2.82Å; D29-K33 PolarHBondContact OD2-NZ 3.39Å
30	S	34.3	Very low	31.4	Very low	81 Å²	81	143.8 Å²	143.8	57%	0.566	72%	0.717	S	S	*	*	H	α-helix	trans	-89.6	-28.2	-179.5	-58.6	0	0	0	0	113.3
31	F	30	Very low	31.4	Very low	138 Å²	138	145.5 Å²	145.5	61%	0.605	72%	0.717	S	S	*	*	H	α-helix	trans	-79.3	-31.2	-174.7	-116.9	-90.5	0	0	0	113.5
32	Q	34.3	Very low	31.2	Very low	135 Å²	135	150.7 Å²	150.7	63%	0.631	73%	0.729	S	S	*	*	H	α-helix	trans	-70.8	-35.5	175.5	-66.6	-158.7	6.2	0	0	112.7	A34 I35 L36	Q32-A34 VanDerWaalsContact C-N 3.29Å; Q32-A34 PolarHBondContact O-N 3.26Å; Q32-I35 PolarHBondContact O-N 3.06Å; Q32-L36 PolarHBondContact O-N 3.2Å
33	K	33.2	Very low	31.3	Very low	134 Å²	134	143.5 Å²	143.5	58%	0.583	72%	0.724	S	S	*	*	H	α-helix	trans	-64.2	-30	176.9	-78.2	168.3	177.2	145.1	0	113	D29 R37	D29-K33 IonicContact OD2-NZ 2.82Å; D29-K33 PolarHBondContact OD2-NZ 3.39Å; K33-R37 PolarHBondContact O-N 3.17Å
34	A	31	Very low	31.3	Very low	63 Å²	63	147.1 Å²	147.1	52%	0.521	73%	0.731	S	S	.	*	H	α-helix	trans	-71	-39.5	176.9	0	0	0	0	0	113.1	Q32 R37	Q32-A34 VanDerWaalsContact C-N 3.29Å; Q32-A34 PolarHBondContact O-N 3.26Å; A34-R37 PolarHBondContact O-N 3.2Å
35	I	30.9	Very low	31.2	Very low	116 Å²	116	146.8 Å²	146.8	60%	0.595	73%	0.729	S	S	*	*	H	α-helix	trans	-72.4	-37.1	179.1	-63.7	178.1	0	0	0	110.9	Q32 R37 R38	Q32-I35 PolarHBondContact O-N 3.06Å; I35-R37 VanDerWaalsContact C-N 3.29Å; I35-R37 PolarHBondContact O-N 3.06Å; I35-R38 PolarHBondContact O-N 3.13Å
36	L	31.9	Very low	30.7	Very low	130 Å²	130	143.7 Å²	143.7	68%	0.681	72%	0.72	S	S	*	*	H	α-helix	trans	-67.6	-22.9	177.2	-78.6	164	0	0	0	114	Q32 R38	Q32-L36 PolarHBondContact O-N 3.2Å; L36-R38 PolarHBondContact O-N 3.32Å
37	R	30.7	Very low	30.4	Very low	234 Å²	234	149 Å²	149	88%	0.883	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-15.8	175.2	-93.6	-168	176.6	-158.7	0.6	115	K33 A34 I35	K33-R37 PolarHBondContact O-N 3.17Å; A34-R37 PolarHBondContact O-N 3.2Å; I35-R37 VanDerWaalsContact C-N 3.29Å; I35-R37 PolarHBondContact O-N 3.06Å
38	R	32.4	Very low	30.2	Very low	182 Å²	182	150.1 Å²	150.1	69%	0.687	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	2.3	-175.4	-152.8	173.5	-91.2	-170.3	-4.2	114.4	I35 L36 E470	I35-R38 PolarHBondContact O-N 3.13Å; L36-R38 PolarHBondContact O-N 3.32Å; R38-E470 IonicContact NH2-OE1 3.34Å; R38-E470 PolarHBondContact NH2-OE1 2.85Å; R38-E470 IonicContact NH2-OE2 2.67Å; R38-E470 PolarHBondContact NH2-OE2 2.93Å; R38-E470 VanDerWaalsContact NH2-OE2 3.1Å
39	Y	30.5	Very low	29.8	Very low	219 Å²	219	151 Å²	151	86%	0.859	74%	0.743	S	S	*	*	S	Bend	trans	-119.8	21.4	174.1	-85.8	-78.6	0	0	0	113.7
40	G	32.2	Very low	29.3	Very low	62 Å²	62	157 Å²	157	64%	0.639	76%	0.758	S	S	*	*	S	Bend	trans	-111.6	7.9	-177	0	0	0	0	0	116.1
41	K	31.2	Very low	29	Very low	194 Å²	194	163 Å²	163	84%	0.843	77%	0.773	S	S	*	*	S	Bend	trans	-145.7	90.6	176.7	-74.8	-167.5	176.2	-169.3	0	110.4
42	Y	26.4	Very low	28.7	Very low	247 Å²	247	160 Å²	160	97%	0.969	78%	0.782	S	S	*	*			trans	-175.8	88.1	145.6	-92.4	-61.3	0	0	0	106.8
43	G	25.6	Very low	28.2	Very low	72 Å²	72	159.3 Å²	159.3	74%	0.742	79%	0.791	S	S	*	*			trans	-114.6	112.7	169	0	0	0	0	0	108.2
44	H	28.5	Very low	27.8	Very low	186 Å²	186	161.9 Å²	161.9	86%	0.861	80%	0.802	S	S	*	*			trans	27.6	120.7	162.4	-92.3	-98.4	0	0	0	119.7
45	E	25.4	Very low	27.6	Very low	181 Å²	181	163.3 Å²	163.3	85%	0.846	81%	0.808	S	S	*	*				-153.6	142.8	120.5	-114.1	164.5	-145.8	0	0	112.5
46	N	25.9	Very low	27.3	Very low	142 Å²	142	163.7 Å²	163.7	76%	0.759	82%	0.816	S	S	*	*			trans	10.3	121.1	171.7	-61.9	-56.1	0	0	0	121.8
47	L	27.1	Very low	27	Very low	179 Å²	179	164 Å²	164	94%	0.937	82%	0.818	S	S	*	*			trans	-147.5	130.9	141.5	-116.5	152.7	0	0	0	110.4
48	Q	25.8	Very low	26.8	Very low	182 Å²	182	158 Å²	158	85%	0.85	80%	0.8	S	S	*	*			trans	-75.9	139	-171.8	-62.9	-176	-2.3	0	0	112.2
49	L	25	Very low	26.4	Very low	182 Å²	182	159.9 Å²	159.9	95%	0.953	81%	0.808	S	S	*	*			trans	-97.4	102.2	166.4	-83.7	165.7	0	0	0	110.4
50	R	23.6	Very low	26.1	Very low	238 Å²	238	156.3 Å²	156.3	90%	0.898	80%	0.797	S	S	*	*			trans	-100.2	142	167.3	-160.9	176.7	-173.5	-160.1	2.1	110
51	K	27	Very low	25.8	Very low	206 Å²	206	158.7 Å²	158.7	90%	0.896	80%	0.8	S	S	*	*			trans	-60.1	152.7	-174.6	-54.6	167.8	178.7	177.4	0	113.4
52	G	24.1	Very low	25.5	Very low	77 Å²	77	156.1 Å²	156.1	79%	0.794	80%	0.795	S	S	*	*			trans	172.5	54.1	167.1	0	0	0	0	0	121
53	C	24.2	Very low	25.5	Very low	120 Å²	120	153.7 Å²	153.7	81%	0.811	79%	0.789	S	S	*	*			trans	12.3	158.6	151.6	-147.5	0	0	0	0	124.9
54	K	24.3	Very low	25.4	Very low	187 Å²	187	159.6 Å²	159.6	81%	0.813	80%	0.797	S	S	*	*			trans	88.5	142.8	162	-57.4	-175.8	-177.7	-176.1	0	117.2
55	S	26.5	Very low	25.1	Very low	93 Å²	93	153.9 Å²	153.9	65%	0.65	79%	0.789	S	S	*	*			cis	172.1	-169.2	-27.9	51.2	0	0	0	0	106.5
56	V	24.9	Very low	25.1	Very low	125 Å²	125	156.5 Å²	156.5	76%	0.758	79%	0.793	S	S	*	*			trans	86.2	131.7	178.3	-169.5	0	0	0	0	114.8
57	D	25.4	Very low	25	Very low	137 Å²	137	157.8 Å²	157.8	73%	0.733	80%	0.8	S	S	*	*			cis	160.4	154.7	-47.7	-74.2	-34.2	0	0	0	107.2
58	E	26.4	Very low	24.8	Very low	107 Å²	107	152.8 Å²	152.8	50%	0.5	79%	0.791	S	S	.	*			cis	-151.4	171.5	-2.9	-148.7	-145.7	-120.8	0	0	109.3	K60	E58-K60 WeakPolarHBondContact OE1-CD 3.35Å; E58-K60 WeakPolarHBondContact OE1-CE 3.14Å; E58-K60 IonicContact OE1-NZ 2.79Å; E58-K60 PolarHBondContact OE1-NZ 3.19Å; E58-K60 VanDerWaalsContact OE2-CG 3.23Å; E58-K60 WeakPolarHBondContact OE2-CG 3.35Å; E58-K60 PolarHBondContact OE2-N 3.25Å
59	Y	23.7	Very low	24.8	Very low	221 Å²	221	152.2 Å²	152.2	87%	0.867	79%	0.794	S	S	*	*				-165.5	117	126.1	-128.1	-98	0	0	0	113.4
60	K	24.6	Very low	24.7	Very low	144 Å²	144	149.6 Å²	149.6	63%	0.626	78%	0.78	S	S	*	*			trans	-66.8	173.2	166.9	-74.3	162.8	175.9	133.2	0	111.6	E58	E58-K60 WeakPolarHBondContact OE1-CD 3.35Å; E58-K60 WeakPolarHBondContact OE1-CE 3.14Å; E58-K60 IonicContact OE1-NZ 2.79Å; E58-K60 PolarHBondContact OE1-NZ 3.19Å; E58-K60 VanDerWaalsContact OE2-CG 3.23Å; E58-K60 WeakPolarHBondContact OE2-CG 3.35Å; E58-K60 PolarHBondContact OE2-N 3.25Å
61	V	26.6	Very low	24.7	Very low	113 Å²	113	146.5 Å²	146.5	69%	0.685	78%	0.776	S	S	*	*				-167.5	123.2	77.7	157.5	0	0	0	0	111.5
62	N	25.5	Very low	24.6	Very low	139 Å²	139	142.3 Å²	142.3	74%	0.743	77%	0.771	S	S	*	*			trans	54.1	151.9	144.4	-60.8	-10.8	0	0	0	120.7
63	K	25.1	Very low	24.5	Very low	197 Å²	197	148 Å²	148	86%	0.857	78%	0.775	S	S	*	*			cis	-148.5	135.2	25.7	-155.2	171.7	-176.7	178.8	0	112.6
64	E	24.1	Very low	24.6	Very low	195 Å²	195	148.6 Å²	148.6	91%	0.911	78%	0.775	S	S	*	*			trans	-78.8	162.5	166.6	-62.2	176.4	132	0	0	111.1
65	G	23.1	Very low	24.7	Very low	67 Å²	67	146 Å²	146	69%	0.691	78%	0.775	S	S	*	*			trans	174.8	100.3	172.4	0	0	0	0	0	114.3
66	Y	23.7	Very low	24.7	Very low	236 Å²	236	146.4 Å²	146.4	93%	0.925	78%	0.784	S	S	*	*			trans	94.2	83.6	168.3	-66.7	-77.5	0	0	0	119.2
67	N	23.9	Very low	24.8	Very low	168 Å²	168	149.6 Å²	149.6	90%	0.898	79%	0.791	S	S	*	*			trans	-77.2	152	136.6	-85	-36.5	0	0	0	109.5
68	G	23.2	Very low	24.8	Very low	74 Å²	74	148 Å²	148	76%	0.763	79%	0.79	S	S	*	*			trans	136.4	71.8	160.2	0	0	0	0	0	116.3
69	L	25.5	Very low	24.9	Very low	171 Å²	171	152.1 Å²	152.1	90%	0.895	81%	0.806	S	S	*	*			trans	-150	130	131.5	-111.1	171.9	0	0	0	111
70	N	22.8	Very low	25	Very low	126 Å²	126	147.5 Å²	147.5	67%	0.674	80%	0.801	S	S	*	*			trans	-44.4	134.8	-173.2	-83.4	-27.8	0	0	0	115.5
71	Q	25.3	Very low	25.2	Very low	173 Å²	173	150 Å²	150	81%	0.808	81%	0.812	S	S	*	*				50.4	87.4	94.5	-57.6	-177.6	-5.7	0	0	114
72	C	22.9	Very low	25.2	Very low	118 Å²	118	153.8 Å²	153.8	80%	0.797	82%	0.823	S	S	*	*			trans	-163.3	88.2	137.7	-118.1	0	0	0	0	110.6
73	F	23.9	Very low	25.1	Very low	196 Å²	196	153 Å²	153	86%	0.86	83%	0.826	S	S	*	*			trans	166	74.7	130.8	-102.9	-81.9	0	0	0	111.5	T75	F73-T75 PolarHBondContact O-N 3.37Å
74	T	25.9	Very low	25.5	Very low	133 Å²	133	151.2 Å²	151.2	82%	0.816	83%	0.826	S	S	*	*			trans	-68.1	118.5	145.8	42.6	0	0	0	0	108.5
75	T	25.9	Very low	26.1	Very low	133 Å²	133	150.4 Å²	150.4	82%	0.816	82%	0.82	S	S	*	*			trans	169.6	94.7	136.9	-69	0	0	0	0	109.1	F73	F73-T75 PolarHBondContact O-N 3.37Å
76	A	27	Very low	26.3	Very low	102 Å²	102	157.6 Å²	157.6	84%	0.843	83%	0.827	S	S	*	*	S	Bend	trans	170.7	18.4	154.8	0	0	0	0	0	114.9
77	Q	26.9	Very low	26.7	Very low	192 Å²	192	154.6 Å²	154.6	90%	0.897	83%	0.827	S	S	*	*			trans	-135.7	122.9	154.8	-67	-173.2	-3.1	0	0	105.5
78	S	25.6	Very low	27.1	Very low	104 Å²	104	156.3 Å²	156.3	73%	0.727	83%	0.826	S	S	*	*			cis	-164.8	166.5	41.3	52.2	0	0	0	0	112.3
79	K	28.8	Very low	27.5	Very low	192 Å²	192	158.8 Å²	158.8	84%	0.835	83%	0.826	S	S	*	*			trans	113.5	129.6	159.3	-62.4	178.4	-178	175.8	0	113.6
80	V	24.8	Very low	27.5	Very low	124 Å²	124	160 Å²	160	75%	0.752	82%	0.824	S	S	*	*			cis	-152.7	143.2	-3.8	113.4	0	0	0	0	111.7
81	F	29.1	Very low	27.8	Very low	198 Å²	198	165.4 Å²	165.4	87%	0.868	84%	0.837	S	S	*	*			trans	-6.5	120	142.8	-95.8	-105.4	0	0	0	117.5
82	Q	25.7	Very low	28.1	Very low	192 Å²	192	166.7 Å²	166.7	90%	0.897	84%	0.84	S	S	*	*			trans	-166	115.8	133	-111.5	-179.6	34.9	0	0	111.5
83	C	24.7	Very low	28.3	Very low	122 Å²	122	170.8 Å²	170.8	82%	0.824	85%	0.845	S	S	*	*				153.7	73.5	126.4	-161.5	0	0	0	0	110.9
84	D	33.6	Very low	28.4	Very low	160 Å²	160	169.2 Å²	169.2	86%	0.856	85%	0.845	S	S	*	*			trans	-102.1	94.3	163.5	-172.4	18.4	0	0	0	108.3
85	K	34.9	Very low	28.3	Very low	177 Å²	177	170.9 Å²	170.9	77%	0.77	85%	0.848	S	S	*	*			trans	-154.4	3.3	176.3	-137.9	-178.4	179.7	178.5	0	118.1
86	Y	28.1	Very low	28.2	Very low	218 Å²	218	169.5 Å²	169.5	86%	0.855	84%	0.844	S	S	*	*			trans	-138.4	73.6	179	-86.6	-76.7	0	0	0	114.3
87	L	32.1	Very low	28	Very low	173 Å²	173	172.2 Å²	172.2	91%	0.906	85%	0.845	S	S	*	*			trans	-144.8	48.4	161.6	-116.2	171.8	0	0	0	112.4
88	K	32	Very low	28	Very low	205 Å²	205	173.2 Å²	173.2	89%	0.891	84%	0.84	S	S	*	*	S	Bend	trans	-143.6	23.5	176.7	-126.1	179.1	-168.7	175.2	0	117.4
89	V	31.1	Very low	28.1	Very low	126 Å²	126	174 Å²	174	76%	0.764	84%	0.842	S	S	*	*	S	Bend	trans	-140.8	94.6	161.9	-173.3	0	0	0	0	109.2
90	F	26.3	Very low	28	Very low	195 Å²	195	173 Å²	173	86%	0.855	84%	0.839	S	S	*	*	S	Bend	trans	175.7	50.5	146.8	-104.6	-68.8	0	0	0	112.1
91	Y	29.3	Very low	28	Very low	241 Å²	241	175.3 Å²	175.3	95%	0.945	85%	0.845	S	S	*	*	S	Bend	trans	-140.6	58.1	162.6	-111.2	-78.1	0	0	0	110.6
92	K	31.2	Very low	27.7	Very low	199 Å²	199	177.1 Å²	177.1	87%	0.865	85%	0.846	S	S	*	*	S	Bend	trans	-153.5	50.7	164.8	-149.9	-176.9	-175.6	-173.7	0	113.4
93	F	27.9	Very low	27.8	Very low	204 Å²	204	176.7 Å²	176.7	90%	0.895	84%	0.843	S	S	*	*			trans	-153.7	150.6	151.9	-121.8	-84	0	0	0	109.1
94	L	24.6	Very low	27.7	Very low	164 Å²	164	177.7 Å²	177.7	86%	0.859	85%	0.846	S	S	*	*			trans	89.7	61.1	-170.3	-54.8	177.1	0	0	0	116.5
95	N	24.1	Very low	27.1	Very low	168 Å²	168	177.8 Å²	177.8	90%	0.898	84%	0.841	S	S	*	*				-148	142.5	120.2	-110	-17.5	0	0	0	109.8
96	S	23.5	Very low	26.7	Very low	104 Å²	104	177.9 Å²	177.9	73%	0.727	84%	0.842	S	S	*	*			trans	92.1	84.9	-175.7	-56.1	0	0	0	0	116.8
97	N	24.7	Very low	26.5	Very low	159 Å²	159	177.7 Å²	177.7	85%	0.85	85%	0.845	S	S	*	*				177.9	143.9	95.5	-88.7	-21.5	0	0	0	113
98	R	26.6	Very low	26.1	Very low	212 Å²	212	174.3 Å²	174.3	80%	0.8	84%	0.836	S	S	*	*			trans	-66.1	152.9	163.4	-113.9	-179.5	-176	171.8	4.1	109.3
99	P	26.9	Very low	25.6	Very low	120 Å²	120	175 Å²	175	78%	0.779	84%	0.839	S	S	*	*				-136.7	157.8	104	18	2.3	0	0	0	114.6
100	K	26.9	Very low	25.2	Very low	173 Å²	173	178.4 Å²	178.4	75%	0.752	84%	0.844	S	S	*	*			trans	-94.2	125.2	161.1	-66.3	174	173.2	-178.2	0	108.1
101	I	24.7	Very low	25	Very low	172 Å²	172	174 Å²	174	88%	0.882	84%	0.836	S	S	*	*			trans	-145.3	154.2	152.5	-65.8	-166.2	0	0	0	109.3
102	R	23.3	Very low	24.8	Very low	236 Å²	236	172.6 Å²	172.6	89%	0.891	84%	0.835	S	S	*	*			trans	-71.7	172	-175.1	-77.6	169.2	153.5	170.3	-9.7	115.5
103	H	26.6	Very low	24.4	Very low	183 Å²	183	171.9 Å²	171.9	85%	0.847	83%	0.832	S	S	*	*			trans	-42.2	146.4	165	-66.4	-99	0	0	0	115.8
104	T	22.3	Very low	24.3	Very low	143 Å²	143	172.9 Å²	172.9	88%	0.877	83%	0.829	S	S	*	*				-164.8	174.8	125.8	21.9	0	0	0	0	112.2
105	E	22.9	Very low	24.3	Very low	161 Å²	161	170.6 Å²	170.6	75%	0.752	82%	0.822	S	S	*	*			trans	-69.3	169.9	-154	-56.2	178.6	93.6	0	0	121.2
106	K	26.1	Very low	24.5	Very low	180 Å²	180	171 Å²	171	78%	0.783	82%	0.816	S	S	*	*			trans	0.9	129.1	148.5	-62.3	166.8	179.9	162.8	0	118
107	K	23.2	Very low	24.6	Very low	214 Å²	214	172.4 Å²	172.4	93%	0.93	82%	0.815	S	S	*	*				-169.3	153.7	113.1	-103.6	159.7	-173.7	174.1	0	113.3
108	S	23.4	Very low	24.5	Very low	101 Å²	101	174.3 Å²	174.3	71%	0.706	82%	0.816	S	S	*	*			trans	-91	151.7	179	53.3	0	0	0	0	112.8
109	F	22.6	Very low	24.4	Very low	220 Å²	220	169.4 Å²	169.4	97%	0.965	81%	0.813	S	S	*	*			trans	-148.4	159.9	150.8	-107.2	-74.6	0	0	0	114.3
110	K	21.9	Very low	24.3	Very low	198 Å²	198	171.1 Å²	171.1	86%	0.861	81%	0.812	S	S	*	*			trans	-93.2	147.8	-163.1	-75.1	172.4	174.3	170.3	0	115.1
111	C	21.4	Very low	24.3	Very low	103 Å²	103	171 Å²	171	70%	0.696	82%	0.819	S	S	*	*			trans	-17	143.8	151.3	-177.8	0	0	0	0	118.9
112	K	25.7	Very low	24.4	Very low	210 Å²	210	168.3 Å²	168.3	91%	0.913	82%	0.815	S	S	*	*			trans	-123.5	130.2	141.4	-92.8	-176.8	175.5	177.4	0	111.1
113	K	23.6	Very low	24.7	Very low	185 Å²	185	166.3 Å²	166.3	80%	0.804	82%	0.816	S	S	*	*			trans	-73.1	162.3	167.8	-66.8	172.4	175.6	173.3	0	109
114	R	25.9	Very low	24.8	Very low	224 Å²	224	167.2 Å²	167.2	85%	0.845	82%	0.817	S	S	*	*				-177.3	132.5	74.6	-107.9	-160.8	166.2	166.2	-3.7	109.2
115	V	24.5	Very low	25.2	Very low	116 Å²	116	166.7 Å²	166.7	70%	0.703	81%	0.814	S	S	*	*				90.8	137.3	100.1	158.5	0	0	0	0	112.8
116	K	28	Very low	25.5	Very low	178 Å²	178	167.9 Å²	167.9	77%	0.774	82%	0.819	S	S	*	*			cis	-148.6	146.6	7.2	-137	168.2	-174.1	-173.2	0	113.6
117	L	24.4	Very low	25.8	Very low	133 Å²	133	168.6 Å²	168.6	70%	0.696	83%	0.825	S	S	*	*			trans	9.4	126.4	147.8	-77.1	75.5	0	0	0	121.9
118	F	22.5	Very low	26	Very low	198 Å²	198	168.1 Å²	168.1	87%	0.868	82%	0.823	S	S	*	*				-158.1	147.6	92.8	-122.9	-107.2	0	0	0	106.2
119	C	25.9	Very low	26.3	Very low	109 Å²	109	168.7 Å²	168.7	74%	0.736	83%	0.827	S	S	*	*			cis	-137.4	152.4	13.3	-164.4	0	0	0	0	110.3
120	M	24.3	Very low	26.5	Very low	156 Å²	156	164.8 Å²	164.8	77%	0.768	82%	0.815	S	S	*	*			trans	-103.3	126.4	176.9	-81.2	-103.4	-68.5	0	0	110.5
121	L	27.8	Very low	27	Very low	172 Å²	172	166.5 Å²	166.5	90%	0.901	82%	0.817	S	S	*	*			trans	-174.6	159.3	148	-100.3	147	0	0	0	110.1
122	S	26.1	Very low	27.3	Very low	114 Å²	114	169 Å²	169	80%	0.797	82%	0.819	S	S	*	*	S	Bend	trans	73.8	22.6	172.7	79.4	0	0	0	0	122.1
123	H	30.3	Very low	27.8	Very low	195 Å²	195	169.4 Å²	169.4	90%	0.903	81%	0.814	S	S	*	*			trans	-135.7	57.8	163.5	-111.1	-86.2	0	0	0	113.9
124	K	28.3	Very low	28.5	Very low	202 Å²	202	169.2 Å²	169.2	88%	0.878	82%	0.816	S	S	*	*			trans	-144.2	45.7	176	-149.9	-177.1	-177.4	-176.1	0	115.3
125	T	30.1	Very low	29.4	Very low	132 Å²	132	166 Å²	166	81%	0.81	81%	0.808	S	S	*	*	S	Bend	trans	-133.9	154.8	156.2	41.2	0	0	0	0	108.5
126	Q	30.4	Very low	30.5	Very low	185 Å²	185	164 Å²	164	86%	0.864	80%	0.8	S	S	*	*	S	Bend	trans	69.4	48.9	-178.4	-52.9	-173.4	-9.5	0	0	118
127	H	31.1	Very low	31.5	Very low	195 Å²	195	160 Å²	160	90%	0.903	78%	0.781	S	S	*	*			trans	-161.3	85.4	136.5	-111.2	-75.9	0	0	0	111.2
128	K	28.2	Very low	32.6	Very low	204 Å²	204	160.2 Å²	160.2	89%	0.887	78%	0.776	S	S	*	*			trans	-125.6	133.5	151.3	-95.2	-169.5	172.3	-173.8	0	107.8
129	S	29	Very low	33.9	Very low	114 Å²	114	150.9 Å²	150.9	80%	0.797	74%	0.735	S	S	*	*			trans	-52.7	133.3	-178.2	46.4	0	0	0	0	113.6
130	I	27.3	Very low	35.2	Very low	137 Å²	137	154.9 Å²	154.9	70%	0.703	74%	0.74	S	S	*	*			trans	-116	114.7	148.4	-58.3	179.6	0	0	0	107.2	H132	I130-H132 VanDerWaalsContact C-N 3.32Å; I130-H132 HydrophobicContact CG2-CB 4.44Å; I130-H132 VanDerWaalsContact CG2-CD2 3.41Å; I130-H132 WeakPolarHBondContact CG2-CD2 3.27Å; I130-H132 PolarHBondContact O-N 3.12Å
131	Y	31.4	Very low	36.5	Very low	234 Å²	234	152.5 Å²	152.5	92%	0.918	73%	0.727	S	S	*	*			trans	-75.2	85.9	171.7	-156.1	-89.1	0	0	0	107.4	R133	Y131-R133 PolarHBondContact O-N 3.15Å
132	H	29.3	Very low	37.9	Very low	157 Å²	157	146 Å²	146	73%	0.727	70%	0.696	S	S	*	*			trans	-89.6	100.1	-179.2	-116.9	-55.3	0	0	0	111	I130 E134	I130-H132 VanDerWaalsContact C-N 3.32Å; I130-H132 HydrophobicContact CG2-CB 4.44Å; I130-H132 VanDerWaalsContact CG2-CD2 3.41Å; I130-H132 WeakPolarHBondContact CG2-CD2 3.27Å; I130-H132 PolarHBondContact O-N 3.12Å; H132-E134 PolarHBondContact O-N 2.93Å
133	R	35.1	Very low	39.1	Very low	217 Å²	217	142.5 Å²	142.5	82%	0.819	68%	0.678	S	S	*	*			trans	-33.3	119.5	162.3	-176.2	179.2	-174.2	175.5	2.5	110.9	Y131 K135	Y131-R133 PolarHBondContact O-N 3.15Å; R133-K135 PolarHBondContact O-N 3.31Å
134	E	38.7	Very low	40.4	Very low	181 Å²	181	139.1 Å²	139.1	85%	0.846	66%	0.66	S	S	*	*			trans	-59.7	102.8	180	-66.2	-177.3	141.3	0	0	110.5	H132 S136	H132-E134 PolarHBondContact O-N 2.93Å; E134-S136 PolarHBondContact O-N 2.95Å
135	K	44.6	Very low	41.3	Very low	156 Å²	156	133.2 Å²	133.2	68%	0.678	64%	0.641	S	S	*	*			trans	-83.2	96.2	167.5	-80.6	-172	174.2	-177.3	0	108.3	R133 Y137	R133-K135 PolarHBondContact O-N 3.31Å; K135-Y137 HydrophobicContact CB-CE2 4.42Å; K135-Y137 WeakPolarHBondContact O-CD2 3.26Å; K135-Y137 WeakPolarHBondContact O-CE2 3.41Å
136	S	47.5	Very low	42.9	Very low	76 Å²	76	129 Å²	129	53%	0.531	61%	0.612	S	S	.	*			trans	-75.7	129.2	167.1	54.5	0	0	0	0	110.1	E134	E134-S136 PolarHBondContact O-N 2.95Å
137	Y	49.5	Very low	43.5	Very low	92 Å²	92	126.5 Å²	126.5	36%	0.361	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.2	107.5	178.8	-62.5	-87.6	0	0	0	108.8	K135 T145 F146	K135-Y137 HydrophobicContact CB-CE2 4.42Å; K135-Y137 WeakPolarHBondContact O-CD2 3.26Å; K135-Y137 WeakPolarHBondContact O-CE2 3.41Å; Y137-T145 WeakPolarHBondContact O-CA 3.36Å; Y137-F146 PolarHBondContact N-O 3.36Å; Y137-F146 PolarHBondContact O-N 3.22Å
138	K	46.4	Very low	44.3	Very low	139 Å²	139	125.9 Å²	125.9	60%	0.604	59%	0.594	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92	126.3	-178.1	-155.3	167.5	-172.2	-178.4	0	110.8	K140 G143 K144 T145	K138-K140 PolarHBondContact O-N 3.08Å; K138-G143 WeakPolarHBondContact CE-O 3.14Å; K138-G143 VanDerWaalsContact CG-O 3.3Å; K138-G143 WeakPolarHBondContact CG-O 3.36Å; K138-K144 WeakPolarHBondContact CA-O 3.16Å; K138-T145 HydrophobicContact CB-CG2 3.97Å; K138-T145 HydrophobicContact CD-CG2 3.91Å; K138-T145 HydrophobicContact CG-CG2 3.69Å
139	C	51	Low	45.1	Very low	2 Å²	2	118.7 Å²	118.7	1%	0.014	57%	0.57	C	S	.	*			trans	-68.6	126.3	171.6	-172.7	0	0	0	0	109.7	E141 C142 G143 K144 F146 L152	C139-E141 VanDerWaalsContact C-N 3.34Å; C139-C142 VanDerWaalsContact CB-SG 3.55Å; C139-C142 VanDerWaalsContact SG-SG 3.68Å; C139-G143 WeakPolarHBondContact O-CA 3.38Å; C139-G143 PolarHBondContact O-N 2.83Å; C139-K144 PolarHBondContact N-O 3.26Å; C139-F146 HydrophobicContact CB-CE2 4.45Å; C139-L152 HydrophobicContact CB-CD1 3.7Å
140	K	53.2	Low	45.9	Very low	193 Å²	193	116 Å²	116	84%	0.839	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-26.7	-179.3	-70.7	-168.8	176.3	-172.6	0	113.5	K138	K138-K140 PolarHBondContact O-N 3.08Å
141	E	50.7	Low	47.2	Very low	105 Å²	105	112.7 Å²	112.7	49%	0.491	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-31.8	-177.5	-67.9	134.4	-124.1	0	0	113.7	C139 R156 Y159	C139-E141 VanDerWaalsContact C-N 3.34Å; E141-R156 IonicContact OE1-NH2 3.04Å; E141-Y159 HydrophobicContact CB-CE1 4.39Å
142	C	57	Low	47.9	Very low	36 Å²	36	102.6 Å²	102.6	24%	0.243	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	3.4	-175.2	77.1	0	0	0	0	115	C139 K144 H155	C139-C142 VanDerWaalsContact CB-SG 3.55Å; C139-C142 VanDerWaalsContact SG-SG 3.68Å; C142-K144 PolarHBondContact O-N 3.2Å; C142-H155 PolarHBondContact SG-CE1 3.14Å
143	G	53.2	Low	49.1	Very low	40 Å²	40	98.6 Å²	98.6	41%	0.412	49%	0.486	S	S	.	.			trans	69.9	-7.7	176.1	0	0	0	0	0	117.1	K138 C139	K138-G143 WeakPolarHBondContact CE-O 3.14Å; K138-G143 VanDerWaalsContact CG-O 3.3Å; K138-G143 WeakPolarHBondContact CG-O 3.36Å; C139-G143 WeakPolarHBondContact O-CA 3.38Å; C139-G143 PolarHBondContact O-N 2.83Å
144	K	57.3	Low	49.9	Very low	124 Å²	124	92.6 Å²	92.6	54%	0.539	47%	0.47	S	S	.	.			trans	-70.4	137.4	-176.7	-65.4	176.8	-174.7	171.7	0	112.4	K138 C139 C142 F146	K138-K144 WeakPolarHBondContact CA-O 3.16Å; C139-K144 PolarHBondContact N-O 3.26Å; C142-K144 PolarHBondContact O-N 3.2Å; K144-F146 HydrophobicContact CB-CE2 3.77Å; K144-F146 HydrophobicContact CB-CZ 3.89Å
145	T	46.8	Very low	50.8	Low	79 Å²	79	85.5 Å²	85.5	49%	0.485	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.3	177.3	43.9	0	0	0	0	112.3	Y137 K138	Y137-T145 WeakPolarHBondContact O-CA 3.36Å; K138-T145 HydrophobicContact CB-CG2 3.97Å; K138-T145 HydrophobicContact CD-CG2 3.91Å; K138-T145 HydrophobicContact CG-CG2 3.69Å
146	F	62.4	Low	51	Low	42 Å²	42	83.2 Å²	83.2	18%	0.184	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.3	179.1	-60.1	-86	0	0	0	111.5	Y137 C139 K144 W148 L152 H155	Y137-F146 PolarHBondContact N-O 3.36Å; Y137-F146 PolarHBondContact O-N 3.22Å; C139-F146 HydrophobicContact CB-CE2 4.45Å; K144-F146 HydrophobicContact CB-CE2 3.77Å; K144-F146 HydrophobicContact CB-CZ 3.89Å; F146-W148 VanDerWaalsContact C-N 3.32Å; F146-W148 PolarHBondContact O-N 3.09Å; F146-L152 HydrophobicContact CB-CB 4.36Å; F146-L152 HydrophobicContact CD2-CB 4.1Å; F146-L152 HydrophobicContact CD2-CD1 3.88Å; F146-L152 HydrophobicContact CE2-CD1 4.08Å; F146-L152 HydrophobicContact CG-CB 4.38Å; F146-H155 HydrophobicContact CE1-CB 4.38Å; F146-H155 HydrophobicContact CE2-CB 4.25Å; F146-H155 HydrophobicContact CZ-CB 3.92Å; F146-H155 AromaticContact CZ-CD2 3.36Å; F146-H155 WeakPolarHBondContact CZ-CD2 3.25Å; F146-H155 AromaticContact CZ-CG 3.67Å
147	N	43.2	Very low	51.4	Low	133 Å²	133	86.8 Å²	86.8	71%	0.711	43%	0.43	S	S	*	.	S	Bend	trans	-87.9	0.4	-176.4	-62	-0.2	0	0	0	113.3
148	W	48.1	Very low	51.6	Low	182 Å²	182	89 Å²	89	69%	0.689	45%	0.446	S	S	*	.	S	Bend	trans	-144.8	147.8	175.6	-145.3	-75.1	0	0	0	110.1	F146 T151 L152	F146-W148 VanDerWaalsContact C-N 3.32Å; F146-W148 PolarHBondContact O-N 3.09Å; W148-T151 PolarHBondContact O-OG1 3.25Å; W148-L152 PolarHBondContact O-N 3.05Å
149	S	44.9	Very low	51.4	Low	54 Å²	54	88.8 Å²	88.8	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-38.9	179	53.7	0	0	0	0	112.4	T151 L152 T153	S149-T151 VanDerWaalsContact C-N 3.32Å; S149-T151 PolarHBondContact O-N 3.02Å; S149-L152 PolarHBondContact O-N 3.34Å; S149-L152 VanDerWaalsContact O-N 3.14Å; S149-T153 PolarHBondContact O-N 2.88Å; S149-T153 PolarHBondContact O-OG1 3.06Å
150	S	47	Very low	50.8	Low	58 Å²	58	92.9 Å²	92.9	41%	0.406	47%	0.468	S	S	.	.	H	α-helix	trans	-60.7	-34.5	178.5	56.7	0	0	0	0	113.8	T153 N154	S150-T153 PolarHBondContact O-N 2.98Å; S150-N154 PolarHBondContact O-N 3.5Å
151	T	53.5	Low	50.2	Low	67 Å²	67	92.5 Å²	92.5	41%	0.411	47%	0.469	S	S	.	.	H	α-helix	trans	-74.5	-33.3	174.5	38.8	0	0	0	0	112.3	W148 S149 H155	W148-T151 PolarHBondContact O-OG1 3.25Å; S149-T151 VanDerWaalsContact C-N 3.32Å; S149-T151 PolarHBondContact O-N 3.02Å; T151-H155 WeakPolarHBondContact O-CB 3.42Å; T151-H155 PolarHBondContact O-N 3.41Å
152	L	46.9	Very low	49.2	Very low	21 Å²	21	96 Å²	96	11%	0.11	49%	0.486	C	S	.	.	H	α-helix	trans	-66.1	-40.3	167.8	176.5	61.4	0	0	0	111.8	C139 F146 W148 S149 N154 H155 R156	C139-L152 HydrophobicContact CB-CD1 3.7Å; F146-L152 HydrophobicContact CB-CB 4.36Å; F146-L152 HydrophobicContact CD2-CB 4.1Å; F146-L152 HydrophobicContact CD2-CD1 3.88Å; F146-L152 HydrophobicContact CE2-CD1 4.08Å; F146-L152 HydrophobicContact CG-CB 4.38Å; W148-L152 PolarHBondContact O-N 3.05Å; S149-L152 PolarHBondContact O-N 3.34Å; S149-L152 VanDerWaalsContact O-N 3.14Å; L152-N154 PolarHBondContact O-N 2.99Å; L152-H155 PolarHBondContact O-N 3.24Å; L152-R156 HydrophobicContact CD1-CG 4.38Å; L152-R156 PolarHBondContact O-N 3.46Å
153	T	53.8	Low	48.3	Very low	73 Å²	73	104.3 Å²	104.3	45%	0.448	52%	0.517	S	S	.	.	H	α-helix	trans	-62.6	-42.2	176.7	-53.5	0	0	0	0	111.4	S149 S150 R156 K157	S149-T153 PolarHBondContact O-N 2.88Å; S149-T153 PolarHBondContact O-OG1 3.06Å; S150-T153 PolarHBondContact O-N 2.98Å; T153-R156 PolarHBondContact O-N 3.3Å; T153-K157 WeakPolarHBondContact O-CG 3.4Å; T153-K157 PolarHBondContact O-N 3.4Å; T153-K157 VanDerWaalsContact O-N 3.08Å
154	N	52.4	Low	47.5	Very low	92 Å²	92	107.5 Å²	107.5	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-70.6	-35.6	175.3	-73.3	-6.6	0	0	0	112.4	S150 L152 K157 I158	S150-N154 PolarHBondContact O-N 3.5Å; L152-N154 PolarHBondContact O-N 2.99Å; N154-K157 PolarHBondContact O-N 2.99Å; N154-I158 WeakPolarHBondContact O-CD1 3.23Å; N154-I158 WeakPolarHBondContact O-CG1 3.4Å; N154-I158 PolarHBondContact O-N 2.94Å
155	H	56.9	Low	46.2	Very low	32 Å²	32	112 Å²	112	15%	0.148	55%	0.546	C	S	.	.	H	α-helix	trans	-61.2	-45.3	172.1	177.4	-71.4	0	0	0	111.5	C142 F146 T151 L152 K157 I158 Y159	C142-H155 PolarHBondContact SG-CE1 3.14Å; F146-H155 HydrophobicContact CE1-CB 4.38Å; F146-H155 HydrophobicContact CE2-CB 4.25Å; F146-H155 HydrophobicContact CZ-CB 3.92Å; F146-H155 AromaticContact CZ-CD2 3.36Å; F146-H155 WeakPolarHBondContact CZ-CD2 3.25Å; F146-H155 AromaticContact CZ-CG 3.67Å; T151-H155 WeakPolarHBondContact O-CB 3.42Å; T151-H155 PolarHBondContact O-N 3.41Å; L152-H155 PolarHBondContact O-N 3.24Å; H155-K157 PolarHBondContact O-N 3.26Å; H155-I158 PolarHBondContact O-N 3.28Å; H155-I158 VanDerWaalsContact O-N 3.17Å; H155-Y159 PolarHBondContact O-N 2.8Å; H155-Y159 VanDerWaalsContact O-N 3.12Å
156	R	48.8	Very low	45.2	Very low	108 Å²	108	116.1 Å²	116.1	41%	0.408	56%	0.557	S	S	.	*	H	α-helix	trans	-60.1	-44.8	176.3	-81.9	-179.6	155.2	-177	-11.7	112.2	E141 L152 T153 I158 Y159 T160	E141-R156 IonicContact OE1-NH2 3.04Å; L152-R156 HydrophobicContact CD1-CG 4.38Å; L152-R156 PolarHBondContact O-N 3.46Å; T153-R156 PolarHBondContact O-N 3.3Å; R156-I158 PolarHBondContact O-N 3.35Å; R156-I158 VanDerWaalsContact O-N 3.1Å; R156-Y159 PolarHBondContact O-N 3.32Å; R156-T160 PolarHBondContact O-N 3.21Å; R156-T160 PolarHBondContact O-OG1 3.47Å
157	K	56.3	Low	43.4	Very low	151 Å²	151	120.4 Å²	120.4	66%	0.657	59%	0.591	S	S	*	*	H	α-helix	trans	-60.4	-17.5	175.5	-74.8	179	174.9	-169.7	0	115.1	T153 N154 H155	T153-K157 WeakPolarHBondContact O-CG 3.4Å; T153-K157 PolarHBondContact O-N 3.4Å; T153-K157 VanDerWaalsContact O-N 3.08Å; N154-K157 PolarHBondContact O-N 2.99Å; H155-K157 PolarHBondContact O-N 3.26Å
158	I	53.1	Low	42.7	Very low	137 Å²	137	121 Å²	121	70%	0.703	59%	0.589	S	S	*	*	H	α-helix	trans	-98.5	-20.2	176.3	-64.6	164.9	0	0	0	111.1	N154 H155 R156	N154-I158 WeakPolarHBondContact O-CD1 3.23Å; N154-I158 WeakPolarHBondContact O-CG1 3.4Å; N154-I158 PolarHBondContact O-N 2.94Å; H155-I158 PolarHBondContact O-N 3.28Å; H155-I158 VanDerWaalsContact O-N 3.17Å; R156-I158 PolarHBondContact O-N 3.35Å; R156-I158 VanDerWaalsContact O-N 3.1Å
159	Y	43.4	Very low	41.9	Very low	136 Å²	136	120.9 Å²	120.9	53%	0.533	60%	0.596	S	S	.	*	H	α-helix	trans	-92.2	-19	-176.6	-148.6	-105.2	0	0	0	113.5	E141 H155 R156	E141-Y159 HydrophobicContact CB-CE1 4.39Å; H155-Y159 PolarHBondContact O-N 2.8Å; H155-Y159 VanDerWaalsContact O-N 3.12Å; R156-Y159 PolarHBondContact O-N 3.32Å
160	T	37.3	Very low	40.9	Very low	88 Å²	88	129.5 Å²	129.5	54%	0.54	62%	0.622	S	S	.	*			trans	-109.7	78.7	175.2	59.2	0	0	0	0	110.9	R156 E162	R156-T160 PolarHBondContact O-N 3.21Å; R156-T160 PolarHBondContact O-OG1 3.47Å; T160-E162 VanDerWaalsContact C-N 3.32Å; T160-E162 PolarHBondContact O-N 3.16Å
161	E	41	Very low	40.2	Very low	185 Å²	185	134 Å²	134	86%	0.864	64%	0.641	S	S	*	*			trans	-79.4	80.2	164.1	-77.6	-165	149.7	0	0	110.5
162	E	28.9	Very low	39	Very low	179 Å²	179	140.4 Å²	140.4	84%	0.836	66%	0.664	S	S	*	*			trans	-133	141.4	156.1	-72.1	-166.2	149.8	0	0	109	T160 P164	T160-E162 VanDerWaalsContact C-N 3.32Å; T160-E162 PolarHBondContact O-N 3.16Å; E162-P164 VanDerWaalsContact O-CD 3.3Å; E162-P164 WeakPolarHBondContact O-CD 3.44Å
163	K	40.1	Very low	38.1	Very low	210 Å²	210	144.2 Å²	144.2	91%	0.913	69%	0.692	S	S	*	*			trans	-81	131.8	179.2	-78.1	178.2	174.4	175.4	0	111.4
164	P	34.8	Very low	37.2	Very low	106 Å²	106	146.8 Å²	146.8	69%	0.688	71%	0.71	S	S	*	*			trans	-135.2	152.6	146.4	31.6	-15.9	0	0	0	112.1	E162	E162-P164 VanDerWaalsContact O-CD 3.3Å; E162-P164 WeakPolarHBondContact O-CD 3.44Å
165	Y	29.5	Very low	36.5	Very low	218 Å²	218	151.7 Å²	151.7	86%	0.855	73%	0.727	S	S	*	*			cis	-159.3	175.4	-10.9	-115.3	-59.6	0	0	0	108.4
166	K	27	Very low	35.7	Very low	167 Å²	167	157 Å²	157	73%	0.726	75%	0.752	S	S	*	*			trans	-52.3	158.3	157.7	-70	176.1	162.7	-165.6	0	111.1	E168	K166-E168 IonicContact NZ-OE1 3.22Å; K166-E168 PolarHBondContact NZ-OE1 2.81Å
167	C	23.8	Very low	34.9	Very low	131 Å²	131	158 Å²	158	89%	0.885	77%	0.765	S	S	*	*			trans	-127.4	111.6	159.5	-164.3	0	0	0	0	108.6
168	E	28.8	Very low	34.2	Very low	147 Å²	147	155.1 Å²	155.1	69%	0.687	76%	0.763	S	S	*	*			trans	-92.2	140.7	167.2	-81.7	163.8	-163.9	0	0	109	K166	K166-E168 IonicContact NZ-OE1 3.22Å; K166-E168 PolarHBondContact NZ-OE1 2.81Å
169	E	31	Very low	33.6	Very low	178 Å²	178	152.5 Å²	152.5	83%	0.832	75%	0.754	S	S	*	*			trans	13.7	123.4	167.3	-53.9	-169.1	150.9	0	0	120.8
170	Y	25.1	Very low	33.5	Very low	235 Å²	235	150.4 Å²	150.4	92%	0.922	75%	0.752	S	S	*	*				-156	135.3	125	-122.8	-81.9	0	0	0	112
171	N	32	Very low	34.2	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	75%	0.745	S	S	*	*			trans	-63.4	131.1	-172	-81.6	-71.6	0	0	0	115.1
172	K	28.3	Very low	34.6	Very low	202 Å²	202	144 Å²	144	88%	0.878	73%	0.725	S	S	*	*			trans	-165.4	98.2	156.3	-108.7	158.5	-168.5	173	0	114.3
173	S	27.6	Very low	35.6	Very low	102 Å²	102	140.6 Å²	140.6	71%	0.713	71%	0.709	S	S	*	*			trans	49	147.6	152	65.2	0	0	0	0	122.9	K175	S173-K175 VanDerWaalsContact C-N 3.34Å; S173-K175 PolarHBondContact O-N 2.9Å
174	P	34.7	Very low	36	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	10.8	-153.1	-15.5	32.6	0	0	0	117.8
175	K	37.8	Very low	36.8	Very low	195 Å²	195	132 Å²	132	85%	0.848	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	1.6	-168.6	-73.5	-172.8	177	179.4	0	115.8	S173	S173-K175 VanDerWaalsContact C-N 3.34Å; S173-K175 PolarHBondContact O-N 2.9Å
176	Q	39.3	Very low	37.9	Very low	145 Å²	145	124.4 Å²	124.4	68%	0.678	64%	0.637	S	S	*	*	S	Bend	trans	-114.9	-1.3	-178.7	-69.7	-164	-9.4	0	0	115.9	S178 T179 L180	Q176-S178 PolarHBondContact O-N 3.38Å; Q176-T179 WeakPolarHBondContact CA-OG1 3.38Å; Q176-T179 PolarHBondContact O-N 3.34Å; Q176-T179 PolarHBondContact O-OG1 3.07Å; Q176-L180 PolarHBondContact O-N 3.41Å
177	L	32.6	Very low	39.1	Very low	129 Å²	129	123.2 Å²	123.2	68%	0.675	63%	0.634	S	S	*	*	H	α-helix	trans	-61.4	-45.9	-174.7	-165.2	65.4	0	0	0	112.4	T179 L180 T181	L177-T179 VanDerWaalsContact C-N 3.32Å; L177-T179 PolarHBondContact O-N 3.13Å; L177-L180 PolarHBondContact O-N 3.22Å; L177-L180 VanDerWaalsContact O-N 3.15Å; L177-T181 PolarHBondContact O-N 2.99Å; L177-T181 PolarHBondContact O-OG1 3.22Å
178	S	43	Very low	40.4	Very low	89 Å²	89	120.3 Å²	120.3	62%	0.622	62%	0.619	S	S	*	*	H	α-helix	trans	-64.6	-31.3	179.1	58.1	0	0	0	0	114.2	Q176 T182	Q176-S178 PolarHBondContact O-N 3.38Å; S178-T182 WeakPolarHBondContact O-CG2 3.4Å; S178-T182 PolarHBondContact O-N 3.01Å; S178-T182 PolarHBondContact O-OG1 3.48Å
179	T	39.8	Very low	41.6	Very low	83 Å²	83	115.8 Å²	115.8	51%	0.509	61%	0.612	S	S	.	*	H	α-helix	trans	-75.5	-29.8	174.5	37.8	0	0	0	0	112.9	Q176 L177 T182 H183	Q176-T179 WeakPolarHBondContact CA-OG1 3.38Å; Q176-T179 PolarHBondContact O-N 3.34Å; Q176-T179 PolarHBondContact O-OG1 3.07Å; L177-T179 VanDerWaalsContact C-N 3.32Å; L177-T179 PolarHBondContact O-N 3.13Å; T179-T182 WeakPolarHBondContact CA-OG1 3.25Å; T179-T182 PolarHBondContact O-OG1 2.83Å; T179-H183 WeakPolarHBondContact O-CB 3.46Å; T179-H183 PolarHBondContact O-N 3.24Å
180	L	40.9	Very low	42.8	Very low	92 Å²	92	112.6 Å²	112.6	48%	0.482	60%	0.597	S	S	.	*	H	α-helix	trans	-71.8	-51.5	175.3	-149	79.9	0	0	0	110.4	Q176 L177 T182 H183 E184	Q176-L180 PolarHBondContact O-N 3.41Å; L177-L180 PolarHBondContact O-N 3.22Å; L177-L180 VanDerWaalsContact O-N 3.15Å; L180-T182 VanDerWaalsContact C-N 3.29Å; L180-T182 PolarHBondContact O-N 3.37Å; L180-H183 WeakPolarHBondContact O-CA 3.45Å; L180-H183 WeakPolarHBondContact O-CB 3.45Å; L180-H183 PolarHBondContact O-N 3.09Å; L180-E184 WeakPolarHBondContact O-CG 3.38Å; L180-E184 PolarHBondContact O-N 2.79Å
181	T	51.8	Low	44.3	Very low	66 Å²	66	107.8 Å²	107.8	41%	0.405	58%	0.581	S	S	.	*	H	α-helix	trans	-58	-41.1	179.5	-40.1	0	0	0	0	111.8	L177 I185	L177-T181 PolarHBondContact O-N 2.99Å; L177-T181 PolarHBondContact O-OG1 3.22Å; T181-I185 HydrophobicContact CG2-CD1 4.04Å; T181-I185 WeakPolarHBondContact O-CB 3.3Å; T181-I185 WeakPolarHBondContact O-CD1 3.34Å; T181-I185 WeakPolarHBondContact O-CG1 3.43Å; T181-I185 PolarHBondContact O-N 3.33Å
182	T	48.9	Very low	45.6	Very low	72 Å²	72	105.2 Å²	105.2	44%	0.442	57%	0.566	S	S	.	*	H	α-helix	trans	-70.6	-30.8	176.9	47.6	0	0	0	0	113.2	S178 T179 L180 I186	S178-T182 WeakPolarHBondContact O-CG2 3.4Å; S178-T182 PolarHBondContact O-N 3.01Å; S178-T182 PolarHBondContact O-OG1 3.48Å; T179-T182 WeakPolarHBondContact CA-OG1 3.25Å; T179-T182 PolarHBondContact O-OG1 2.83Å; L180-T182 VanDerWaalsContact C-N 3.29Å; L180-T182 PolarHBondContact O-N 3.37Å; T182-I186 WeakPolarHBondContact O-CD1 3.2Å; T182-I186 WeakPolarHBondContact O-CG1 3.36Å; T182-I186 PolarHBondContact O-N 3.42Å
183	H	50.7	Low	47.3	Very low	107 Å²	107	99.8 Å²	99.8	50%	0.495	54%	0.541	S	S	.	.	H	α-helix	trans	-69.5	-44	173.8	-175.9	-90.2	0	0	0	111.6	T179 L180 I186 H187	T179-H183 WeakPolarHBondContact O-CB 3.46Å; T179-H183 PolarHBondContact O-N 3.24Å; L180-H183 WeakPolarHBondContact O-CA 3.45Å; L180-H183 WeakPolarHBondContact O-CB 3.45Å; L180-H183 PolarHBondContact O-N 3.09Å; H183-I186 PolarHBondContact O-N 3.07Å; H183-H187 AromaticContact CE1-CD2 3.36Å; H183-H187 PolarHBondContact CE1-CD2 3.16Å; H183-H187 AromaticContact CE1-NE2 3.5Å; H183-H187 AromaticContact ND1-CD2 3.71Å; H183-H187 AromaticContact NE2-CD2 3.7Å; H183-H187 AromaticContact NE2-NE2 3.54Å; H183-H187 PolarHBondContact O-CD2 2.93Å; H183-H187 PolarHBondContact O-N 3.33Å; H183-H187 VanDerWaalsContact O-N 3.1Å
184	E	48.3	Very low	48.9	Very low	106 Å²	106	101.8 Å²	101.8	50%	0.495	54%	0.537	S	S	.	.	H	α-helix	trans	-62.3	-46.5	178.1	-70.1	164.4	161.5	0	0	111.7	L180 I186 H187 A188	L180-E184 WeakPolarHBondContact O-CG 3.38Å; L180-E184 PolarHBondContact O-N 2.79Å; E184-I186 VanDerWaalsContact C-N 3.29Å; E184-I186 PolarHBondContact O-N 2.64Å; E184-H187 PolarHBondContact O-N 3.24Å; E184-H187 VanDerWaalsContact O-N 3.13Å; E184-A188 WeakPolarHBondContact O-CB 3.2Å; E184-A188 PolarHBondContact O-N 3.13Å
185	I	52.8	Low	50.6	Low	30 Å²	30	95.9 Å²	95.9	15%	0.154	50%	0.499	C	S	.	.	H	α-helix	trans	-57	-39.9	174.7	-72.9	163.9	0	0	0	112.2	T181 G189 E190 L192	T181-I185 HydrophobicContact CG2-CD1 4.04Å; T181-I185 WeakPolarHBondContact O-CB 3.3Å; T181-I185 WeakPolarHBondContact O-CD1 3.34Å; T181-I185 WeakPolarHBondContact O-CG1 3.43Å; T181-I185 PolarHBondContact O-N 3.33Å; I185-G189 PolarHBondContact O-N 2.8Å; I185-E190 PolarHBondContact O-N 3.34Å; I185-L192 HydrophobicContact CB-CD1 4.45Å; I185-L192 HydrophobicContact CD1-CD1 3.62Å; I185-L192 HydrophobicContact CG1-CD1 3.79Å; I185-L192 HydrophobicContact CG2-CD1 3.77Å
186	I	52	Low	52	Low	58 Å²	58	95.2 Å²	95.2	30%	0.297	50%	0.498	S	S	.	.	H	α-helix	trans	-69.2	-37.6	179.3	-67.7	160.9	0	0	0	111.2	T182 H183 E184 R204	T182-I186 WeakPolarHBondContact O-CD1 3.2Å; T182-I186 WeakPolarHBondContact O-CG1 3.36Å; T182-I186 PolarHBondContact O-N 3.42Å; H183-I186 PolarHBondContact O-N 3.07Å; E184-I186 VanDerWaalsContact C-N 3.29Å; E184-I186 PolarHBondContact O-N 2.64Å; I186-R204 VanDerWaalsContact CD1-NH2 3.26Å
187	H	51.2	Low	53	Low	143 Å²	143	94.7 Å²	94.7	66%	0.662	50%	0.496	S	S	*	.	H	α-helix	trans	-76.3	-30.5	178	-87.8	-83.1	0	0	0	113.3	H183 E184 G189	H183-H187 AromaticContact CE1-CD2 3.36Å; H183-H187 PolarHBondContact CE1-CD2 3.16Å; H183-H187 AromaticContact CE1-NE2 3.5Å; H183-H187 AromaticContact ND1-CD2 3.71Å; H183-H187 AromaticContact NE2-CD2 3.7Å; H183-H187 AromaticContact NE2-NE2 3.54Å; H183-H187 PolarHBondContact O-CD2 2.93Å; H183-H187 PolarHBondContact O-N 3.33Å; H183-H187 VanDerWaalsContact O-N 3.1Å; E184-H187 PolarHBondContact O-N 3.24Å; E184-H187 VanDerWaalsContact O-N 3.13Å; H187-G189 VanDerWaalsContact C-N 3.31Å
188	A	52.7	Low	54.7	Low	69 Å²	69	91 Å²	91	57%	0.57	48%	0.481	S	S	*	.	H	α-helix	trans	-75.5	-17	173.5	0	0	0	0	0	113.5	E184 E190	E184-A188 WeakPolarHBondContact O-CB 3.2Å; E184-A188 PolarHBondContact O-N 3.13Å; A188-E190 VanDerWaalsContact C-N 3.28Å; A188-E190 HydrophobicContact CB-CG 4.09Å; A188-E190 PolarHBondContact O-N 2.96Å
189	G	52.2	Low	55.8	Low	52 Å²	52	89.4 Å²	89.4	54%	0.536	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	8.5	179.3	0	0	0	0	0	114.6	I185 H187	I185-G189 PolarHBondContact O-N 2.8Å; H187-G189 VanDerWaalsContact C-N 3.31Å
190	E	56.2	Low	57.1	Low	112 Å²	112	90.6 Å²	90.6	52%	0.523	48%	0.478	S	S	.	.			trans	-71.9	128.5	-175	-64.4	-169.2	156.6	0	0	112.4	I185 A188 L192	I185-E190 PolarHBondContact O-N 3.34Å; A188-E190 VanDerWaalsContact C-N 3.28Å; A188-E190 HydrophobicContact CB-CG 4.09Å; A188-E190 PolarHBondContact O-N 2.96Å; E190-L192 HydrophobicContact CB-CD1 4.48Å; E190-L192 PolarHBondContact O-N 3.2Å
191	K	58.1	Low	58.3	Low	133 Å²	133	87.4 Å²	87.4	58%	0.578	47%	0.465	S	S	*	.			trans	-100.8	72.7	-177.6	-67.9	174.1	164.6	-165.1	0	110.9	Y193 A201 F202	K191-Y193 PolarHBondContact O-N 3.44Å; K191-A201 HydrophobicContact CB-CB 3.62Å; K191-A201 HydrophobicContact CD-CB 4.13Å; K191-A201 VanDerWaalsContact CD-O 3.32Å; K191-A201 WeakPolarHBondContact CD-O 3.43Å; K191-A201 HydrophobicContact CG-CB 4.47Å; K191-F202 CarbonylContact C-O 3.31Å; K191-F202 WeakPolarHBondContact CA-O 3.28Å
192	L	58.9	Low	59.4	Low	98 Å²	98	85.9 Å²	85.9	51%	0.513	45%	0.453	S	S	.	.			trans	-68	-28	-174.6	-77.2	146.3	0	0	0	114.6	I185 E190 F202	I185-L192 HydrophobicContact CB-CD1 4.45Å; I185-L192 HydrophobicContact CD1-CD1 3.62Å; I185-L192 HydrophobicContact CG1-CD1 3.79Å; I185-L192 HydrophobicContact CG2-CD1 3.77Å; E190-L192 HydrophobicContact CB-CD1 4.48Å; E190-L192 PolarHBondContact O-N 3.2Å; L192-F202 PolarHBondContact N-O 3.1Å
193	Y	64.6	Low	59.9	Low	88 Å²	88	85.2 Å²	85.2	35%	0.345	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	96	-172.1	-59.4	-76.9	0	0	0	111.5	K191 F202 R204 S205	K191-Y193 PolarHBondContact O-N 3.44Å; Y193-F202 PolarHBondContact N-O 3.24Å; Y193-F202 WeakPolarHBondContact O-CD2 3.35Å; Y193-F202 PolarHBondContact O-N 3.37Å; Y193-R204 VanDerWaalsContact CD2-C 3.41Å; Y193-S205 VanDerWaalsContact CD2-N 3.32Å
194	K	61.1	Low	60.7	Low	145 Å²	145	86.2 Å²	86.2	63%	0.63	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	142.2	179.6	-62.9	-179.6	-178.2	173.9	0	112	E200 A201 L208	K194-E200 CarbonylContact C-O 3.56Å; K194-E200 WeakPolarHBondContact CA-O 3.29Å; K194-A201 HydrophobicContact CG-CB 3.85Å; K194-L208 WeakPolarHBondContact O-CD2 3.44Å
195	C	70.8	Confident	61.3	Low	2 Å²	2	84.1 Å²	84.1	1%	0.014	44%	0.443	C	S	.	.			trans	-85.4	122.2	166.9	-175.2	0	0	0	0	109.5	E197 C198 G199 E200 F202 L208	C195-E197 VanDerWaalsContact C-N 3.3Å; C195-E197 PolarHBondContact O-N 3.14Å; C195-C198 VanDerWaalsContact CB-SG 3.56Å; C195-C198 VanDerWaalsContact SG-SG 3.62Å; C195-G199 WeakPolarHBondContact O-CA 3.26Å; C195-G199 PolarHBondContact O-N 3.37Å; C195-E200 PolarHBondContact N-O 2.85Å; C195-F202 HydrophobicContact CB-CE2 4.44Å; C195-L208 HydrophobicContact CB-CD1 3.58Å
196	E	65.6	Low	61.9	Low	180 Å²	180	85.8 Å²	85.8	84%	0.841	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-23.5	-177.9	-66.3	165.6	154.7	0	0	112.7
197	E	61.3	Low	62.6	Low	135 Å²	135	86 Å²	86	63%	0.631	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-22.7	-177.5	-63.1	174.3	138.5	0	0	113.5	C195 H215	C195-E197 VanDerWaalsContact C-N 3.3Å; C195-E197 PolarHBondContact O-N 3.14Å; E197-H215 WeakPolarHBondContact OE2-CB 3.46Å; E197-H215 IonicContact OE2-CD2 3.91Å; E197-H215 PolarHBondContact OE2-CD2 3.31Å; E197-H215 IonicContact OE2-CG 3.72Å; E197-H215 VanDerWaalsContact OE2-CG 3.25Å
198	C	68.3	Low	63.5	Low	52 Å²	52	80.1 Å²	80.1	35%	0.351	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138	-5.6	-175.9	74	0	0	0	0	115.3	C195 E200 H211 H215	C195-C198 VanDerWaalsContact CB-SG 3.56Å; C195-C198 VanDerWaalsContact SG-SG 3.62Å; C198-E200 VanDerWaalsContact C-N 3.25Å; C198-E200 PolarHBondContact O-N 3.01Å; C198-E200 PolarHBondContact SG-N 3.38Å; C198-H211 PolarHBondContact SG-NE2 3.28Å; C198-H215 WeakPolarHBondContact CB-NE2 3.48Å
199	G	66.1	Low	64.1	Low	55 Å²	55	81.1 Å²	81.1	57%	0.567	43%	0.431	S	S	*	.			trans	76.5	-5.4	-178.6	0	0	0	0	0	115.9	C195 A201	C195-G199 WeakPolarHBondContact O-CA 3.26Å; C195-G199 PolarHBondContact O-N 3.37Å; G199-A201 PolarHBondContact O-N 2.94Å
200	E	65.9	Low	64.6	Low	107 Å²	107	81.9 Å²	81.9	50%	0.5	43%	0.425	S	S	.	.			trans	-65.5	133.6	-178.5	-71.8	-156.1	150.3	0	0	112.1	K194 C195 C198 F202 H211	K194-E200 CarbonylContact C-O 3.56Å; K194-E200 WeakPolarHBondContact CA-O 3.29Å; C195-E200 PolarHBondContact N-O 2.85Å; C198-E200 VanDerWaalsContact C-N 3.25Å; C198-E200 PolarHBondContact O-N 3.01Å; C198-E200 PolarHBondContact SG-N 3.38Å; E200-F202 HydrophobicContact CB-CE2 3.75Å; E200-F202 HydrophobicContact CB-CZ 3.72Å; E200-F202 WeakPolarHBondContact O-CE2 3.47Å; E200-H211 IonicContact OE2-CE1 3.32Å; E200-H211 PolarHBondContact OE2-CE1 2.99Å; E200-H211 IonicContact OE2-ND1 3.25Å; E200-H211 PolarHBondContact OE2-ND1 3.46Å
201	A	67.3	Low	65.3	Low	25 Å²	25	77.5 Å²	77.5	21%	0.207	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.8	-174.1	0	0	0	0	0	111.9	K191 K194 G199	K191-A201 HydrophobicContact CB-CB 3.62Å; K191-A201 HydrophobicContact CD-CB 4.13Å; K191-A201 VanDerWaalsContact CD-O 3.32Å; K191-A201 WeakPolarHBondContact CD-O 3.43Å; K191-A201 HydrophobicContact CG-CB 4.47Å; K194-A201 HydrophobicContact CG-CB 3.85Å; G199-A201 PolarHBondContact O-N 2.94Å
202	F	74	Confident	65.7	Low	35 Å²	35	75.2 Å²	75.2	15%	0.154	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	148.7	-173.6	-57.8	-83.4	0	0	0	111.8	K191 L192 Y193 C195 E200 N207 L208 H211	K191-F202 CarbonylContact C-O 3.31Å; K191-F202 WeakPolarHBondContact CA-O 3.28Å; L192-F202 PolarHBondContact N-O 3.1Å; Y193-F202 PolarHBondContact N-O 3.24Å; Y193-F202 WeakPolarHBondContact O-CD2 3.35Å; Y193-F202 PolarHBondContact O-N 3.37Å; C195-F202 HydrophobicContact CB-CE2 4.44Å; E200-F202 HydrophobicContact CB-CE2 3.75Å; E200-F202 HydrophobicContact CB-CZ 3.72Å; E200-F202 WeakPolarHBondContact O-CE2 3.47Å; F202-N207 HydrophobicContact CB-CB 4.06Å; F202-N207 HydrophobicContact CD1-CB 3.92Å; F202-N207 HydrophobicContact CG-CB 4.22Å; F202-L208 HydrophobicContact CB-CB 4.34Å; F202-L208 HydrophobicContact CD2-CB 3.87Å; F202-L208 HydrophobicContact CD2-CD1 3.82Å; F202-L208 HydrophobicContact CD2-CG 4.44Å; F202-L208 HydrophobicContact CE2-CD1 4Å; F202-L208 HydrophobicContact CG-CB 4.3Å; F202-H211 HydrophobicContact CE1-CB 4.22Å; F202-H211 HydrophobicContact CE2-CB 3.95Å; F202-H211 AromaticContact CE2-CG 3.78Å; F202-H211 HydrophobicContact CZ-CB 3.67Å; F202-H211 AromaticContact CZ-CE1 3.94Å; F202-H211 AromaticContact CZ-CG 3.45Å; F202-H211 VanDerWaalsContact CZ-CG 3.45Å; F202-H211 AromaticContact CZ-ND1 3.34Å; F202-H211 VanDerWaalsContact CZ-ND1 3.34Å; F202-H211 WeakPolarHBondContact CZ-ND1 3.48Å
203	N	60.6	Low	66	Low	58 Å²	58	72.4 Å²	72.4	31%	0.31	38%	0.38	S	S	.	.	S	Bend	trans	-85.7	-5.3	178.1	61.3	-4.1	0	0	0	114	N207	N203-N207 PolarHBondContact OD1-ND2 2.84Å; N203-N207 VanDerWaalsContact OD1-ND2 3.12Å
204	R	66.1	Low	65.9	Low	128 Å²	128	71.9 Å²	71.9	48%	0.483	38%	0.382	S	S	.	.	S	Bend	trans	-143.3	138.7	178.1	-66.1	-178.9	173.7	-177.4	-6	109.8	I186 Y193 S206 N207 L208	I186-R204 VanDerWaalsContact CD1-NH2 3.26Å; Y193-R204 VanDerWaalsContact CD2-C 3.41Å; R204-S206 VanDerWaalsContact C-N 3.26Å; R204-S206 PolarHBondContact O-N 2.98Å; R204-N207 HydrophobicContact CB-CB 4.4Å; R204-N207 WeakPolarHBondContact O-CB 3.43Å; R204-N207 PolarHBondContact O-N 3.03Å; R204-L208 PolarHBondContact O-N 2.82Å
205	S	61.7	Low	66	Low	61 Å²	61	69.5 Å²	69.5	43%	0.427	37%	0.374	S	S	.	.	H	α-helix	trans	-57.2	-39.1	175.7	54.3	0	0	0	0	112.1	Y193 N207 L208 T209	Y193-S205 VanDerWaalsContact CD2-N 3.32Å; S205-N207 VanDerWaalsContact C-N 3.26Å; S205-N207 PolarHBondContact O-N 3.42Å; S205-L208 PolarHBondContact O-N 3.38Å; S205-L208 VanDerWaalsContact O-N 3.13Å; S205-T209 PolarHBondContact O-N 3.08Å; S205-T209 PolarHBondContact O-OG1 3Å; S205-T209 VanDerWaalsContact O-OG1 3.06Å
206	S	65.4	Low	65.6	Low	65 Å²	65	73.6 Å²	73.6	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-61.7	-29	175.5	54.1	0	0	0	0	114.2	R204 T210	R204-S206 VanDerWaalsContact C-N 3.26Å; R204-S206 PolarHBondContact O-N 2.98Å; S206-T210 WeakPolarHBondContact O-CG2 3.38Å; S206-T210 PolarHBondContact O-N 3.16Å; S206-T210 PolarHBondContact O-OG1 3.12Å
207	N	67.5	Low	65.4	Low	63 Å²	63	66.9 Å²	66.9	34%	0.337	38%	0.377	S	S	.	.	H	α-helix	trans	-75.2	-39.6	174.6	-67.9	-15.3	0	0	0	110.8	F202 N203 R204 S205 T210 H211	F202-N207 HydrophobicContact CB-CB 4.06Å; F202-N207 HydrophobicContact CD1-CB 3.92Å; F202-N207 HydrophobicContact CG-CB 4.22Å; N203-N207 PolarHBondContact OD1-ND2 2.84Å; N203-N207 VanDerWaalsContact OD1-ND2 3.12Å; R204-N207 HydrophobicContact CB-CB 4.4Å; R204-N207 WeakPolarHBondContact O-CB 3.43Å; R204-N207 PolarHBondContact O-N 3.03Å; S205-N207 VanDerWaalsContact C-N 3.26Å; S205-N207 PolarHBondContact O-N 3.42Å; N207-T210 WeakPolarHBondContact CA-OG1 3.34Å; N207-T210 PolarHBondContact O-OG1 3.34Å; N207-T210 VanDerWaalsContact O-OG1 3.11Å; N207-H211 WeakPolarHBondContact O-CB 3.3Å; N207-H211 PolarHBondContact O-N 3.29Å
208	L	68.4	Low	65.5	Low	20 Å²	20	66.1 Å²	66.1	11%	0.105	37%	0.374	C	S	.	.	H	α-helix	trans	-64.2	-43.5	171.1	175.7	60.8	0	0	0	111.7	K194 C195 F202 R204 S205 T210 H211 K212	K194-L208 WeakPolarHBondContact O-CD2 3.44Å; C195-L208 HydrophobicContact CB-CD1 3.58Å; F202-L208 HydrophobicContact CB-CB 4.34Å; F202-L208 HydrophobicContact CD2-CB 3.87Å; F202-L208 HydrophobicContact CD2-CD1 3.82Å; F202-L208 HydrophobicContact CD2-CG 4.44Å; F202-L208 HydrophobicContact CE2-CD1 4Å; F202-L208 HydrophobicContact CG-CB 4.3Å; R204-L208 PolarHBondContact O-N 2.82Å; S205-L208 PolarHBondContact O-N 3.38Å; S205-L208 VanDerWaalsContact O-N 3.13Å; L208-T210 PolarHBondContact O-N 3.38Å; L208-H211 WeakPolarHBondContact O-CB 3.43Å; L208-H211 PolarHBondContact O-N 3.26Å; L208-K212 HydrophobicContact CD1-CG 4.25Å; L208-K212 WeakPolarHBondContact O-CG 3.32Å; L208-K212 PolarHBondContact O-N 3.04Å
209	T	65.9	Low	65.7	Low	90 Å²	90	68.9 Å²	68.9	55%	0.552	38%	0.38	S	S	*	.	H	α-helix	trans	-61.8	-42.7	177.9	-55.3	0	0	0	0	111.4	S205 H211 K212 I213	S205-T209 PolarHBondContact O-N 3.08Å; S205-T209 PolarHBondContact O-OG1 3Å; S205-T209 VanDerWaalsContact O-OG1 3.06Å; T209-H211 VanDerWaalsContact C-N 3.34Å; T209-K212 PolarHBondContact O-N 2.83Å; T209-I213 WeakPolarHBondContact O-CG1 3.44Å
210	T	63.5	Low	66.1	Low	67 Å²	67	69.7 Å²	69.7	41%	0.411	38%	0.375	S	S	.	.	H	α-helix	trans	-71.9	-26	176	48.1	0	0	0	0	113.6	S206 N207 L208	S206-T210 WeakPolarHBondContact O-CG2 3.38Å; S206-T210 PolarHBondContact O-N 3.16Å; S206-T210 PolarHBondContact O-OG1 3.12Å; N207-T210 WeakPolarHBondContact CA-OG1 3.34Å; N207-T210 PolarHBondContact O-OG1 3.34Å; N207-T210 VanDerWaalsContact O-OG1 3.11Å; L208-T210 PolarHBondContact O-N 3.38Å
211	H	69.8	Low	66.3	Low	20 Å²	20	69.4 Å²	69.4	9%	0.093	37%	0.37	C	S	.	.	H	α-helix	trans	-70.9	-41.7	169.7	178.2	98.1	0	0	0	112.2	C198 E200 F202 N207 L208 T209 I213 I214 H215	C198-H211 PolarHBondContact SG-NE2 3.28Å; E200-H211 IonicContact OE2-CE1 3.32Å; E200-H211 PolarHBondContact OE2-CE1 2.99Å; E200-H211 IonicContact OE2-ND1 3.25Å; E200-H211 PolarHBondContact OE2-ND1 3.46Å; F202-H211 HydrophobicContact CE1-CB 4.22Å; F202-H211 HydrophobicContact CE2-CB 3.95Å; F202-H211 AromaticContact CE2-CG 3.78Å; F202-H211 HydrophobicContact CZ-CB 3.67Å; F202-H211 AromaticContact CZ-CE1 3.94Å; F202-H211 AromaticContact CZ-CG 3.45Å; F202-H211 VanDerWaalsContact CZ-CG 3.45Å; F202-H211 AromaticContact CZ-ND1 3.34Å; F202-H211 VanDerWaalsContact CZ-ND1 3.34Å; F202-H211 WeakPolarHBondContact CZ-ND1 3.48Å; N207-H211 WeakPolarHBondContact O-CB 3.3Å; N207-H211 PolarHBondContact O-N 3.29Å; L208-H211 WeakPolarHBondContact O-CB 3.43Å; L208-H211 PolarHBondContact O-N 3.26Å; T209-H211 VanDerWaalsContact C-N 3.34Å; H211-I213 PolarHBondContact O-N 3.26Å; H211-I213 VanDerWaalsContact O-N 3.12Å; H211-I214 WeakPolarHBondContact O-CB 3.5Å; H211-I214 VanDerWaalsContact O-CG1 3.29Å; H211-I214 WeakPolarHBondContact O-CG1 3.48Å; H211-I214 PolarHBondContact O-N 3.01Å; H211-H215 AromaticContact NE2-CD2 3.95Å
212	K	66.1	Low	66.4	Low	86 Å²	86	74.6 Å²	74.6	37%	0.374	39%	0.388	S	S	.	.	H	α-helix	trans	-57.6	-28.1	178.4	-75	-172.1	174.3	-163.5	0	113.4	L208 T209 I214 H215 T216	L208-K212 HydrophobicContact CD1-CG 4.25Å; L208-K212 WeakPolarHBondContact O-CG 3.32Å; L208-K212 PolarHBondContact O-N 3.04Å; T209-K212 PolarHBondContact O-N 2.83Å; K212-I214 PolarHBondContact O-N 3.46Å; K212-H215 PolarHBondContact O-N 3.38Å; K212-H215 VanDerWaalsContact O-N 3.08Å; K212-T216 PolarHBondContact O-N 3.17Å; K212-T216 VanDerWaalsContact O-N 3.16Å
213	I	67.1	Low	66.5	Low	39 Å²	39	73 Å²	73	20%	0.2	38%	0.381	C	S	.	.	H	α-helix	trans	-60.7	-25.2	173.2	-52.9	175	0	0	0	112	T209 H211 T216 G217 E218 I231	T209-I213 WeakPolarHBondContact O-CG1 3.44Å; H211-I213 PolarHBondContact O-N 3.26Å; H211-I213 VanDerWaalsContact O-N 3.12Å; I213-T216 WeakPolarHBondContact CA-OG1 3.39Å; I213-T216 PolarHBondContact O-OG1 3.02Å; I213-G217 PolarHBondContact O-N 2.89Å; I213-G217 VanDerWaalsContact O-N 3.12Å; I213-E218 HydrophobicContact CG2-CB 4.07Å; I213-E218 WeakPolarHBondContact CG2-O 3.31Å; I213-I231 HydrophobicContact CB-CG2 4.41Å; I213-I231 HydrophobicContact CG2-CG2 3.85Å
214	I	62.7	Low	67.1	Low	76 Å²	76	78.1 Å²	78.1	39%	0.39	40%	0.403	S	S	.	.	H	α-helix	trans	-69	-37.4	176.4	-55	173.5	0	0	0	110.8	H211 K212 W232	H211-I214 WeakPolarHBondContact O-CB 3.5Å; H211-I214 VanDerWaalsContact O-CG1 3.29Å; H211-I214 WeakPolarHBondContact O-CG1 3.48Å; H211-I214 PolarHBondContact O-N 3.01Å; K212-I214 PolarHBondContact O-N 3.46Å; I214-W232 HydrophobicContact CD1-CZ2 4.28Å
215	H	62.9	Low	67.1	Low	96 Å²	96	78 Å²	78	44%	0.444	41%	0.408	S	S	.	.	H	α-helix	trans	-77.6	-41.8	178.7	-62.4	-51.2	0	0	0	112.5	E197 C198 H211 K212 G217	E197-H215 WeakPolarHBondContact OE2-CB 3.46Å; E197-H215 IonicContact OE2-CD2 3.91Å; E197-H215 PolarHBondContact OE2-CD2 3.31Å; E197-H215 IonicContact OE2-CG 3.72Å; E197-H215 VanDerWaalsContact OE2-CG 3.25Å; C198-H215 WeakPolarHBondContact CB-NE2 3.48Å; H211-H215 AromaticContact NE2-CD2 3.95Å; K212-H215 PolarHBondContact O-N 3.38Å; K212-H215 VanDerWaalsContact O-N 3.08Å; H215-G217 PolarHBondContact O-N 2.86Å
216	T	62.6	Low	67.4	Low	88 Å²	88	77.5 Å²	77.5	54%	0.54	40%	0.404	S	S	.	.	H	α-helix	trans	-68.3	-18	174.9	64.1	0	0	0	0	112.8	K212 I213 E218	K212-T216 PolarHBondContact O-N 3.17Å; K212-T216 VanDerWaalsContact O-N 3.16Å; I213-T216 WeakPolarHBondContact CA-OG1 3.39Å; I213-T216 PolarHBondContact O-OG1 3.02Å; T216-E218 PolarHBondContact O-N 3.46Å
217	G	60.2	Low	67.6	Low	38 Å²	38	77.4 Å²	77.4	39%	0.392	41%	0.413	S	S	.	.			trans	70.3	6.8	179.3	0	0	0	0	0	114.2	I213 H215	I213-G217 PolarHBondContact O-N 2.89Å; I213-G217 VanDerWaalsContact O-N 3.12Å; H215-G217 PolarHBondContact O-N 2.86Å
218	E	64.3	Low	67.6	Low	119 Å²	119	80.4 Å²	80.4	56%	0.556	42%	0.423	S	S	*	.			trans	-61.2	141	179.3	-73.2	-175.7	168.1	0	0	111.3	I213 T216	I213-E218 HydrophobicContact CG2-CB 4.07Å; I213-E218 WeakPolarHBondContact CG2-O 3.31Å; T216-E218 PolarHBondContact O-N 3.46Å
219	K	72.4	Confident	67.9	Low	110 Å²	110	81.2 Å²	81.2	48%	0.478	43%	0.433	S	S	.	.			trans	-129.4	77.2	-177.3	-72.7	162	-172.8	164.6	0	109.5	Y221 A229 F230 I231	K219-Y221 PolarHBondContact O-N 3.04Å; K219-A229 HydrophobicContact CB-CB 3.46Å; K219-A229 VanDerWaalsContact CB-CB 3.46Å; K219-A229 HydrophobicContact CD-CB 4.22Å; K219-A229 HydrophobicContact CG-CB 4.4Å; K219-F230 CarbonylContact C-O 3.14Å; K219-F230 VanDerWaalsContact C-O 3.27Å; K219-F230 WeakPolarHBondContact CA-O 3.39Å; K219-I231 HydrophobicContact CG-CG1 3.86Å
220	P	73.1	Confident	68.3	Low	73 Å²	73	79 Å²	79	47%	0.474	42%	0.416	S	S	.	.			trans	-62.6	-27.7	-171.8	-23.4	34.9	0	0	0	113.3	K222	P220-K222 PolarHBondContact O-N 3.12Å
221	Y	71.4	Confident	68.6	Low	100 Å²	100	77.7 Å²	77.7	39%	0.392	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	92.6	-170.7	-57.6	-74.1	0	0	0	111.4	K219 F230 I231 W232 S233	K219-Y221 PolarHBondContact O-N 3.04Å; Y221-F230 PolarHBondContact N-O 3.25Å; Y221-F230 VanDerWaalsContact N-O 3.07Å; Y221-F230 PolarHBondContact O-N 3.18Å; Y221-I231 WeakPolarHBondContact CD2-O 3.38Å; Y221-I231 WeakPolarHBondContact CE2-O 3.27Å; Y221-W232 VanDerWaalsContact CD2-C 3.45Å; Y221-S233 VanDerWaalsContact CD2-N 3.26Å
222	K	69.6	Low	68.8	Low	134 Å²	134	82.7 Å²	82.7	58%	0.583	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	150.3	178.1	-64.9	177.9	-176.4	172.8	0	112.4	P220 K228 A229 L236	P220-K222 PolarHBondContact O-N 3.12Å; K222-K228 CarbonylContact C-O 3.58Å; K222-A229 HydrophobicContact CG-CB 3.93Å; K222-L236 VanDerWaalsContact O-CD2 3.24Å; K222-L236 WeakPolarHBondContact O-CD2 3.25Å
223	C	76.4	Confident	68.9	Low	1 Å²	1	81.4 Å²	81.4	1%	0.007	43%	0.426	C	S	.	.			trans	-102.6	102.6	174.9	-179	0	0	0	0	110	E225 C226 G227 K228 F230 L236 H239 H243	C223-E225 PolarHBondContact O-N 2.98Å; C223-E225 VanDerWaalsContact O-N 3.09Å; C223-C226 PolarHBondContact O-N 2.89Å; C223-C226 VanDerWaalsContact SG-SG 3.65Å; C223-G227 WeakPolarHBondContact O-CA 3.19Å; C223-G227 PolarHBondContact O-N 3.23Å; C223-K228 VanDerWaalsContact CB-O 3.3Å; C223-K228 WeakPolarHBondContact CB-O 3.44Å; C223-K228 PolarHBondContact N-O 3.23Å; C223-F230 HydrophobicContact CB-CE2 4.33Å; C223-L236 HydrophobicContact CB-CD1 3.53Å; C223-H239 VanDerWaalsContact SG-CD2 3.56Å; C223-H243 PolarHBondContact SG-NE2 3.34Å; C223-H243 VanDerWaalsContact SG-NE2 3.39Å
224	E	71.6	Confident	69	Low	166 Å²	166	83.1 Å²	83.1	78%	0.776	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-33	179.6	-52.3	-44.1	119.8	0	0	114	C226	E224-C226 VanDerWaalsContact C-N 3.34Å; E224-C226 PolarHBondContact O-N 3.29Å
225	E	66.6	Low	69.3	Low	125 Å²	125	81.6 Å²	81.6	58%	0.584	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-14.8	-178.2	-63.1	175.8	130.7	0	0	114.2	C223 H243	C223-E225 PolarHBondContact O-N 2.98Å; C223-E225 VanDerWaalsContact O-N 3.09Å; E225-H243 WeakPolarHBondContact OE2-CB 3.46Å; E225-H243 IonicContact OE2-CD2 3.4Å; E225-H243 PolarHBondContact OE2-CD2 3.22Å; E225-H243 IonicContact OE2-CG 3.35Å
226	C	69	Low	69.8	Low	52 Å²	52	77.8 Å²	77.8	35%	0.351	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.2	11.7	-178.5	73.8	0	0	0	0	116.5	C223 E224 K228 H239 H243	C223-C226 PolarHBondContact O-N 2.89Å; C223-C226 VanDerWaalsContact SG-SG 3.65Å; E224-C226 VanDerWaalsContact C-N 3.34Å; E224-C226 PolarHBondContact O-N 3.29Å; C226-K228 PolarHBondContact O-N 3.24Å; C226-H239 PolarHBondContact SG-NE2 3.33Å; C226-H243 PolarHBondContact SG-NE2 2.83Å; C226-H243 VanDerWaalsContact SG-NE2 3.38Å
227	G	69.4	Low	70.2	Confident	62 Å²	62	77.7 Å²	77.7	64%	0.639	42%	0.418	S	S	*	.			trans	68.9	-3.9	179	0	0	0	0	0	116.3	C223 A229	C223-G227 WeakPolarHBondContact O-CA 3.19Å; C223-G227 PolarHBondContact O-N 3.23Å; G227-A229 PolarHBondContact O-N 2.96Å
228	K	66.8	Low	70.5	Confident	126 Å²	126	79.9 Å²	79.9	55%	0.548	42%	0.418	S	S	.	.			trans	-70.7	127.8	-175.9	-70.8	-176.8	-179.7	-178.2	0	111.8	K222 C223 C226 F230	K222-K228 CarbonylContact C-O 3.58Å; C223-K228 VanDerWaalsContact CB-O 3.3Å; C223-K228 WeakPolarHBondContact CB-O 3.44Å; C223-K228 PolarHBondContact N-O 3.23Å; C226-K228 PolarHBondContact O-N 3.24Å; K228-F230 HydrophobicContact CB-CE2 3.75Å; K228-F230 HydrophobicContact CB-CZ 4.03Å; K228-F230 WeakPolarHBondContact O-CD2 3.49Å; K228-F230 WeakPolarHBondContact O-CE2 3.28Å
229	A	74	Confident	71	Confident	37 Å²	37	75 Å²	75	31%	0.306	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	141.8	-179.5	0	0	0	0	0	111.7	K219 K222 G227	K219-A229 HydrophobicContact CB-CB 3.46Å; K219-A229 VanDerWaalsContact CB-CB 3.46Å; K219-A229 HydrophobicContact CD-CB 4.22Å; K219-A229 HydrophobicContact CG-CB 4.4Å; K222-A229 HydrophobicContact CG-CB 3.93Å; G227-A229 PolarHBondContact O-N 2.96Å
230	F	75.1	Confident	70.8	Confident	43 Å²	43	74.4 Å²	74.4	19%	0.189	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.2	-176	-62.3	-90.9	0	0	0	111.3	K219 Y221 C223 K228 L236 H239	K219-F230 CarbonylContact C-O 3.14Å; K219-F230 VanDerWaalsContact C-O 3.27Å; K219-F230 WeakPolarHBondContact CA-O 3.39Å; Y221-F230 PolarHBondContact N-O 3.25Å; Y221-F230 VanDerWaalsContact N-O 3.07Å; Y221-F230 PolarHBondContact O-N 3.18Å; C223-F230 HydrophobicContact CB-CE2 4.33Å; K228-F230 HydrophobicContact CB-CE2 3.75Å; K228-F230 HydrophobicContact CB-CZ 4.03Å; K228-F230 WeakPolarHBondContact O-CD2 3.49Å; K228-F230 WeakPolarHBondContact O-CE2 3.28Å; F230-L236 HydrophobicContact CB-CB 4.25Å; F230-L236 HydrophobicContact CD2-CB 4Å; F230-L236 HydrophobicContact CD2-CD1 3.8Å; F230-L236 HydrophobicContact CD2-CG 4.5Å; F230-L236 HydrophobicContact CE2-CD1 4.03Å; F230-L236 HydrophobicContact CG-CB 4.24Å; F230-H239 HydrophobicContact CE1-CB 3.97Å; F230-H239 HydrophobicContact CE2-CB 3.92Å; F230-H239 AromaticContact CE2-CD2 3.44Å; F230-H239 VanDerWaalsContact CE2-CD2 3.44Å; F230-H239 WeakPolarHBondContact CE2-CD2 3.19Å; F230-H239 AromaticContact CE2-CG 3.63Å; F230-H239 HydrophobicContact CZ-CB 3.49Å; F230-H239 VanDerWaalsContact CZ-CB 3.49Å; F230-H239 AromaticContact CZ-CD2 3.51Å; F230-H239 AromaticContact CZ-CG 3.22Å; F230-H239 AromaticContact CZ-ND1 3.67Å
231	I	68.9	Low	70.7	Confident	41 Å²	41	76.1 Å²	76.1	21%	0.21	39%	0.392	C	S	.	.	S	Bend	trans	-74.2	-32.1	178.2	-56.2	180	0	0	0	110.8	I213 K219 Y221	I213-I231 HydrophobicContact CB-CG2 4.41Å; I213-I231 HydrophobicContact CG2-CG2 3.85Å; K219-I231 HydrophobicContact CG-CG1 3.86Å; Y221-I231 WeakPolarHBondContact CD2-O 3.38Å; Y221-I231 WeakPolarHBondContact CE2-O 3.27Å
232	W	74.3	Confident	70.4	Confident	124 Å²	124	74.9 Å²	74.9	47%	0.47	39%	0.392	S	S	.	.	S	Bend	trans	-126.5	137.8	-177.2	-54.7	-47.7	0	0	0	113	I214 Y221 S234 T235 L236	I214-W232 HydrophobicContact CD1-CZ2 4.28Å; Y221-W232 VanDerWaalsContact CD2-C 3.45Å; W232-S234 PolarHBondContact O-N 2.86Å; W232-T235 HydrophobicContact CB-CG2 4.49Å; W232-T235 HydrophobicContact CE3-CG2 3.93Å; W232-T235 PolarHBondContact O-N 2.8Å; W232-T235 PolarHBondContact O-OG1 3.38Å; W232-L236 PolarHBondContact O-N 3.09Å; W232-L236 VanDerWaalsContact O-N 3.15Å
233	S	68.4	Low	70.2	Confident	59 Å²	59	71.2 Å²	71.2	41%	0.413	38%	0.377	S	S	.	.	H	α-helix	trans	-57.3	-32.8	176.8	59.4	0	0	0	0	113.4	Y221 L236 T237	Y221-S233 VanDerWaalsContact CD2-N 3.26Å; S233-L236 PolarHBondContact O-N 3.06Å; S233-T237 WeakPolarHBondContact O-CB 3.11Å; S233-T237 PolarHBondContact O-N 2.83Å; S233-T237 PolarHBondContact O-OG1 2.89Å
234	S	69.7	Low	69.5	Low	76 Å²	76	75.1 Å²	75.1	53%	0.531	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-44.3	173.8	54.3	0	0	0	0	112.1	W232 T237 E238	W232-S234 PolarHBondContact O-N 2.86Å; S234-T237 WeakPolarHBondContact O-CB 3.26Å; S234-T237 PolarHBondContact O-N 3.46Å; S234-E238 PolarHBondContact O-N 3.18Å
235	T	69.6	Low	68.7	Low	44 Å²	44	78.1 Å²	78.1	27%	0.27	41%	0.405	S	S	.	.	H	α-helix	trans	-73.1	-34.2	178.7	60.7	0	0	0	0	112.6	W232 T237 E238 H239	W232-T235 HydrophobicContact CB-CG2 4.49Å; W232-T235 HydrophobicContact CE3-CG2 3.93Å; W232-T235 PolarHBondContact O-N 2.8Å; W232-T235 PolarHBondContact O-OG1 3.38Å; T235-T237 VanDerWaalsContact C-N 3.35Å; T235-E238 PolarHBondContact O-N 3.02Å; T235-H239 VanDerWaalsContact O-CB 3.27Å; T235-H239 WeakPolarHBondContact O-CB 3.46Å; T235-H239 PolarHBondContact O-N 2.87Å
236	L	72.5	Confident	68.4	Low	15 Å²	15	80 Å²	80	8%	0.079	41%	0.411	C	S	.	.	H	α-helix	trans	-62.1	-42.2	167.2	173.6	62.4	0	0	0	111.6	K222 C223 F230 W232 S233 E238 H239 K240	K222-L236 VanDerWaalsContact O-CD2 3.24Å; K222-L236 WeakPolarHBondContact O-CD2 3.25Å; C223-L236 HydrophobicContact CB-CD1 3.53Å; F230-L236 HydrophobicContact CB-CB 4.25Å; F230-L236 HydrophobicContact CD2-CB 4Å; F230-L236 HydrophobicContact CD2-CD1 3.8Å; F230-L236 HydrophobicContact CD2-CG 4.5Å; F230-L236 HydrophobicContact CE2-CD1 4.03Å; F230-L236 HydrophobicContact CG-CB 4.24Å; W232-L236 PolarHBondContact O-N 3.09Å; W232-L236 VanDerWaalsContact O-N 3.15Å; S233-L236 PolarHBondContact O-N 3.06Å; L236-E238 VanDerWaalsContact C-N 3.34Å; L236-E238 PolarHBondContact O-N 3.13Å; L236-H239 WeakPolarHBondContact O-CB 3.43Å; L236-H239 PolarHBondContact O-N 3.47Å; L236-K240 HydrophobicContact CD1-CG 4.39Å; L236-K240 WeakPolarHBondContact O-CG 3.41Å; L236-K240 PolarHBondContact O-N 2.8Å
237	T	70.8	Confident	68.4	Low	86 Å²	86	82.8 Å²	82.8	53%	0.528	42%	0.417	S	S	.	.	H	α-helix	trans	-66.6	-36.5	179.5	-58.7	0	0	0	0	111.9	S233 S234 T235	S233-T237 WeakPolarHBondContact O-CB 3.11Å; S233-T237 PolarHBondContact O-N 2.83Å; S233-T237 PolarHBondContact O-OG1 2.89Å; S234-T237 WeakPolarHBondContact O-CB 3.26Å; S234-T237 PolarHBondContact O-N 3.46Å; T235-T237 VanDerWaalsContact C-N 3.35Å
238	E	66.9	Low	68.6	Low	84 Å²	84	84 Å²	84	39%	0.393	41%	0.414	S	S	.	.	H	α-helix	trans	-67.2	-42.9	169.3	179.8	163.4	-136.8	0	0	112	S234 T235 L236 K240 K241 W260	S234-E238 PolarHBondContact O-N 3.18Å; T235-E238 PolarHBondContact O-N 3.02Å; L236-E238 VanDerWaalsContact C-N 3.34Å; L236-E238 PolarHBondContact O-N 3.13Å; E238-K240 VanDerWaalsContact C-N 3.34Å; E238-K240 PolarHBondContact O-N 3.41Å; E238-K241 WeakPolarHBondContact O-CB 3.41Å; E238-K241 WeakPolarHBondContact O-CG 3.37Å; E238-K241 PolarHBondContact O-N 2.89Å; E238-W260 HydrophobicContact CG-CZ2 4.08Å; E238-W260 PolarHBondContact OE1-NE1 2.89Å
239	H	73.8	Confident	69	Low	18 Å²	18	82.8 Å²	82.8	8%	0.083	41%	0.407	C	S	.	.	H	α-helix	trans	-60.1	-38.8	177.7	174.9	64.8	0	0	0	113.1	C223 C226 F230 T235 L236 K241 I242 H243	C223-H239 VanDerWaalsContact SG-CD2 3.56Å; C226-H239 PolarHBondContact SG-NE2 3.33Å; F230-H239 HydrophobicContact CE1-CB 3.97Å; F230-H239 HydrophobicContact CE2-CB 3.92Å; F230-H239 AromaticContact CE2-CD2 3.44Å; F230-H239 VanDerWaalsContact CE2-CD2 3.44Å; F230-H239 WeakPolarHBondContact CE2-CD2 3.19Å; F230-H239 AromaticContact CE2-CG 3.63Å; F230-H239 HydrophobicContact CZ-CB 3.49Å; F230-H239 VanDerWaalsContact CZ-CB 3.49Å; F230-H239 AromaticContact CZ-CD2 3.51Å; F230-H239 AromaticContact CZ-CG 3.22Å; F230-H239 AromaticContact CZ-ND1 3.67Å; T235-H239 VanDerWaalsContact O-CB 3.27Å; T235-H239 WeakPolarHBondContact O-CB 3.46Å; T235-H239 PolarHBondContact O-N 2.87Å; L236-H239 WeakPolarHBondContact O-CB 3.43Å; L236-H239 PolarHBondContact O-N 3.47Å; H239-K241 PolarHBondContact O-N 3.24Å; H239-K241 VanDerWaalsContact O-N 3.09Å; H239-I242 VanDerWaalsContact O-CB 3.26Å; H239-I242 WeakPolarHBondContact O-CB 3.47Å; H239-I242 WeakPolarHBondContact O-CG1 3.24Å; H239-I242 PolarHBondContact O-N 3.42Å; H239-H243 AromaticContact CD2-NE2 3.81Å; H239-H243 AromaticContact CE1-NE2 3.66Å; H239-H243 AromaticContact NE2-CE1 3.78Å; H239-H243 AromaticContact NE2-NE2 3.06Å; H239-H243 PolarHBondContact NE2-NE2 3.2Å
240	K	69.9	Low	68.9	Low	97 Å²	97	87.3 Å²	87.3	42%	0.422	42%	0.419	S	S	.	.	H	α-helix	trans	-59.1	-18.8	174.3	-73.9	178.4	177.2	-174.6	0	113.6	L236 E238 I242 H243 T244	L236-K240 HydrophobicContact CD1-CG 4.39Å; L236-K240 WeakPolarHBondContact O-CG 3.41Å; L236-K240 PolarHBondContact O-N 2.8Å; E238-K240 VanDerWaalsContact C-N 3.34Å; E238-K240 PolarHBondContact O-N 3.41Å; K240-I242 PolarHBondContact O-N 2.81Å; K240-H243 PolarHBondContact O-N 3.38Å; K240-T244 PolarHBondContact O-N 2.95Å; K240-T244 PolarHBondContact O-OG1 3.16Å
241	K	70.7	Confident	69.2	Low	108 Å²	108	85.3 Å²	85.3	47%	0.47	41%	0.411	S	S	.	.	H	α-helix	trans	-69.6	-14.6	171.8	-56.9	175.4	-176.1	171.4	0	113.2	E238 H239 T244 I259	E238-K241 WeakPolarHBondContact O-CB 3.41Å; E238-K241 WeakPolarHBondContact O-CG 3.37Å; E238-K241 PolarHBondContact O-N 2.89Å; H239-K241 PolarHBondContact O-N 3.24Å; H239-K241 VanDerWaalsContact O-N 3.09Å; K241-T244 WeakPolarHBondContact CA-OG1 3.44Å; K241-T244 PolarHBondContact O-OG1 3.28Å; K241-I259 HydrophobicContact CB-CG2 4.06Å
242	I	64.5	Low	69.5	Low	75 Å²	75	90.9 Å²	90.9	39%	0.385	44%	0.436	S	S	.	.	H	α-helix	trans	-77.1	-41	176.2	-56.6	179	0	0	0	111	H239 K240 I259	H239-I242 VanDerWaalsContact O-CB 3.26Å; H239-I242 WeakPolarHBondContact O-CB 3.47Å; H239-I242 WeakPolarHBondContact O-CG1 3.24Å; H239-I242 PolarHBondContact O-N 3.42Å; K240-I242 PolarHBondContact O-N 2.81Å; I242-I259 HydrophobicContact CB-CD1 4.39Å; I242-I259 HydrophobicContact CG1-CD1 4.13Å; I242-I259 HydrophobicContact CG2-CD1 4.41Å
243	H	64.8	Low	69.4	Low	57 Å²	57	90.8 Å²	90.8	26%	0.264	44%	0.441	S	S	.	.	H	α-helix	trans	-76.2	-35.5	-176.1	-57.6	-45.3	0	0	0	113	C223 E225 C226 H239 K240 R245	C223-H243 PolarHBondContact SG-NE2 3.34Å; C223-H243 VanDerWaalsContact SG-NE2 3.39Å; E225-H243 WeakPolarHBondContact OE2-CB 3.46Å; E225-H243 IonicContact OE2-CD2 3.4Å; E225-H243 PolarHBondContact OE2-CD2 3.22Å; E225-H243 IonicContact OE2-CG 3.35Å; C226-H243 PolarHBondContact SG-NE2 2.83Å; C226-H243 VanDerWaalsContact SG-NE2 3.38Å; H239-H243 AromaticContact CD2-NE2 3.81Å; H239-H243 AromaticContact CE1-NE2 3.66Å; H239-H243 AromaticContact NE2-CE1 3.78Å; H239-H243 AromaticContact NE2-NE2 3.06Å; H239-H243 PolarHBondContact NE2-NE2 3.2Å; K240-H243 PolarHBondContact O-N 3.38Å; H243-R245 PolarHBondContact O-N 3.5Å
244	T	61.4	Low	69.7	Low	83 Å²	83	90.3 Å²	90.3	51%	0.509	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	3.6	-176.7	45.6	0	0	0	0	115.7	K240 K241 K246	K240-T244 PolarHBondContact O-N 2.95Å; K240-T244 PolarHBondContact O-OG1 3.16Å; K241-T244 WeakPolarHBondContact CA-OG1 3.44Å; K241-T244 PolarHBondContact O-OG1 3.28Å; T244-K246 PolarHBondContact O-N 3.1Å
245	R	56.1	Low	69.8	Low	229 Å²	229	89.6 Å²	89.6	86%	0.864	44%	0.442	S	S	*	.			trans	53.5	-11	179.3	-73.2	-174.4	176.6	-179.3	0.7	117.2	H243 K247	H243-R245 PolarHBondContact O-N 3.5Å; R245-K247 PolarHBondContact O-N 3.21Å
246	K	59.4	Low	69.9	Low	163 Å²	163	93.1 Å²	93.1	71%	0.709	45%	0.453	S	S	*	.			trans	-65.1	113.3	174.7	-70.8	176.9	-178.2	178	0	108.7	T244 P248	T244-K246 PolarHBondContact O-N 3.1Å; K246-P248 WeakPolarHBondContact O-CD 3.37Å
247	K	70.6	Confident	70.1	Confident	111 Å²	111	93.9 Å²	93.9	48%	0.483	46%	0.461	S	S	.	.			trans	-110.7	86	172.6	-72	170.9	167.3	-169.8	0	107.6	R245 Y249 A257 F258 I259	R245-K247 PolarHBondContact O-N 3.21Å; K247-Y249 VanDerWaalsContact C-N 3.25Å; K247-Y249 PolarHBondContact O-N 3.06Å; K247-A257 HydrophobicContact CB-CB 3.56Å; K247-A257 HydrophobicContact CD-CB 4.05Å; K247-A257 WeakPolarHBondContact CD-O 3.49Å; K247-A257 HydrophobicContact CG-CB 4.44Å; K247-F258 CarbonylContact C-O 3.6Å; K247-F258 VanDerWaalsContact C-O 3.24Å; K247-F258 VanDerWaalsContact CA-O 3.32Å; K247-F258 WeakPolarHBondContact CA-O 3.45Å; K247-I259 HydrophobicContact CG-CG1 4.07Å
248	P	73.1	Confident	70.5	Confident	89 Å²	89	91.9 Å²	91.9	58%	0.578	45%	0.446	S	S	*	.			trans	-68.9	-27.3	-166.7	-18.3	33.1	0	0	0	112.6	K246 K250 F258	K246-P248 WeakPolarHBondContact O-CD 3.37Å; P248-K250 PolarHBondContact O-N 3.28Å; P248-F258 WeakPolarHBondContact CD-O 3.48Å
249	Y	74.7	Confident	70.9	Confident	100 Å²	100	89.6 Å²	89.6	39%	0.392	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	96.6	-170.3	-57.1	-76.4	0	0	0	110.1	K247 A257 F258 I259 W260	K247-Y249 VanDerWaalsContact C-N 3.25Å; K247-Y249 PolarHBondContact O-N 3.06Å; Y249-A257 CarbonylContact O-C 3.6Å; Y249-A257 WeakPolarHBondContact O-CA 3.31Å; Y249-F258 PolarHBondContact N-O 2.9Å; Y249-F258 PolarHBondContact O-N 3.24Å; Y249-I259 VanDerWaalsContact CD2-O 3.3Å; Y249-I259 WeakPolarHBondContact CD2-O 3.41Å; Y249-I259 VanDerWaalsContact CE2-O 3.29Å; Y249-I259 WeakPolarHBondContact CE2-O 3.46Å; Y249-W260 VanDerWaalsContact CD2-C 3.46Å
250	K	72.4	Confident	71.1	Confident	131 Å²	131	93.1 Å²	93.1	57%	0.57	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	148.7	177.3	-64.4	-176.9	-178.2	177	0	111.8	P248 A257 L264	P248-K250 PolarHBondContact O-N 3.28Å; K250-A257 HydrophobicContact CG-CB 3.99Å; K250-L264 VanDerWaalsContact O-CD2 3.22Å; K250-L264 WeakPolarHBondContact O-CD2 3.28Å
251	C	81.4	Confident	71.4	Confident	1 Å²	1	91.4 Å²	91.4	1%	0.007	45%	0.448	C	S	.	.			trans	-98.3	107.9	171.4	-168.2	0	0	0	0	109.3	E253 C254 G255 K256 F258 L264 H271	C251-E253 PolarHBondContact O-N 3.02Å; C251-C254 PolarHBondContact O-N 3.23Å; C251-G255 WeakPolarHBondContact O-CA 3.44Å; C251-G255 PolarHBondContact O-N 2.9Å; C251-K256 WeakPolarHBondContact CB-O 3.43Å; C251-K256 PolarHBondContact N-O 3.28Å; C251-F258 HydrophobicContact CB-CE2 4.38Å; C251-L264 HydrophobicContact CB-CD1 3.54Å; C251-H271 PolarHBondContact SG-NE2 2.8Å
252	E	75.3	Confident	71.8	Confident	159 Å²	159	89.9 Å²	89.9	74%	0.743	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.4	-177.6	-55.2	-47.8	125.9	0	0	113	C254	E252-C254 VanDerWaalsContact C-N 3.34Å; E252-C254 PolarHBondContact O-N 3.21Å
253	E	71.4	Confident	72.4	Confident	121 Å²	121	87.5 Å²	87.5	57%	0.565	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-19.7	-177.8	-63.7	166.4	139.9	0	0	114.5	C251 H271	C251-E253 PolarHBondContact O-N 3.02Å; E253-H271 WeakPolarHBondContact OE2-CB 3.45Å; E253-H271 IonicContact OE2-CD2 3.95Å; E253-H271 PolarHBondContact OE2-CD2 3.17Å; E253-H271 IonicContact OE2-CG 3.78Å
254	C	73.9	Confident	73.2	Confident	50 Å²	50	85.7 Å²	85.7	34%	0.338	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.4	9.2	-175.5	80.3	0	0	0	0	115.4	C251 E252 K256 H267 H271	C251-C254 PolarHBondContact O-N 3.23Å; E252-C254 VanDerWaalsContact C-N 3.34Å; E252-C254 PolarHBondContact O-N 3.21Å; C254-K256 PolarHBondContact O-N 3.26Å; C254-H267 PolarHBondContact SG-NE2 3.06Å; C254-H271 PolarHBondContact SG-NE2 3.11Å
255	G	72	Confident	74	Confident	61 Å²	61	85.5 Å²	85.5	63%	0.629	43%	0.431	S	S	*	.			trans	67.1	-2.8	179.2	0	0	0	0	0	116.4	C251 A257	C251-G255 WeakPolarHBondContact O-CA 3.44Å; C251-G255 PolarHBondContact O-N 2.9Å; G255-A257 PolarHBondContact O-N 2.84Å
256	K	73.3	Confident	75.2	Confident	118 Å²	118	80.5 Å²	80.5	51%	0.513	41%	0.413	S	S	.	.			trans	-71.1	130.2	-175.8	-70.9	178.3	-176.5	173.5	0	111.3	C251 C254 F258	C251-K256 WeakPolarHBondContact CB-O 3.43Å; C251-K256 PolarHBondContact N-O 3.28Å; C254-K256 PolarHBondContact O-N 3.26Å; K256-F258 HydrophobicContact CB-CE2 3.82Å; K256-F258 HydrophobicContact CB-CZ 4.01Å; K256-F258 WeakPolarHBondContact O-CE2 3.43Å
257	A	76.3	Confident	76.2	Confident	30 Å²	30	73.5 Å²	73.5	25%	0.248	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	141.3	-178.2	0	0	0	0	0	112.2	K247 Y249 K250 G255	K247-A257 HydrophobicContact CB-CB 3.56Å; K247-A257 HydrophobicContact CD-CB 4.05Å; K247-A257 WeakPolarHBondContact CD-O 3.49Å; K247-A257 HydrophobicContact CG-CB 4.44Å; Y249-A257 CarbonylContact O-C 3.6Å; Y249-A257 WeakPolarHBondContact O-CA 3.31Å; K250-A257 HydrophobicContact CG-CB 3.99Å; G255-A257 PolarHBondContact O-N 2.84Å
258	F	78.3	Confident	76.6	Confident	45 Å²	45	72.5 Å²	72.5	20%	0.197	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	154	-174.2	-60	-89.9	0	0	0	111.6	K247 P248 Y249 C251 K256 L264 H267	K247-F258 CarbonylContact C-O 3.6Å; K247-F258 VanDerWaalsContact C-O 3.24Å; K247-F258 VanDerWaalsContact CA-O 3.32Å; K247-F258 WeakPolarHBondContact CA-O 3.45Å; P248-F258 WeakPolarHBondContact CD-O 3.48Å; Y249-F258 PolarHBondContact N-O 2.9Å; Y249-F258 PolarHBondContact O-N 3.24Å; C251-F258 HydrophobicContact CB-CE2 4.38Å; K256-F258 HydrophobicContact CB-CE2 3.82Å; K256-F258 HydrophobicContact CB-CZ 4.01Å; K256-F258 WeakPolarHBondContact O-CE2 3.43Å; F258-L264 HydrophobicContact CB-CB 4.34Å; F258-L264 HydrophobicContact CD2-CB 3.98Å; F258-L264 HydrophobicContact CD2-CD1 3.8Å; F258-L264 HydrophobicContact CD2-CG 4.49Å; F258-L264 HydrophobicContact CE2-CD1 3.98Å; F258-L264 HydrophobicContact CG-CB 4.3Å; F258-H267 HydrophobicContact CE1-CB 4.06Å; F258-H267 HydrophobicContact CE2-CB 3.98Å; F258-H267 AromaticContact CE2-CD2 3.36Å; F258-H267 WeakPolarHBondContact CE2-CD2 3.41Å; F258-H267 AromaticContact CE2-CG 3.76Å; F258-H267 HydrophobicContact CZ-CB 3.54Å; F258-H267 AromaticContact CZ-CD2 3.37Å; F258-H267 WeakPolarHBondContact CZ-CD2 3.29Å; F258-H267 AromaticContact CZ-CG 3.33Å
259	I	75.8	Confident	77.1	Confident	36 Å²	36	71 Å²	71	19%	0.185	36%	0.361	C	S	.	.	S	Bend	trans	-79.3	-32.3	178.9	-60.6	167.6	0	0	0	110.7	K241 I242 K247 Y249	K241-I259 HydrophobicContact CB-CG2 4.06Å; I242-I259 HydrophobicContact CB-CD1 4.39Å; I242-I259 HydrophobicContact CG1-CD1 4.13Å; I242-I259 HydrophobicContact CG2-CD1 4.41Å; K247-I259 HydrophobicContact CG-CG1 4.07Å; Y249-I259 VanDerWaalsContact CD2-O 3.3Å; Y249-I259 WeakPolarHBondContact CD2-O 3.41Å; Y249-I259 VanDerWaalsContact CE2-O 3.29Å; Y249-I259 WeakPolarHBondContact CE2-O 3.46Å
260	W	78.8	Confident	77	Confident	92 Å²	92	72.6 Å²	72.6	35%	0.348	37%	0.373	S	S	.	.	S	Bend	trans	-123.4	140.5	-177	-58.9	-75.5	0	0	0	112.7	E238 Y249 S262 T263 L264	E238-W260 HydrophobicContact CG-CZ2 4.08Å; E238-W260 PolarHBondContact OE1-NE1 2.89Å; Y249-W260 VanDerWaalsContact CD2-C 3.46Å; W260-S262 VanDerWaalsContact C-N 3.33Å; W260-S262 PolarHBondContact O-N 3.46Å; W260-T263 HydrophobicContact CB-CG2 4.31Å; W260-T263 HydrophobicContact CE3-CG2 3.96Å; W260-T263 PolarHBondContact O-N 2.83Å; W260-T263 VanDerWaalsContact O-N 3.12Å; W260-T263 PolarHBondContact O-OG1 3.47Å; W260-L264 PolarHBondContact O-N 3.14Å
261	S	75.8	Confident	77.1	Confident	60 Å²	60	70 Å²	70	42%	0.42	36%	0.363	S	S	.	.	H	α-helix	trans	-56.4	-44	175	52.6	0	0	0	0	112.3	T263 L264 T265	S261-T263 PolarHBondContact O-N 3.1Å; S261-L264 CarbonylContact O-C 3.24Å; S261-L264 WeakPolarHBondContact O-CA 3.32Å; S261-L264 WeakPolarHBondContact O-CB 3.37Å; S261-L264 PolarHBondContact O-N 3.11Å; S261-T265 PolarHBondContact O-N 3.39Å; S261-T265 PolarHBondContact O-OG1 2.74Å
262	S	78.1	Confident	76.9	Confident	76 Å²	76	73.5 Å²	73.5	53%	0.531	38%	0.384	S	S	.	.	H	α-helix	trans	-54.9	-38.4	176.3	59	0	0	0	0	112.9	W260 R266	W260-S262 VanDerWaalsContact C-N 3.33Å; W260-S262 PolarHBondContact O-N 3.46Å; S262-R266 WeakPolarHBondContact O-CB 3.43Å; S262-R266 PolarHBondContact O-N 3.32Å
263	T	78.3	Confident	76.9	Confident	25 Å²	25	68.1 Å²	68.1	15%	0.153	37%	0.372	C	S	.	.	H	α-helix	trans	-74.6	-32.3	177	60.1	0	0	0	0	113.2	W260 S261 H267	W260-T263 HydrophobicContact CB-CG2 4.31Å; W260-T263 HydrophobicContact CE3-CG2 3.96Å; W260-T263 PolarHBondContact O-N 2.83Å; W260-T263 VanDerWaalsContact O-N 3.12Å; W260-T263 PolarHBondContact O-OG1 3.47Å; S261-T263 PolarHBondContact O-N 3.1Å; T263-H267 WeakPolarHBondContact O-CB 3.27Å; T263-H267 PolarHBondContact O-N 3.1Å
264	L	80.1	Confident	77.1	Confident	19 Å²	19	67 Å²	67	10%	0.099	37%	0.367	C	S	.	.	H	α-helix	trans	-66.9	-46.7	169.5	172.2	63.1	0	0	0	111.1	K250 C251 F258 W260 S261 R266 H267 K268	K250-L264 VanDerWaalsContact O-CD2 3.22Å; K250-L264 WeakPolarHBondContact O-CD2 3.28Å; C251-L264 HydrophobicContact CB-CD1 3.54Å; F258-L264 HydrophobicContact CB-CB 4.34Å; F258-L264 HydrophobicContact CD2-CB 3.98Å; F258-L264 HydrophobicContact CD2-CD1 3.8Å; F258-L264 HydrophobicContact CD2-CG 4.49Å; F258-L264 HydrophobicContact CE2-CD1 3.98Å; F258-L264 HydrophobicContact CG-CB 4.3Å; W260-L264 PolarHBondContact O-N 3.14Å; S261-L264 CarbonylContact O-C 3.24Å; S261-L264 WeakPolarHBondContact O-CA 3.32Å; S261-L264 WeakPolarHBondContact O-CB 3.37Å; S261-L264 PolarHBondContact O-N 3.11Å; L264-R266 VanDerWaalsContact C-N 3.33Å; L264-R266 PolarHBondContact O-N 3.25Å; L264-H267 CarbonylContact O-C 3.59Å; L264-H267 WeakPolarHBondContact O-CA 3Å; L264-H267 WeakPolarHBondContact O-CB 3.09Å; L264-H267 PolarHBondContact O-N 2.92Å; L264-K268 HydrophobicContact CD1-CG 4.25Å; L264-K268 PolarHBondContact O-N 2.85Å
265	T	79.3	Confident	77.6	Confident	79 Å²	79	70.5 Å²	70.5	49%	0.485	38%	0.376	S	S	.	.	H	α-helix	trans	-59.2	-44.4	177.9	-56.6	0	0	0	0	111.2	S261 H267 K268	S261-T265 PolarHBondContact O-N 3.39Å; S261-T265 PolarHBondContact O-OG1 2.74Å; T265-H267 VanDerWaalsContact C-N 3.27Å; T265-H267 PolarHBondContact O-N 3.49Å; T265-K268 PolarHBondContact O-N 3.27Å
266	R	80.5	Confident	78.1	Confident	125 Å²	125	71 Å²	71	47%	0.472	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-32.4	173.2	-175.3	174.4	65.8	-173.2	-3.9	112.9	S262 L264 Q288	S262-R266 WeakPolarHBondContact O-CB 3.43Å; S262-R266 PolarHBondContact O-N 3.32Å; L264-R266 VanDerWaalsContact C-N 3.33Å; L264-R266 PolarHBondContact O-N 3.25Å; R266-Q288 HydrophobicContact CG-CG 4.23Å
267	H	81	Confident	78.6	Confident	15 Å²	15	69.1 Å²	69.1	7%	0.069	36%	0.359	C	S	.	.	H	α-helix	trans	-72.9	-40.2	175.9	173.1	53.7	0	0	0	112.7	C254 F258 T263 L264 T265 R269 M270 H271	C254-H267 PolarHBondContact SG-NE2 3.06Å; F258-H267 HydrophobicContact CE1-CB 4.06Å; F258-H267 HydrophobicContact CE2-CB 3.98Å; F258-H267 AromaticContact CE2-CD2 3.36Å; F258-H267 WeakPolarHBondContact CE2-CD2 3.41Å; F258-H267 AromaticContact CE2-CG 3.76Å; F258-H267 HydrophobicContact CZ-CB 3.54Å; F258-H267 AromaticContact CZ-CD2 3.37Å; F258-H267 WeakPolarHBondContact CZ-CD2 3.29Å; F258-H267 AromaticContact CZ-CG 3.33Å; T263-H267 WeakPolarHBondContact O-CB 3.27Å; T263-H267 PolarHBondContact O-N 3.1Å; L264-H267 CarbonylContact O-C 3.59Å; L264-H267 WeakPolarHBondContact O-CA 3Å; L264-H267 WeakPolarHBondContact O-CB 3.09Å; L264-H267 PolarHBondContact O-N 2.92Å; T265-H267 VanDerWaalsContact C-N 3.27Å; T265-H267 PolarHBondContact O-N 3.49Å; H267-R269 PolarHBondContact O-N 3.49Å; H267-M270 PolarHBondContact ND1-SD 3.32Å; H267-M270 WeakPolarHBondContact O-CB 3.42Å; H267-M270 WeakPolarHBondContact O-CG 3.18Å; H267-M270 PolarHBondContact O-N 2.89Å; H267-H271 AromaticContact CD2-NE2 3.96Å; H267-H271 AromaticContact CE1-CE1 3.83Å; H267-H271 AromaticContact CE1-NE2 3.49Å; H267-H271 PolarHBondContact CE1-NE2 3.14Å; H267-H271 AromaticContact NE2-CE1 3.85Å; H267-H271 AromaticContact NE2-NE2 3.14Å; H267-H271 PolarHBondContact NE2-NE2 3.37Å; H267-H271 VanDerWaalsContact NE2-NE2 3.14Å
268	K	78.1	Confident	78.8	Confident	91 Å²	91	74.2 Å²	74.2	40%	0.396	38%	0.375	S	S	.	.	H	α-helix	trans	-56.7	-33	177.7	-75.1	-171.8	172.5	-166.8	0	113	L264 T265 M270 H271 T272	L264-K268 HydrophobicContact CD1-CG 4.25Å; L264-K268 PolarHBondContact O-N 2.85Å; T265-K268 PolarHBondContact O-N 3.27Å; K268-M270 PolarHBondContact O-N 2.87Å; K268-H271 PolarHBondContact O-N 3.22Å; K268-T272 PolarHBondContact O-N 2.83Å; K268-T272 VanDerWaalsContact O-N 3.09Å
269	R	83.7	Confident	79.1	Confident	56 Å²	56	72 Å²	72	21%	0.211	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-17.1	171.9	-62	-177.6	-178.8	171.3	0.4	114.6	H267 G273 E274 S287	H267-R269 PolarHBondContact O-N 3.49Å; R269-G273 PolarHBondContact O-N 2.95Å; R269-E274 HydrophobicContact CB-CB 4.18Å; R269-E274 HydrophobicContact CG-CB 4Å; R269-E274 PolarHBondContact O-N 2.71Å; R269-S287 PolarHBondContact NH1-O 3.06Å; R269-S287 VanDerWaalsContact NH1-O 3.09Å
270	M	73.1	Confident	79.4	Confident	134 Å²	134	77.7 Å²	77.7	66%	0.66	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-28.6	172.1	-62.1	-179.2	59.5	0	0	112.8	H267 K268	H267-M270 PolarHBondContact ND1-SD 3.32Å; H267-M270 WeakPolarHBondContact O-CB 3.42Å; H267-M270 WeakPolarHBondContact O-CG 3.18Å; H267-M270 PolarHBondContact O-N 2.89Å; K268-M270 PolarHBondContact O-N 2.87Å
271	H	75.6	Confident	79.4	Confident	77 Å²	77	78.4 Å²	78.4	36%	0.356	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-44.1	-178.9	-53.1	-52	0	0	0	110.9	C251 E253 C254 H267 K268 G273	C251-H271 PolarHBondContact SG-NE2 2.8Å; E253-H271 WeakPolarHBondContact OE2-CB 3.45Å; E253-H271 IonicContact OE2-CD2 3.95Å; E253-H271 PolarHBondContact OE2-CD2 3.17Å; E253-H271 IonicContact OE2-CG 3.78Å; C254-H271 PolarHBondContact SG-NE2 3.11Å; H267-H271 AromaticContact CD2-NE2 3.96Å; H267-H271 AromaticContact CE1-CE1 3.83Å; H267-H271 AromaticContact CE1-NE2 3.49Å; H267-H271 PolarHBondContact CE1-NE2 3.14Å; H267-H271 AromaticContact NE2-CE1 3.85Å; H267-H271 AromaticContact NE2-NE2 3.14Å; H267-H271 PolarHBondContact NE2-NE2 3.37Å; H267-H271 VanDerWaalsContact NE2-NE2 3.14Å; K268-H271 PolarHBondContact O-N 3.22Å; H271-G273 PolarHBondContact O-N 2.87Å
272	T	75.7	Confident	79.5	Confident	74 Å²	74	77.7 Å²	77.7	45%	0.454	39%	0.393	S	S	.	.	S	Bend	trans	-73.5	-12.3	176.4	64.5	0	0	0	0	113.5	K268 E274	K268-T272 PolarHBondContact O-N 2.83Å; K268-T272 VanDerWaalsContact O-N 3.09Å; T272-E274 WeakPolarHBondContact CB-OE1 3.44Å; T272-E274 PolarHBondContact O-N 3.18Å; T272-E274 VanDerWaalsContact OG1-CD 3.24Å; T272-E274 WeakPolarHBondContact OG1-CG 3.31Å; T272-E274 PolarHBondContact OG1-OE1 3.22Å
273	G	74.9	Confident	79.6	Confident	47 Å²	47	76.9 Å²	76.9	49%	0.485	40%	0.396	S	S	.	.			trans	70.7	3.8	-176.6	0	0	0	0	0	114.5	R269 H271 K275	R269-G273 PolarHBondContact O-N 2.95Å; H271-G273 PolarHBondContact O-N 2.87Å; G273-K275 WeakPolarHBondContact O-CG 3.44Å; G273-K275 PolarHBondContact O-N 2.81Å
274	E	77.4	Confident	79.6	Confident	97 Å²	97	81.4 Å²	81.4	45%	0.453	41%	0.414	S	S	.	.			trans	-53.8	125.2	-178.8	-84.6	166.8	-126	0	0	112.7	R269 T272 S287	R269-E274 HydrophobicContact CB-CB 4.18Å; R269-E274 HydrophobicContact CG-CB 4Å; R269-E274 PolarHBondContact O-N 2.71Å; T272-E274 WeakPolarHBondContact CB-OE1 3.44Å; T272-E274 PolarHBondContact O-N 3.18Å; T272-E274 VanDerWaalsContact OG1-CD 3.24Å; T272-E274 WeakPolarHBondContact OG1-CG 3.31Å; T272-E274 PolarHBondContact OG1-OE1 3.22Å; E274-S287 WeakPolarHBondContact O-CB 3.37Å
275	K	82.9	Confident	79.8	Confident	124 Å²	124	82.1 Å²	82.1	54%	0.539	42%	0.422	S	S	.	.			trans	-127.7	75.2	177.7	-73.3	160.4	174.4	-178.9	0	110	G273 Y277 A285 F286	G273-K275 WeakPolarHBondContact O-CG 3.44Å; G273-K275 PolarHBondContact O-N 2.81Å; K275-Y277 PolarHBondContact O-N 2.86Å; K275-A285 HydrophobicContact CB-CB 3.52Å; K275-A285 HydrophobicContact CD-CB 4.17Å; K275-A285 WeakPolarHBondContact CD-O 3.29Å; K275-A285 HydrophobicContact CG-CB 4.4Å; K275-F286 CarbonylContact C-O 3.58Å; K275-F286 VanDerWaalsContact CA-O 3.24Å; K275-F286 WeakPolarHBondContact CA-O 3.45Å
276	P	84.1	Confident	80	Confident	70 Å²	70	80.5 Å²	80.5	46%	0.455	41%	0.409	S	S	.	.			trans	-66.6	-20.8	-172.5	-21.9	35.3	0	0	0	114.1
277	Y	83	Confident	80.1	Confident	80 Å²	80	76.3 Å²	76.3	31%	0.314	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	94.9	-173.2	-54.9	-76.3	0	0	0	109.9	K275 A285 F286 S289	K275-Y277 PolarHBondContact O-N 2.86Å; Y277-A285 CarbonylContact O-C 3.51Å; Y277-F286 PolarHBondContact N-O 2.99Å; Y277-F286 PolarHBondContact O-N 3.31Å; Y277-S289 VanDerWaalsContact CD2-N 3.28Å; Y277-S289 VanDerWaalsContact CE2-N 3.29Å
278	K	80.7	Confident	80.2	Confident	136 Å²	136	78.5 Å²	78.5	59%	0.591	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	152.9	176.6	-65.5	-178.3	-178.6	177.3	0	111.3	A285 L292	K278-A285 HydrophobicContact CG-CB 3.98Å; K278-L292 WeakPolarHBondContact O-CD2 3.17Å
279	C	84.8	Confident	80.3	Confident	0 Å²	0	77 Å²	77	0%	0	41%	0.41	C	S	.	.			trans	-102.9	109.9	171.1	-177.3	0	0	0	0	108.6	E281 C282 G283 K284 F286 L292	C279-E281 PolarHBondContact O-N 2.8Å; C279-C282 PolarHBondContact O-N 3.18Å; C279-G283 WeakPolarHBondContact O-CA 3.3Å; C279-G283 PolarHBondContact O-N 3.31Å; C279-K284 WeakPolarHBondContact CB-O 3.49Å; C279-K284 PolarHBondContact N-O 2.99Å; C279-F286 HydrophobicContact CB-CE2 4.38Å; C279-L292 HydrophobicContact CB-CD1 3.54Å
280	E	81.3	Confident	80.1	Confident	154 Å²	154	77.4 Å²	77.4	72%	0.72	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.3	-177.8	-50.2	-43.3	122.1	0	0	112.8	C282	E280-C282 PolarHBondContact O-N 3.11Å
281	E	78.4	Confident	80.3	Confident	107 Å²	107	73.4 Å²	73.4	50%	0.5	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-17.9	-177	-65.4	153.4	-121.6	0	0	114.4	C279 H299	C279-E281 PolarHBondContact O-N 2.8Å; E281-H299 WeakPolarHBondContact OE2-CB 3.45Å; E281-H299 IonicContact OE2-CD2 2.74Å; E281-H299 PolarHBondContact OE2-CD2 3.06Å; E281-H299 VanDerWaalsContact OE2-CD2 3.22Å; E281-H299 IonicContact OE2-CG 2.8Å; E281-H299 VanDerWaalsContact OE2-CG 3.3Å
282	C	79.3	Confident	80.6	Confident	45 Å²	45	70.8 Å²	70.8	30%	0.304	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.2	11.1	-179	75.2	0	0	0	0	115.9	C279 E280 K284 H295 H299	C279-C282 PolarHBondContact O-N 3.18Å; E280-C282 PolarHBondContact O-N 3.11Å; C282-K284 PolarHBondContact O-N 3.18Å; C282-H295 PolarHBondContact SG-NE2 3.26Å; C282-H299 WeakPolarHBondContact CB-NE2 3.28Å; C282-H299 PolarHBondContact SG-NE2 2.72Å
283	G	79.3	Confident	80.7	Confident	59 Å²	59	71.6 Å²	71.6	61%	0.608	40%	0.398	S	S	*	.			trans	66.7	-4.5	-178.6	0	0	0	0	0	116.1	C279 A285	C279-G283 WeakPolarHBondContact O-CA 3.3Å; C279-G283 PolarHBondContact O-N 3.31Å; G283-A285 PolarHBondContact O-N 2.95Å
284	K	79.4	Confident	80.7	Confident	121 Å²	121	71.6 Å²	71.6	53%	0.526	39%	0.389	S	S	.	.			trans	-69.5	127.7	-174.9	-73.4	176.7	-177.9	165.1	0	111.6	C279 C282 F286	C279-K284 WeakPolarHBondContact CB-O 3.49Å; C279-K284 PolarHBondContact N-O 2.99Å; C282-K284 PolarHBondContact O-N 3.18Å; K284-F286 HydrophobicContact CB-CE2 3.85Å; K284-F286 HydrophobicContact CB-CZ 4.02Å; K284-F286 WeakPolarHBondContact O-CD2 3.35Å; K284-F286 VanDerWaalsContact O-CE2 3.25Å; K284-F286 WeakPolarHBondContact O-CE2 3.21Å
285	A	84.2	Confident	80.7	Confident	33 Å²	33	67.8 Å²	67.8	27%	0.273	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	140.1	-176.6	0	0	0	0	0	112.5	K275 Y277 K278 G283	K275-A285 HydrophobicContact CB-CB 3.52Å; K275-A285 HydrophobicContact CD-CB 4.17Å; K275-A285 WeakPolarHBondContact CD-O 3.29Å; K275-A285 HydrophobicContact CG-CB 4.4Å; Y277-A285 CarbonylContact O-C 3.51Å; K278-A285 HydrophobicContact CG-CB 3.98Å; G283-A285 PolarHBondContact O-N 2.95Å
286	F	83.6	Confident	80.3	Confident	45 Å²	45	65.9 Å²	65.9	20%	0.197	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.4	-175.9	-59.2	-89	0	0	0	111.7	K275 Y277 C279 K284 L292 H295	K275-F286 CarbonylContact C-O 3.58Å; K275-F286 VanDerWaalsContact CA-O 3.24Å; K275-F286 WeakPolarHBondContact CA-O 3.45Å; Y277-F286 PolarHBondContact N-O 2.99Å; Y277-F286 PolarHBondContact O-N 3.31Å; C279-F286 HydrophobicContact CB-CE2 4.38Å; K284-F286 HydrophobicContact CB-CE2 3.85Å; K284-F286 HydrophobicContact CB-CZ 4.02Å; K284-F286 WeakPolarHBondContact O-CD2 3.35Å; K284-F286 VanDerWaalsContact O-CE2 3.25Å; K284-F286 WeakPolarHBondContact O-CE2 3.21Å; F286-L292 HydrophobicContact CB-CB 4.31Å; F286-L292 HydrophobicContact CD2-CB 3.99Å; F286-L292 HydrophobicContact CD2-CD1 3.84Å; F286-L292 HydrophobicContact CE2-CD1 4.06Å; F286-L292 HydrophobicContact CG-CB 4.3Å; F286-H295 HydrophobicContact CE1-CB 4.1Å; F286-H295 HydrophobicContact CE2-CB 3.9Å; F286-H295 AromaticContact CE2-CD2 3.28Å; F286-H295 WeakPolarHBondContact CE2-CD2 3.45Å; F286-H295 AromaticContact CE2-CG 3.61Å; F286-H295 AromaticContact CE2-NE2 3.95Å; F286-H295 HydrophobicContact CZ-CB 3.58Å; F286-H295 AromaticContact CZ-CD2 3.32Å; F286-H295 WeakPolarHBondContact CZ-CD2 3.38Å; F286-H295 AromaticContact CZ-CG 3.22Å; F286-H295 AromaticContact CZ-ND1 3.71Å; F286-H295 AromaticContact CZ-NE2 3.79Å
287	S	81.7	Confident	79.8	Confident	37 Å²	37	63.4 Å²	63.4	26%	0.259	35%	0.345	S	S	.	.	S	Bend	trans	-82.1	-11.7	179.1	56.1	0	0	0	0	114.1	R269 E274	R269-S287 PolarHBondContact NH1-O 3.06Å; R269-S287 VanDerWaalsContact NH1-O 3.09Å; E274-S287 WeakPolarHBondContact O-CB 3.37Å
288	Q	82.3	Confident	79.1	Confident	61 Å²	61	63.3 Å²	63.3	29%	0.285	35%	0.35	S	S	.	.	S	Bend	trans	-135	142.5	-179.6	-53.7	-174.8	29.2	0	0	110.8	R266 T291 L292	R266-Q288 HydrophobicContact CG-CG 4.23Å; Q288-T291 HydrophobicContact CB-CG2 4.48Å; Q288-T291 PolarHBondContact O-N 2.84Å; Q288-T291 PolarHBondContact O-OG1 3.15Å; Q288-L292 PolarHBondContact O-N 2.74Å
289	S	81.7	Confident	78.7	Confident	60 Å²	60	60.9 Å²	60.9	42%	0.42	34%	0.34	S	S	.	.	H	α-helix	trans	-64.1	-42.1	177.4	48.1	0	0	0	0	111.6	Y277 T291 L292 T293	Y277-S289 VanDerWaalsContact CD2-N 3.28Å; Y277-S289 VanDerWaalsContact CE2-N 3.29Å; S289-T291 VanDerWaalsContact C-N 3.28Å; S289-T291 PolarHBondContact O-N 3.49Å; S289-L292 CarbonylContact O-C 3.58Å; S289-L292 WeakPolarHBondContact O-CA 3.42Å; S289-L292 WeakPolarHBondContact O-CB 3.32Å; S289-L292 PolarHBondContact O-N 3.07Å; S289-L292 VanDerWaalsContact O-N 3.1Å; S289-T293 PolarHBondContact O-N 2.73Å; S289-T293 PolarHBondContact O-OG1 3.43Å; S289-T293 VanDerWaalsContact O-OG1 3.08Å
290	S	78.3	Confident	77.8	Confident	64 Å²	64	64.5 Å²	64.5	45%	0.448	36%	0.362	S	S	.	.	H	α-helix	trans	-56	-39.3	177.2	54.6	0	0	0	0	113.2	T293 T294	S290-T293 PolarHBondContact O-N 3.44Å; S290-T294 WeakPolarHBondContact O-CG2 3.32Å; S290-T294 PolarHBondContact O-N 2.5Å; S290-T294 PolarHBondContact O-OG1 3.43Å
291	T	78.3	Confident	76.9	Confident	51 Å²	51	59.6 Å²	59.6	31%	0.313	35%	0.353	S	S	.	.	H	α-helix	trans	-72.3	-37	177.5	52.4	0	0	0	0	111.8	Q288 S289 T294 H295	Q288-T291 HydrophobicContact CB-CG2 4.48Å; Q288-T291 PolarHBondContact O-N 2.84Å; Q288-T291 PolarHBondContact O-OG1 3.15Å; S289-T291 VanDerWaalsContact C-N 3.28Å; S289-T291 PolarHBondContact O-N 3.49Å; T291-T294 WeakPolarHBondContact CA-OG1 3.47Å; T291-T294 PolarHBondContact O-N 2.95Å; T291-T294 PolarHBondContact O-OG1 3.05Å; T291-H295 WeakPolarHBondContact O-CB 3.36Å; T291-H295 PolarHBondContact O-N 2.97Å
292	L	81	Confident	76.2	Confident	22 Å²	22	58.7 Å²	58.7	12%	0.115	35%	0.349	C	S	.	.	H	α-helix	trans	-60.7	-45.9	168.8	173.3	63.9	0	0	0	111.6	K278 C279 F286 Q288 S289 T294 H295 K296	K278-L292 WeakPolarHBondContact O-CD2 3.17Å; C279-L292 HydrophobicContact CB-CD1 3.54Å; F286-L292 HydrophobicContact CB-CB 4.31Å; F286-L292 HydrophobicContact CD2-CB 3.99Å; F286-L292 HydrophobicContact CD2-CD1 3.84Å; F286-L292 HydrophobicContact CE2-CD1 4.06Å; F286-L292 HydrophobicContact CG-CB 4.3Å; Q288-L292 PolarHBondContact O-N 2.74Å; S289-L292 CarbonylContact O-C 3.58Å; S289-L292 WeakPolarHBondContact O-CA 3.42Å; S289-L292 WeakPolarHBondContact O-CB 3.32Å; S289-L292 PolarHBondContact O-N 3.07Å; S289-L292 VanDerWaalsContact O-N 3.1Å; L292-T294 VanDerWaalsContact C-N 3.32Å; L292-T294 PolarHBondContact O-N 3.39Å; L292-H295 CarbonylContact O-C 3.57Å; L292-H295 WeakPolarHBondContact O-CA 3.24Å; L292-H295 WeakPolarHBondContact O-CB 3.46Å; L292-H295 PolarHBondContact O-N 3.3Å; L292-K296 HydrophobicContact CD1-CG 4.27Å; L292-K296 PolarHBondContact O-N 2.91Å
293	T	78.3	Confident	75.5	Confident	90 Å²	90	62 Å²	62	55%	0.552	36%	0.358	S	S	*	.	H	α-helix	trans	-58	-44.7	177	-52.5	0	0	0	0	111	S289 S290 H295 K296	S289-T293 PolarHBondContact O-N 2.73Å; S289-T293 PolarHBondContact O-OG1 3.43Å; S289-T293 VanDerWaalsContact O-OG1 3.08Å; S290-T293 PolarHBondContact O-N 3.44Å; T293-H295 PolarHBondContact O-N 3.07Å; T293-K296 PolarHBondContact O-N 2.96Å
294	T	73.9	Confident	74.9	Confident	47 Å²	47	66.6 Å²	66.6	29%	0.288	36%	0.357	S	S	.	.	H	α-helix	trans	-69.5	-19.7	174.4	60.3	0	0	0	0	114	S290 T291 L292 Q316	S290-T294 WeakPolarHBondContact O-CG2 3.32Å; S290-T294 PolarHBondContact O-N 2.5Å; S290-T294 PolarHBondContact O-OG1 3.43Å; T291-T294 WeakPolarHBondContact CA-OG1 3.47Å; T291-T294 PolarHBondContact O-N 2.95Å; T291-T294 PolarHBondContact O-OG1 3.05Å; L292-T294 VanDerWaalsContact C-N 3.32Å; L292-T294 PolarHBondContact O-N 3.39Å; T294-Q316 HydrophobicContact CG2-CG 4.45Å
295	H	77.8	Confident	74.4	Confident	17 Å²	17	65.1 Å²	65.1	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-81	-38.4	176.3	179	60.5	0	0	0	112.5	C282 F286 T291 L292 T293 I297 I298	C282-H295 PolarHBondContact SG-NE2 3.26Å; F286-H295 HydrophobicContact CE1-CB 4.1Å; F286-H295 HydrophobicContact CE2-CB 3.9Å; F286-H295 AromaticContact CE2-CD2 3.28Å; F286-H295 WeakPolarHBondContact CE2-CD2 3.45Å; F286-H295 AromaticContact CE2-CG 3.61Å; F286-H295 AromaticContact CE2-NE2 3.95Å; F286-H295 HydrophobicContact CZ-CB 3.58Å; F286-H295 AromaticContact CZ-CD2 3.32Å; F286-H295 WeakPolarHBondContact CZ-CD2 3.38Å; F286-H295 AromaticContact CZ-CG 3.22Å; F286-H295 AromaticContact CZ-ND1 3.71Å; F286-H295 AromaticContact CZ-NE2 3.79Å; T291-H295 WeakPolarHBondContact O-CB 3.36Å; T291-H295 PolarHBondContact O-N 2.97Å; L292-H295 CarbonylContact O-C 3.57Å; L292-H295 WeakPolarHBondContact O-CA 3.24Å; L292-H295 WeakPolarHBondContact O-CB 3.46Å; L292-H295 PolarHBondContact O-N 3.3Å; T293-H295 PolarHBondContact O-N 3.07Å; H295-I297 PolarHBondContact O-N 3.13Å; H295-I298 WeakPolarHBondContact O-CB 3.46Å; H295-I298 VanDerWaalsContact O-CG1 3.25Å; H295-I298 WeakPolarHBondContact O-CG1 3.23Å; H295-I298 PolarHBondContact O-N 3.26Å
296	K	74.6	Confident	73.7	Confident	84 Å²	84	70.6 Å²	70.6	37%	0.365	37%	0.366	S	S	.	.	H	α-helix	trans	-57	-33.1	175	-69.4	-165.2	173.6	-155.9	0	112.6	L292 T293 I298 H299 T300	L292-K296 HydrophobicContact CD1-CG 4.27Å; L292-K296 PolarHBondContact O-N 2.91Å; T293-K296 PolarHBondContact O-N 2.96Å; K296-I298 PolarHBondContact O-N 3.02Å; K296-H299 PolarHBondContact O-N 3.34Å; K296-T300 PolarHBondContact O-N 3.36Å
297	I	73.9	Confident	73.4	Confident	18 Å²	18	68.5 Å²	68.5	9%	0.092	36%	0.357	C	S	.	.	H	α-helix	trans	-57	-20.9	172.2	-56.3	174.9	0	0	0	112.9	H295 E302 K315	H295-I297 PolarHBondContact O-N 3.13Å; I297-E302 WeakPolarHBondContact CG2-O 3.26Å; I297-K315 HydrophobicContact CG2-CB 4.39Å; I297-K315 HydrophobicContact CG2-CG 4.33Å
298	I	69.1	Low	72.9	Confident	79 Å²	79	74.3 Å²	74.3	41%	0.405	38%	0.384	S	S	.	.	H	α-helix	trans	-72.9	-38.3	176	-53.7	-167.7	0	0	0	111.4	H295 K296 K315	H295-I298 WeakPolarHBondContact O-CB 3.46Å; H295-I298 VanDerWaalsContact O-CG1 3.25Å; H295-I298 WeakPolarHBondContact O-CG1 3.23Å; H295-I298 PolarHBondContact O-N 3.26Å; K296-I298 PolarHBondContact O-N 3.02Å; I298-K315 HydrophobicContact CG1-CD 4.16Å
299	H	70.8	Confident	72.5	Confident	85 Å²	85	76.9 Å²	76.9	39%	0.394	40%	0.397	S	S	.	.	H	α-helix	trans	-78.4	-41.4	-177.8	-58.8	-52.3	0	0	0	112	E281 C282 K296 G301	E281-H299 WeakPolarHBondContact OE2-CB 3.45Å; E281-H299 IonicContact OE2-CD2 2.74Å; E281-H299 PolarHBondContact OE2-CD2 3.06Å; E281-H299 VanDerWaalsContact OE2-CD2 3.22Å; E281-H299 IonicContact OE2-CG 2.8Å; E281-H299 VanDerWaalsContact OE2-CG 3.3Å; C282-H299 WeakPolarHBondContact CB-NE2 3.28Å; C282-H299 PolarHBondContact SG-NE2 2.72Å; K296-H299 PolarHBondContact O-N 3.34Å; H299-G301 PolarHBondContact O-N 2.97Å; H299-G301 VanDerWaalsContact O-N 3.14Å
300	T	67.6	Low	72.3	Confident	76 Å²	76	76.5 Å²	76.5	47%	0.466	39%	0.393	S	S	.	.	S	Bend	trans	-67	-11.4	174.9	63.9	0	0	0	0	113.4	K296 E302	K296-T300 PolarHBondContact O-N 3.36Å; T300-E302 PolarHBondContact O-N 3.3Å
301	G	61.2	Low	71.9	Confident	51 Å²	51	76.3 Å²	76.3	53%	0.526	40%	0.401	S	S	.	.			trans	67.5	-10.5	-175.9	0	0	0	0	0	115	H299 K303	H299-G301 PolarHBondContact O-N 2.97Å; H299-G301 VanDerWaalsContact O-N 3.14Å; G301-K303 PolarHBondContact O-N 2.97Å
302	E	63.5	Low	71.6	Confident	88 Å²	88	79.9 Å²	79.9	41%	0.411	41%	0.413	S	S	.	.			trans	-61.9	94.5	-172.9	-69.8	-177.2	157.2	0	0	113.1	I297 T300 R304	I297-E302 WeakPolarHBondContact CG2-O 3.26Å; T300-E302 PolarHBondContact O-N 3.3Å; E302-R304 HydrophobicContact CB-CG 4Å; E302-R304 PolarHBondContact O-N 3.34Å; E302-R304 IonicContact OE2-CZ 3.04Å; E302-R304 IonicContact OE2-NE 3.48Å; E302-R304 PolarHBondContact OE2-NE 3.37Å; E302-R304 IonicContact OE2-NH2 3.06Å; E302-R304 PolarHBondContact OE2-NH2 3.19Å
303	K	64.7	Low	71.3	Confident	113 Å²	113	80.1 Å²	80.1	49%	0.491	42%	0.417	S	S	.	.			trans	-79.4	71.6	166.6	-63.1	168.4	-178.9	173.5	0	109.5	G301 Y305 A313 F314	G301-K303 PolarHBondContact O-N 2.97Å; K303-Y305 PolarHBondContact O-N 3.06Å; K303-A313 HydrophobicContact CB-CB 3.32Å; K303-A313 HydrophobicContact CD-CB 3.78Å; K303-A313 WeakPolarHBondContact CD-O 3.19Å; K303-A313 HydrophobicContact CG-CB 4.17Å; K303-F314 CarbonylContact C-O 3.59Å
304	R	67.3	Low	71.2	Confident	156 Å²	156	77.9 Å²	77.9	59%	0.589	40%	0.4	S	S	*	.			trans	-52.2	-30.2	-173.5	-61.9	-177.2	-177.5	-179	-3.1	114	E302	E302-R304 HydrophobicContact CB-CG 4Å; E302-R304 PolarHBondContact O-N 3.34Å; E302-R304 IonicContact OE2-CZ 3.04Å; E302-R304 IonicContact OE2-NE 3.48Å; E302-R304 PolarHBondContact OE2-NE 3.37Å; E302-R304 IonicContact OE2-NH2 3.06Å; E302-R304 PolarHBondContact OE2-NH2 3.19Å
305	Y	68	Low	71	Confident	90 Å²	90	79.8 Å²	79.8	35%	0.353	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	87.3	-176.4	-59	-70.7	0	0	0	110.8	K303 F314 L317	K303-Y305 PolarHBondContact O-N 3.06Å; Y305-F314 PolarHBondContact N-O 2.91Å; Y305-F314 PolarHBondContact O-N 3.38Å; Y305-L317 HydrophobicContact CD1-CB 3.99Å; Y305-L317 HydrophobicContact CD1-CD1 3.8Å; Y305-L317 HydrophobicContact CD1-CG 4.46Å; Y305-L317 HydrophobicContact CD2-CB 4.45Å; Y305-L317 HydrophobicContact CE1-CB 3.79Å; Y305-L317 HydrophobicContact CE1-CD1 4.04Å; Y305-L317 HydrophobicContact CE1-CG 4.34Å; Y305-L317 HydrophobicContact CE2-CB 4.25Å; Y305-L317 HydrophobicContact CG-CB 4.31Å
306	K	70.2	Confident	70.9	Confident	148 Å²	148	82.8 Å²	82.8	64%	0.643	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	138.1	176.6	-59.7	-173.8	179.4	175.8	0	111.4	A313	K306-A313 HydrophobicContact CB-CB 4.39Å; K306-A313 HydrophobicContact CG-CB 3.81Å
307	C	77.3	Confident	70.9	Confident	1 Å²	1	83.4 Å²	83.4	1%	0.007	43%	0.425	C	S	.	.			trans	-84.1	121.4	165	174.3	0	0	0	0	108.7	E309 G311 K312 F314 L320 H327	C307-E309 VanDerWaalsContact C-N 3.35Å; C307-G311 VanDerWaalsContact O-CA 3.27Å; C307-G311 WeakPolarHBondContact O-CA 3.48Å; C307-G311 PolarHBondContact O-N 2.86Å; C307-K312 WeakPolarHBondContact CB-O 2.93Å; C307-K312 PolarHBondContact N-O 3.18Å; C307-F314 HydrophobicContact CB-CE2 4.33Å; C307-L320 HydrophobicContact CB-CD1 3.62Å; C307-H327 VanDerWaalsContact SG-CD2 3.6Å; C307-H327 PolarHBondContact SG-NE2 2.67Å
308	L	71.8	Confident	70.9	Confident	159 Å²	159	86 Å²	86	83%	0.832	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-30.8	-178.9	-59.2	176.6	0	0	0	112.2	C310	L308-C310 PolarHBondContact O-N 3.21Å
309	E	74.1	Confident	71.2	Confident	116 Å²	116	84.3 Å²	84.3	54%	0.542	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-21	-174.8	-62.4	145	145.9	0	0	114	C307 H327	C307-E309 VanDerWaalsContact C-N 3.35Å; E309-H327 IonicContact OE2-CD2 3.38Å; E309-H327 PolarHBondContact OE2-CD2 3.43Å; E309-H327 IonicContact OE2-CG 3.1Å
310	C	76.7	Confident	71.6	Confident	52 Å²	52	80.9 Å²	80.9	35%	0.351	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.3	12.3	-177.8	71.6	0	0	0	0	115	L308 K312 H323 H327	L308-C310 PolarHBondContact O-N 3.21Å; C310-K312 PolarHBondContact O-N 3.34Å; C310-H323 PolarHBondContact SG-NE2 3.38Å; C310-H327 PolarHBondContact SG-CE1 3.35Å; C310-H327 PolarHBondContact SG-NE2 3.15Å
311	G	70	Confident	72	Confident	59 Å²	59	81 Å²	81	61%	0.608	42%	0.424	S	S	*	.			trans	66.1	-9.2	-178.9	0	0	0	0	0	116.4	C307 A313	C307-G311 VanDerWaalsContact O-CA 3.27Å; C307-G311 WeakPolarHBondContact O-CA 3.48Å; C307-G311 PolarHBondContact O-N 2.86Å; G311-A313 PolarHBondContact O-N 3.42Å
312	K	72.8	Confident	72.6	Confident	127 Å²	127	80.4 Å²	80.4	55%	0.552	41%	0.41	S	S	*	.			trans	-64	128.5	-177.2	-71.3	177.8	-175.4	168.2	0	110.7	C307 C310 F314	C307-K312 WeakPolarHBondContact CB-O 2.93Å; C307-K312 PolarHBondContact N-O 3.18Å; C310-K312 PolarHBondContact O-N 3.34Å; K312-F314 HydrophobicContact CB-CE2 3.87Å; K312-F314 HydrophobicContact CB-CZ 4.08Å; K312-F314 WeakPolarHBondContact O-CD2 3.49Å; K312-F314 VanDerWaalsContact O-CE2 3.23Å; K312-F314 WeakPolarHBondContact O-CE2 3.42Å
313	A	74.4	Confident	73.4	Confident	26 Å²	26	77 Å²	77	22%	0.215	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.9	-171.9	0	0	0	0	0	112	K303 K306 G311	K303-A313 HydrophobicContact CB-CB 3.32Å; K303-A313 HydrophobicContact CD-CB 3.78Å; K303-A313 WeakPolarHBondContact CD-O 3.19Å; K303-A313 HydrophobicContact CG-CB 4.17Å; K306-A313 HydrophobicContact CB-CB 4.39Å; K306-A313 HydrophobicContact CG-CB 3.81Å; G311-A313 PolarHBondContact O-N 3.42Å
314	F	75.6	Confident	73.8	Confident	44 Å²	44	76 Å²	76	19%	0.193	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.2	-165.4	-63.2	-91	0	0	0	112.2	K303 Y305 C307 K312 L320 H323	K303-F314 CarbonylContact C-O 3.59Å; Y305-F314 PolarHBondContact N-O 2.91Å; Y305-F314 PolarHBondContact O-N 3.38Å; C307-F314 HydrophobicContact CB-CE2 4.33Å; K312-F314 HydrophobicContact CB-CE2 3.87Å; K312-F314 HydrophobicContact CB-CZ 4.08Å; K312-F314 WeakPolarHBondContact O-CD2 3.49Å; K312-F314 VanDerWaalsContact O-CE2 3.23Å; K312-F314 WeakPolarHBondContact O-CE2 3.42Å; F314-L320 HydrophobicContact CB-CB 4.22Å; F314-L320 HydrophobicContact CD2-CB 4.01Å; F314-L320 HydrophobicContact CD2-CD1 3.78Å; F314-L320 HydrophobicContact CD2-CG 4.49Å; F314-L320 HydrophobicContact CE2-CD1 4.02Å; F314-L320 HydrophobicContact CG-CB 4.21Å; F314-H323 HydrophobicContact CE1-CB 4Å; F314-H323 HydrophobicContact CE2-CB 4.01Å; F314-H323 AromaticContact CE2-CD2 3.22Å; F314-H323 WeakPolarHBondContact CE2-CD2 3.41Å; F314-H323 AromaticContact CE2-CG 3.66Å; F314-H323 AromaticContact CE2-NE2 3.88Å; F314-H323 HydrophobicContact CZ-CB 3.55Å; F314-H323 AromaticContact CZ-CD2 3.29Å; F314-H323 WeakPolarHBondContact CZ-CD2 3.37Å; F314-H323 AromaticContact CZ-CG 3.23Å; F314-H323 AromaticContact CZ-ND1 3.81Å; F314-H323 AromaticContact CZ-NE2 3.85Å
315	K	70.8	Confident	74.2	Confident	87 Å²	87	70.1 Å²	70.1	38%	0.378	37%	0.369	S	S	.	.	S	Bend	trans	-85.8	-13.5	179.9	-63.5	-179.7	176.3	176.5	0	113.6	I297 I298	I297-K315 HydrophobicContact CG2-CB 4.39Å; I297-K315 HydrophobicContact CG2-CG 4.33Å; I298-K315 HydrophobicContact CG1-CD 4.16Å
316	Q	74.1	Confident	74.4	Confident	80 Å²	80	70.5 Å²	70.5	37%	0.374	38%	0.376	S	S	.	.	S	Bend	trans	-142.4	138.6	-179.1	-66.6	-178.8	-8.2	0	0	110.8	T294 S318 T319 L320	T294-Q316 HydrophobicContact CG2-CG 4.45Å; Q316-S318 VanDerWaalsContact C-N 3.32Å; Q316-S318 PolarHBondContact O-N 3.27Å; Q316-T319 HydrophobicContact CB-CG2 4.24Å; Q316-T319 PolarHBondContact O-N 3.48Å; Q316-T319 VanDerWaalsContact O-N 3.09Å; Q316-T319 PolarHBondContact O-OG1 3.13Å; Q316-L320 PolarHBondContact O-N 3.03Å
317	L	74.6	Confident	74.4	Confident	96 Å²	96	66.9 Å²	66.9	50%	0.503	36%	0.362	S	S	.	.	H	α-helix	trans	-56.3	-45.3	177.8	-178.5	59.1	0	0	0	111.9	Y305 T319 L320 T321	Y305-L317 HydrophobicContact CD1-CB 3.99Å; Y305-L317 HydrophobicContact CD1-CD1 3.8Å; Y305-L317 HydrophobicContact CD1-CG 4.46Å; Y305-L317 HydrophobicContact CD2-CB 4.45Å; Y305-L317 HydrophobicContact CE1-CB 3.79Å; Y305-L317 HydrophobicContact CE1-CD1 4.04Å; Y305-L317 HydrophobicContact CE1-CG 4.34Å; Y305-L317 HydrophobicContact CE2-CB 4.25Å; Y305-L317 HydrophobicContact CG-CB 4.31Å; L317-T319 PolarHBondContact O-N 2.9Å; L317-L320 CarbonylContact O-C 3.27Å; L317-L320 WeakPolarHBondContact O-CA 3.32Å; L317-L320 WeakPolarHBondContact O-CB 3.46Å; L317-L320 PolarHBondContact O-N 3.42Å; L317-T321 PolarHBondContact O-N 2.87Å; L317-T321 PolarHBondContact O-OG1 3.08Å; L317-T321 VanDerWaalsContact O-OG1 3.06Å
318	S	74.6	Confident	74	Confident	72 Å²	72	70.9 Å²	70.9	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-53.6	-39.1	176.4	55.9	0	0	0	0	113.1	Q316 T321 T322	Q316-S318 VanDerWaalsContact C-N 3.32Å; Q316-S318 PolarHBondContact O-N 3.27Å; S318-T321 PolarHBondContact O-N 2.93Å; S318-T322 WeakPolarHBondContact O-CG2 3.35Å; S318-T322 PolarHBondContact O-N 3Å
319	T	76.2	Confident	73.6	Confident	44 Å²	44	65.8 Å²	65.8	27%	0.27	37%	0.372	S	S	.	.	H	α-helix	trans	-71.2	-39	177.4	59.9	0	0	0	0	112.2	Q316 L317 T322 H323	Q316-T319 HydrophobicContact CB-CG2 4.24Å; Q316-T319 PolarHBondContact O-N 3.48Å; Q316-T319 VanDerWaalsContact O-N 3.09Å; Q316-T319 PolarHBondContact O-OG1 3.13Å; L317-T319 PolarHBondContact O-N 2.9Å; T319-T322 PolarHBondContact O-N 3.13Å; T319-T322 PolarHBondContact O-OG1 3.25Å; T319-H323 WeakPolarHBondContact O-CB 3.48Å; T319-H323 PolarHBondContact O-N 3.44Å
320	L	78.4	Confident	73.2	Confident	13 Å²	13	65.7 Å²	65.7	7%	0.068	37%	0.371	C	S	.	.	H	α-helix	trans	-61.9	-44.8	170.8	173.1	62.5	0	0	0	111	C307 F314 Q316 L317 T322 H323 K324	C307-L320 HydrophobicContact CB-CD1 3.62Å; F314-L320 HydrophobicContact CB-CB 4.22Å; F314-L320 HydrophobicContact CD2-CB 4.01Å; F314-L320 HydrophobicContact CD2-CD1 3.78Å; F314-L320 HydrophobicContact CD2-CG 4.49Å; F314-L320 HydrophobicContact CE2-CD1 4.02Å; F314-L320 HydrophobicContact CG-CB 4.21Å; Q316-L320 PolarHBondContact O-N 3.03Å; L317-L320 CarbonylContact O-C 3.27Å; L317-L320 WeakPolarHBondContact O-CA 3.32Å; L317-L320 WeakPolarHBondContact O-CB 3.46Å; L317-L320 PolarHBondContact O-N 3.42Å; L320-T322 PolarHBondContact O-N 3.34Å; L320-H323 CarbonylContact O-C 3.41Å; L320-H323 WeakPolarHBondContact O-CA 3.41Å; L320-H323 WeakPolarHBondContact O-CB 3.35Å; L320-H323 PolarHBondContact O-N 3.19Å; L320-K324 HydrophobicContact CD1-CG 4.22Å; L320-K324 PolarHBondContact O-N 3.22Å
321	T	76.3	Confident	72.7	Confident	79 Å²	79	69.4 Å²	69.4	49%	0.485	38%	0.381	S	S	.	.	H	α-helix	trans	-58.2	-47.1	176.7	-49.6	0	0	0	0	111	L317 S318 H323 K324	L317-T321 PolarHBondContact O-N 2.87Å; L317-T321 PolarHBondContact O-OG1 3.08Å; L317-T321 VanDerWaalsContact O-OG1 3.06Å; S318-T321 PolarHBondContact O-N 2.93Å; T321-H323 PolarHBondContact O-N 3.2Å; T321-K324 PolarHBondContact O-N 3Å
322	T	74.4	Confident	72.7	Confident	38 Å²	38	71 Å²	71	23%	0.233	38%	0.376	C	S	.	.	H	α-helix	trans	-67.4	-18.5	175.3	64.7	0	0	0	0	114.3	S318 T319 L320 R344	S318-T322 WeakPolarHBondContact O-CG2 3.35Å; S318-T322 PolarHBondContact O-N 3Å; T319-T322 PolarHBondContact O-N 3.13Å; T319-T322 PolarHBondContact O-OG1 3.25Å; L320-T322 PolarHBondContact O-N 3.34Å; T322-R344 PolarHBondContact OG1-NH2 2.86Å
323	H	78.9	Confident	72.8	Confident	16 Å²	16	69.3 Å²	69.3	7%	0.074	37%	0.366	C	S	.	.	H	α-helix	trans	-84.2	-38.8	176.5	171.1	61.4	0	0	0	112.2	C310 F314 T319 L320 T321 I325 I326 H327	C310-H323 PolarHBondContact SG-NE2 3.38Å; F314-H323 HydrophobicContact CE1-CB 4Å; F314-H323 HydrophobicContact CE2-CB 4.01Å; F314-H323 AromaticContact CE2-CD2 3.22Å; F314-H323 WeakPolarHBondContact CE2-CD2 3.41Å; F314-H323 AromaticContact CE2-CG 3.66Å; F314-H323 AromaticContact CE2-NE2 3.88Å; F314-H323 HydrophobicContact CZ-CB 3.55Å; F314-H323 AromaticContact CZ-CD2 3.29Å; F314-H323 WeakPolarHBondContact CZ-CD2 3.37Å; F314-H323 AromaticContact CZ-CG 3.23Å; F314-H323 AromaticContact CZ-ND1 3.81Å; F314-H323 AromaticContact CZ-NE2 3.85Å; T319-H323 WeakPolarHBondContact O-CB 3.48Å; T319-H323 PolarHBondContact O-N 3.44Å; L320-H323 CarbonylContact O-C 3.41Å; L320-H323 WeakPolarHBondContact O-CA 3.41Å; L320-H323 WeakPolarHBondContact O-CB 3.35Å; L320-H323 PolarHBondContact O-N 3.19Å; T321-H323 PolarHBondContact O-N 3.2Å; H323-I325 PolarHBondContact O-N 3.11Å; H323-I326 WeakPolarHBondContact O-CB 3.33Å; H323-I326 WeakPolarHBondContact O-CG1 3.23Å; H323-I326 PolarHBondContact O-N 3.46Å; H323-H327 AromaticContact CD2-NE2 3.82Å; H323-H327 AromaticContact CE1-CE1 3.79Å; H323-H327 AromaticContact CE1-NE2 3.37Å; H323-H327 PolarHBondContact CE1-NE2 3.19Å; H323-H327 AromaticContact NE2-CE1 3.82Å; H323-H327 AromaticContact NE2-NE2 3.04Å; H323-H327 PolarHBondContact NE2-NE2 3.37Å
324	K	74.4	Confident	73	Confident	94 Å²	94	74.7 Å²	74.7	41%	0.409	39%	0.385	S	S	.	.	H	α-helix	trans	-56.1	-35.4	175.5	-74.2	-168.2	171.2	-162.6	0	112.7	L320 T321 I326 H327 V328	L320-K324 HydrophobicContact CD1-CG 4.22Å; L320-K324 PolarHBondContact O-N 3.22Å; T321-K324 PolarHBondContact O-N 3Å; K324-I326 PolarHBondContact O-N 3.1Å; K324-H327 PolarHBondContact O-N 3.17Å; K324-V328 PolarHBondContact O-N 3.43Å
325	I	74.8	Confident	73.4	Confident	32 Å²	32	72.6 Å²	72.6	16%	0.164	38%	0.376	C	S	.	.	H	α-helix	trans	-53.6	-25.6	173.1	-58.6	170.2	0	0	0	112.5	H323 G329 E330 L332 N343	H323-I325 PolarHBondContact O-N 3.11Å; I325-G329 PolarHBondContact O-N 3.32Å; I325-E330 WeakPolarHBondContact CG2-O 3.31Å; I325-L332 HydrophobicContact CD1-CD1 3.93Å; I325-L332 HydrophobicContact CG1-CD1 4.36Å; I325-L332 HydrophobicContact CG2-CD1 4.41Å; I325-N343 HydrophobicContact CG2-CB 3.95Å
326	I	71.8	Confident	73.9	Confident	97 Å²	97	76.1 Å²	76.1	50%	0.497	39%	0.394	S	S	.	.	H	α-helix	trans	-71.8	-36.4	177.7	-56	178.5	0	0	0	111.5	H323 K324 G329	H323-I326 WeakPolarHBondContact O-CB 3.33Å; H323-I326 WeakPolarHBondContact O-CG1 3.23Å; H323-I326 PolarHBondContact O-N 3.46Å; K324-I326 PolarHBondContact O-N 3.1Å; I326-G329 PolarHBondContact O-N 3.36Å
327	H	70.8	Confident	74.2	Confident	72 Å²	72	77.9 Å²	77.9	33%	0.333	40%	0.402	S	S	.	.	H	α-helix	trans	-78.7	-38.4	-178.4	-57	-52.6	0	0	0	112.2	C307 E309 C310 H323 K324 G329	C307-H327 VanDerWaalsContact SG-CD2 3.6Å; C307-H327 PolarHBondContact SG-NE2 2.67Å; E309-H327 IonicContact OE2-CD2 3.38Å; E309-H327 PolarHBondContact OE2-CD2 3.43Å; E309-H327 IonicContact OE2-CG 3.1Å; C310-H327 PolarHBondContact SG-CE1 3.35Å; C310-H327 PolarHBondContact SG-NE2 3.15Å; H323-H327 AromaticContact CD2-NE2 3.82Å; H323-H327 AromaticContact CE1-CE1 3.79Å; H323-H327 AromaticContact CE1-NE2 3.37Å; H323-H327 PolarHBondContact CE1-NE2 3.19Å; H323-H327 AromaticContact NE2-CE1 3.82Å; H323-H327 AromaticContact NE2-NE2 3.04Å; H323-H327 PolarHBondContact NE2-NE2 3.37Å; K324-H327 PolarHBondContact O-N 3.17Å; H327-G329 PolarHBondContact O-N 3.1Å
328	V	69.1	Low	74.6	Confident	85 Å²	85	76 Å²	76	52%	0.515	40%	0.396	S	S	.	.	S	Bend	trans	-66	-18.5	173.4	-170.7	0	0	0	0	111.6	K324 E330	K324-V328 PolarHBondContact O-N 3.43Å; V328-E330 HydrophobicContact CB-CB 4.46Å; V328-E330 HydrophobicContact CG1-CB 4.06Å; V328-E330 HydrophobicContact CG1-CG 3.78Å; V328-E330 PolarHBondContact O-N 3.35Å
329	G	63.7	Low	74.8	Confident	52 Å²	52	75.3 Å²	75.3	54%	0.536	40%	0.401	S	S	.	.			trans	70.4	-7.8	-177.5	0	0	0	0	0	114.6	I325 I326 H327 K331	I325-G329 PolarHBondContact O-N 3.32Å; I326-G329 PolarHBondContact O-N 3.36Å; H327-G329 PolarHBondContact O-N 3.1Å; G329-K331 PolarHBondContact O-N 3.03Å
330	E	64.4	Low	74.9	Confident	114 Å²	114	79.1 Å²	79.1	53%	0.533	41%	0.413	S	S	.	.			trans	-60.1	101.7	179	-90	-179.9	-169.6	0	0	112.3	I325 V328 L332	I325-E330 WeakPolarHBondContact CG2-O 3.31Å; V328-E330 HydrophobicContact CB-CB 4.46Å; V328-E330 HydrophobicContact CG1-CB 4.06Å; V328-E330 HydrophobicContact CG1-CG 3.78Å; V328-E330 PolarHBondContact O-N 3.35Å; E330-L332 HydrophobicContact CB-CD2 4.23Å; E330-L332 HydrophobicContact CB-CG 4.44Å; E330-L332 PolarHBondContact O-N 3.21Å
331	K	67.1	Low	74.9	Confident	130 Å²	130	79.1 Å²	79.1	57%	0.565	42%	0.416	S	S	*	.			trans	-80.3	74.6	168.3	-69.9	162.4	177.7	163.7	0	109.9	G329 Y333 G341	G329-K331 PolarHBondContact O-N 3.03Å; K331-Y333 PolarHBondContact O-N 3.5Å; K331-G341 WeakPolarHBondContact CD-O 3.23Å
332	L	69.2	Low	75	Confident	93 Å²	93	77.1 Å²	77.1	49%	0.487	40%	0.401	S	S	.	.			trans	-51	-28	-178	-63.8	175.6	0	0	0	114.4	I325 E330	I325-L332 HydrophobicContact CD1-CD1 3.93Å; I325-L332 HydrophobicContact CG1-CD1 4.36Å; I325-L332 HydrophobicContact CG2-CD1 4.41Å; E330-L332 HydrophobicContact CB-CD2 4.23Å; E330-L332 HydrophobicContact CB-CG 4.44Å; E330-L332 PolarHBondContact O-N 3.21Å
333	Y	75	Confident	75.1	Confident	91 Å²	91	77.8 Å²	77.8	36%	0.357	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	89.8	-177.8	-56.9	-73.7	0	0	0	110.4	K331 G341 F342 S345	K331-Y333 PolarHBondContact O-N 3.5Å; Y333-G341 CarbonylContact O-C 3.59Å; Y333-G341 WeakPolarHBondContact O-CA 3.22Å; Y333-F342 PolarHBondContact N-O 3.09Å; Y333-F342 VanDerWaalsContact N-O 3.08Å; Y333-F342 PolarHBondContact O-N 3.46Å; Y333-S345 VanDerWaalsContact CD2-N 3.28Å
334	K	78.3	Confident	74.9	Confident	139 Å²	139	82 Å²	82	60%	0.604	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	149.8	177.1	-62.6	-178.5	-175	174.4	0	111.8	L348	K334-L348 WeakPolarHBondContact O-CD2 3.46Å
335	C	84	Confident	75	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.007	42%	0.42	C	S	.	.			trans	-97.4	113.3	169.9	-176.6	0	0	0	0	109.1	E337 C338 G339 K340 F342 L348 H355	C335-E337 PolarHBondContact O-N 3.5Å; C335-C338 PolarHBondContact O-N 2.79Å; C335-G339 VanDerWaalsContact O-CA 3.29Å; C335-G339 WeakPolarHBondContact O-CA 3.18Å; C335-G339 PolarHBondContact O-N 3.4Å; C335-K340 VanDerWaalsContact CB-O 3.29Å; C335-K340 WeakPolarHBondContact CB-O 3.39Å; C335-K340 PolarHBondContact N-O 3.15Å; C335-F342 HydrophobicContact CB-CE2 4.48Å; C335-L348 HydrophobicContact CB-CD1 3.61Å; C335-H355 PolarHBondContact SG-NE2 2.79Å
336	E	81.1	Confident	75.2	Confident	161 Å²	161	82.1 Å²	82.1	75%	0.752	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-33.5	179	-52.9	-48.2	129.7	0	0	113.2	C338	E336-C338 PolarHBondContact O-N 3.12Å
337	E	81.4	Confident	75.6	Confident	116 Å²	116	80.3 Å²	80.3	54%	0.542	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.8	-173.1	-63.3	172.9	-110.3	0	0	114.3	C335 H355	C335-E337 PolarHBondContact O-N 3.5Å; E337-H355 WeakPolarHBondContact OE2-CB 3.5Å; E337-H355 IonicContact OE2-CD2 3.15Å; E337-H355 IonicContact OE2-CG 3.81Å
338	C	82.3	Confident	76.2	Confident	57 Å²	57	77.9 Å²	77.9	39%	0.385	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.8	11	-179	69.3	0	0	0	0	115	C335 E336 K340 H351 H355	C335-C338 PolarHBondContact O-N 2.79Å; E336-C338 PolarHBondContact O-N 3.12Å; C338-K340 PolarHBondContact O-N 3.23Å; C338-K340 WeakPolarHBondContact SG-CB 3.5Å; C338-H351 PolarHBondContact SG-NE2 3.46Å; C338-H355 WeakPolarHBondContact CB-CE1 3.47Å; C338-H355 PolarHBondContact SG-CE1 3.14Å; C338-H355 PolarHBondContact SG-NE2 3.4Å
339	G	78.7	Confident	76.7	Confident	58 Å²	58	78.3 Å²	78.3	60%	0.598	42%	0.417	S	S	*	.			trans	64.1	-5.8	-176.1	0	0	0	0	0	115.5	C335 G341	C335-G339 VanDerWaalsContact O-CA 3.29Å; C335-G339 WeakPolarHBondContact O-CA 3.18Å; C335-G339 PolarHBondContact O-N 3.4Å; G339-G341 PolarHBondContact O-N 2.9Å
340	K	78.2	Confident	77.4	Confident	123 Å²	123	79 Å²	79	54%	0.535	41%	0.412	S	S	.	.			trans	-69.9	119.5	-172.1	-167.6	168.8	-173.4	166.9	0	110.8	C335 C338 F342	C335-K340 VanDerWaalsContact CB-O 3.29Å; C335-K340 WeakPolarHBondContact CB-O 3.39Å; C335-K340 PolarHBondContact N-O 3.15Å; C338-K340 PolarHBondContact O-N 3.23Å; C338-K340 WeakPolarHBondContact SG-CB 3.5Å; K340-F342 HydrophobicContact CB-CE2 4.21Å; K340-F342 HydrophobicContact CB-CZ 4.47Å; K340-F342 HydrophobicContact CD-CZ 4.03Å; K340-F342 HydrophobicContact CG-CE2 4.04Å; K340-F342 HydrophobicContact CG-CZ 3.93Å; K340-F342 WeakPolarHBondContact O-CD2 3.4Å; K340-F342 WeakPolarHBondContact O-CE2 3.39Å
341	G	78.9	Confident	78.3	Confident	13 Å²	13	74.6 Å²	74.6	13%	0.134	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	147.3	-177.4	0	0	0	0	0	114.9	K331 Y333 G339	K331-G341 WeakPolarHBondContact CD-O 3.23Å; Y333-G341 CarbonylContact O-C 3.59Å; Y333-G341 WeakPolarHBondContact O-CA 3.22Å; G339-G341 PolarHBondContact O-N 2.9Å
342	F	79.1	Confident	79	Confident	37 Å²	37	72.5 Å²	72.5	16%	0.162	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.5	-174.6	-59.7	-92.9	0	0	0	111.7	Y333 C335 K340 N347 L348 H351	Y333-F342 PolarHBondContact N-O 3.09Å; Y333-F342 VanDerWaalsContact N-O 3.08Å; Y333-F342 PolarHBondContact O-N 3.46Å; C335-F342 HydrophobicContact CB-CE2 4.48Å; K340-F342 HydrophobicContact CB-CE2 4.21Å; K340-F342 HydrophobicContact CB-CZ 4.47Å; K340-F342 HydrophobicContact CD-CZ 4.03Å; K340-F342 HydrophobicContact CG-CE2 4.04Å; K340-F342 HydrophobicContact CG-CZ 3.93Å; K340-F342 WeakPolarHBondContact O-CD2 3.4Å; K340-F342 WeakPolarHBondContact O-CE2 3.39Å; F342-N347 HydrophobicContact CB-CB 4.34Å; F342-N347 HydrophobicContact CD1-CB 3.93Å; F342-N347 HydrophobicContact CG-CB 4.39Å; F342-L348 HydrophobicContact CB-CB 4.42Å; F342-L348 HydrophobicContact CD2-CB 4.01Å; F342-L348 HydrophobicContact CD2-CD1 3.93Å; F342-L348 HydrophobicContact CE2-CD1 4.1Å; F342-L348 HydrophobicContact CG-CB 4.35Å; F342-H351 HydrophobicContact CE1-CB 4.08Å; F342-H351 HydrophobicContact CE2-CB 3.93Å; F342-H351 AromaticContact CE2-CD2 3.26Å; F342-H351 WeakPolarHBondContact CE2-CD2 3.5Å; F342-H351 AromaticContact CE2-CG 3.66Å; F342-H351 AromaticContact CE2-NE2 3.98Å; F342-H351 HydrophobicContact CZ-CB 3.52Å; F342-H351 AromaticContact CZ-CD2 3.34Å; F342-H351 WeakPolarHBondContact CZ-CD2 3.44Å; F342-H351 AromaticContact CZ-CG 3.27Å; F342-H351 AromaticContact CZ-ND1 3.87Å; F342-H351 AromaticContact CZ-NE2 3.93Å
343	N	75.1	Confident	79.6	Confident	52 Å²	52	69.9 Å²	69.9	28%	0.278	37%	0.368	S	S	.	.	S	Bend	trans	-88.7	-2.5	177.4	62.2	-1.4	0	0	0	114.3	I325	I325-N343 HydrophobicContact CG2-CB 3.95Å
344	R	75.4	Confident	79.9	Confident	106 Å²	106	69.4 Å²	69.4	40%	0.4	37%	0.371	S	S	.	.	S	Bend	trans	-144.4	134.9	178.5	-65.8	-176.9	176.8	178.1	-2.4	110.5	T322 S346 N347 L348	T322-R344 PolarHBondContact OG1-NH2 2.86Å; R344-S346 VanDerWaalsContact C-N 3.3Å; R344-S346 PolarHBondContact O-N 3.22Å; R344-N347 HydrophobicContact CB-CB 4.4Å; R344-N347 WeakPolarHBondContact O-CB 3.39Å; R344-N347 PolarHBondContact O-N 3.12Å; R344-L348 PolarHBondContact O-N 3.08Å
345	S	77.6	Confident	80	Confident	63 Å²	63	66.4 Å²	66.4	44%	0.441	36%	0.359	S	S	.	.	H	α-helix	trans	-56.4	-42.1	176.7	54.2	0	0	0	0	112.4	Y333 N347 L348 T349	Y333-S345 VanDerWaalsContact CD2-N 3.28Å; S345-N347 PolarHBondContact O-N 2.82Å; S345-L348 WeakPolarHBondContact O-CB 3.32Å; S345-L348 PolarHBondContact O-N 2.88Å; S345-L348 VanDerWaalsContact O-N 3.15Å; S345-T349 PolarHBondContact O-N 3.42Å; S345-T349 PolarHBondContact O-OG1 2.93Å; S345-T349 VanDerWaalsContact O-OG1 3.1Å
346	S	78	Confident	79.7	Confident	65 Å²	65	70.4 Å²	70.4	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-54.3	-38.5	175.7	60.2	0	0	0	0	113	R344 T349 T350	R344-S346 VanDerWaalsContact C-N 3.3Å; R344-S346 PolarHBondContact O-N 3.22Å; S346-T349 PolarHBondContact O-N 3.46Å; S346-T350 WeakPolarHBondContact O-CG2 3.5Å; S346-T350 PolarHBondContact O-N 2.8Å; S346-T350 PolarHBondContact O-OG1 3.17Å
347	N	80.8	Confident	79.5	Confident	59 Å²	59	64.8 Å²	64.8	32%	0.316	37%	0.368	S	S	.	.	H	α-helix	trans	-72.9	-41.4	-177.9	-63.4	0.7	0	0	0	110.2	F342 R344 S345 T350 H351	F342-N347 HydrophobicContact CB-CB 4.34Å; F342-N347 HydrophobicContact CD1-CB 3.93Å; F342-N347 HydrophobicContact CG-CB 4.39Å; R344-N347 HydrophobicContact CB-CB 4.4Å; R344-N347 WeakPolarHBondContact O-CB 3.39Å; R344-N347 PolarHBondContact O-N 3.12Å; S345-N347 PolarHBondContact O-N 2.82Å; N347-T350 WeakPolarHBondContact CA-OG1 3.25Å; N347-T350 PolarHBondContact O-N 3.12Å; N347-T350 PolarHBondContact O-OG1 3.27Å; N347-H351 WeakPolarHBondContact O-CB 3.25Å; N347-H351 PolarHBondContact O-N 2.9Å
348	L	82.4	Confident	79.3	Confident	21 Å²	21	65 Å²	65	11%	0.11	37%	0.369	C	S	.	.	H	α-helix	trans	-59.7	-45.6	170.9	174.2	62.7	0	0	0	111.2	K334 C335 F342 R344 S345 T350 H351 K352	K334-L348 WeakPolarHBondContact O-CD2 3.46Å; C335-L348 HydrophobicContact CB-CD1 3.61Å; F342-L348 HydrophobicContact CB-CB 4.42Å; F342-L348 HydrophobicContact CD2-CB 4.01Å; F342-L348 HydrophobicContact CD2-CD1 3.93Å; F342-L348 HydrophobicContact CE2-CD1 4.1Å; F342-L348 HydrophobicContact CG-CB 4.35Å; R344-L348 PolarHBondContact O-N 3.08Å; S345-L348 WeakPolarHBondContact O-CB 3.32Å; S345-L348 PolarHBondContact O-N 2.88Å; S345-L348 VanDerWaalsContact O-N 3.15Å; L348-T350 PolarHBondContact O-N 3.2Å; L348-H351 WeakPolarHBondContact O-CB 3.38Å; L348-H351 PolarHBondContact O-N 2.49Å; L348-K352 HydrophobicContact CD1-CG 4.34Å; L348-K352 PolarHBondContact O-N 2.71Å
349	T	79.5	Confident	79.4	Confident	93 Å²	93	67.7 Å²	67.7	57%	0.571	37%	0.374	S	S	*	.	H	α-helix	trans	-58.1	-46	176.2	-52.9	0	0	0	0	111.5	S345 S346 H351 K352	S345-T349 PolarHBondContact O-N 3.42Å; S345-T349 PolarHBondContact O-OG1 2.93Å; S345-T349 VanDerWaalsContact O-OG1 3.1Å; S346-T349 PolarHBondContact O-N 3.46Å; T349-H351 VanDerWaalsContact C-N 3.26Å; T349-H351 PolarHBondContact O-N 3.36Å; T349-K352 PolarHBondContact O-N 2.89Å
350	T	79.8	Confident	79.5	Confident	67 Å²	67	68.6 Å²	68.6	41%	0.411	37%	0.37	S	S	.	.	H	α-helix	trans	-68.1	-24.4	175.7	55.1	0	0	0	0	114	S346 N347 L348	S346-T350 WeakPolarHBondContact O-CG2 3.5Å; S346-T350 PolarHBondContact O-N 2.8Å; S346-T350 PolarHBondContact O-OG1 3.17Å; N347-T350 WeakPolarHBondContact CA-OG1 3.25Å; N347-T350 PolarHBondContact O-N 3.12Å; N347-T350 PolarHBondContact O-OG1 3.27Å; L348-T350 PolarHBondContact O-N 3.2Å
351	H	83.3	Confident	79.8	Confident	21 Å²	21	67.3 Å²	67.3	10%	0.097	36%	0.362	C	S	.	.	H	α-helix	trans	-76.6	-38.5	177	172.7	56.8	0	0	0	112.2	C338 F342 N347 L348 T349 I353 I354 H355	C338-H351 PolarHBondContact SG-NE2 3.46Å; F342-H351 HydrophobicContact CE1-CB 4.08Å; F342-H351 HydrophobicContact CE2-CB 3.93Å; F342-H351 AromaticContact CE2-CD2 3.26Å; F342-H351 WeakPolarHBondContact CE2-CD2 3.5Å; F342-H351 AromaticContact CE2-CG 3.66Å; F342-H351 AromaticContact CE2-NE2 3.98Å; F342-H351 HydrophobicContact CZ-CB 3.52Å; F342-H351 AromaticContact CZ-CD2 3.34Å; F342-H351 WeakPolarHBondContact CZ-CD2 3.44Å; F342-H351 AromaticContact CZ-CG 3.27Å; F342-H351 AromaticContact CZ-ND1 3.87Å; F342-H351 AromaticContact CZ-NE2 3.93Å; N347-H351 WeakPolarHBondContact O-CB 3.25Å; N347-H351 PolarHBondContact O-N 2.9Å; L348-H351 WeakPolarHBondContact O-CB 3.38Å; L348-H351 PolarHBondContact O-N 2.49Å; T349-H351 VanDerWaalsContact C-N 3.26Å; T349-H351 PolarHBondContact O-N 3.36Å; H351-I353 PolarHBondContact O-N 2.67Å; H351-I353 VanDerWaalsContact O-N 3.13Å; H351-I354 VanDerWaalsContact O-CB 3.26Å; H351-I354 WeakPolarHBondContact O-CB 3.4Å; H351-I354 PolarHBondContact O-N 3.46Å; H351-H355 AromaticContact CD2-NE2 3.6Å; H351-H355 AromaticContact CE1-NE2 3.53Å; H351-H355 AromaticContact NE2-NE2 2.84Å; H351-H355 PolarHBondContact NE2-NE2 2.99Å
352	K	81.6	Confident	80.1	Confident	87 Å²	87	73 Å²	73	38%	0.378	38%	0.384	S	S	.	.	H	α-helix	trans	-56.8	-28.3	177.1	-72.4	-168.8	174.7	-161.3	0	113.3	L348 T349 I354 H355 T356	L348-K352 HydrophobicContact CD1-CG 4.34Å; L348-K352 PolarHBondContact O-N 2.71Å; T349-K352 PolarHBondContact O-N 2.89Å; K352-I354 PolarHBondContact O-N 3.23Å; K352-H355 PolarHBondContact O-N 3.41Å; K352-T356 PolarHBondContact O-N 3.22Å
353	I	81.9	Confident	80.6	Confident	38 Å²	38	71.3 Å²	71.3	20%	0.195	38%	0.376	C	S	.	.	H	α-helix	trans	-60.9	-24.5	174.6	-42.2	178.4	0	0	0	112.2	H351 T356 G357 E358 I371	H351-I353 PolarHBondContact O-N 2.67Å; H351-I353 VanDerWaalsContact O-N 3.13Å; I353-T356 PolarHBondContact O-OG1 2.83Å; I353-G357 PolarHBondContact O-N 2.96Å; I353-E358 HydrophobicContact CG2-CB 4.03Å; I353-E358 WeakPolarHBondContact CG2-O 3.26Å; I353-I371 HydrophobicContact CB-CG2 4.03Å; I353-I371 HydrophobicContact CG2-CG2 3.78Å
354	I	80.4	Confident	81.2	Confident	81 Å²	81	76.6 Å²	76.6	42%	0.415	40%	0.399	S	S	.	.	H	α-helix	trans	-68.6	-37.3	175.3	-61.5	174.8	0	0	0	110.8	H351 K352 I371 W372	H351-I354 VanDerWaalsContact O-CB 3.26Å; H351-I354 WeakPolarHBondContact O-CB 3.4Å; H351-I354 PolarHBondContact O-N 3.46Å; K352-I354 PolarHBondContact O-N 3.23Å; I354-I371 HydrophobicContact CG1-CD1 4.34Å; I354-W372 HydrophobicContact CD1-CZ2 4.42Å
355	H	80.1	Confident	81.7	Confident	76 Å²	76	77.1 Å²	77.1	35%	0.352	41%	0.406	S	S	.	.	H	α-helix	trans	-78.7	-41.3	-178.7	-61.4	-58.3	0	0	0	112.7	C335 E337 C338 H351 K352 G357	C335-H355 PolarHBondContact SG-NE2 2.79Å; E337-H355 WeakPolarHBondContact OE2-CB 3.5Å; E337-H355 IonicContact OE2-CD2 3.15Å; E337-H355 IonicContact OE2-CG 3.81Å; C338-H355 WeakPolarHBondContact CB-CE1 3.47Å; C338-H355 PolarHBondContact SG-CE1 3.14Å; C338-H355 PolarHBondContact SG-NE2 3.4Å; H351-H355 AromaticContact CD2-NE2 3.6Å; H351-H355 AromaticContact CE1-NE2 3.53Å; H351-H355 AromaticContact NE2-NE2 2.84Å; H351-H355 PolarHBondContact NE2-NE2 2.99Å; K352-H355 PolarHBondContact O-N 3.41Å; H355-G357 PolarHBondContact O-N 3.38Å; H355-G357 VanDerWaalsContact O-N 3.13Å
356	T	78.8	Confident	82	Confident	84 Å²	84	76.4 Å²	76.4	52%	0.515	40%	0.401	S	S	.	.	S	Bend	trans	-66.3	-13.6	174.8	63.7	0	0	0	0	112.9	K352 I353 E358	K352-T356 PolarHBondContact O-N 3.22Å; I353-T356 PolarHBondContact O-OG1 2.83Å; T356-E358 PolarHBondContact O-N 3.24Å; T356-E358 WeakPolarHBondContact OG1-CG 3.3Å; T356-E358 PolarHBondContact OG1-N 3Å
357	G	76.1	Confident	82.3	Confident	43 Å²	43	76 Å²	76	44%	0.443	41%	0.406	S	S	.	.			trans	65.9	4.6	-176.2	0	0	0	0	0	113.8	I353 H355 K359	I353-G357 PolarHBondContact O-N 2.96Å; H355-G357 PolarHBondContact O-N 3.38Å; H355-G357 VanDerWaalsContact O-N 3.13Å; G357-K359 PolarHBondContact O-N 3.25Å
358	E	78.2	Confident	82.4	Confident	121 Å²	121	79.2 Å²	79.2	57%	0.565	42%	0.418	S	S	*	.			trans	-62.4	135.4	-177.7	-75	-173.5	156.5	0	0	110.6	I353 T356 P360	I353-E358 HydrophobicContact CG2-CB 4.03Å; I353-E358 WeakPolarHBondContact CG2-O 3.26Å; T356-E358 PolarHBondContact O-N 3.24Å; T356-E358 WeakPolarHBondContact OG1-CG 3.3Å; T356-E358 PolarHBondContact OG1-N 3Å; E358-P360 WeakPolarHBondContact O-CD 3.48Å
359	K	83.1	Confident	82.6	Confident	113 Å²	113	79.8 Å²	79.8	49%	0.491	43%	0.425	S	S	.	.			trans	-126.7	78.2	179.7	-72.3	162.5	-178.3	174.3	0	108.6	G357 Y361 A369 F370 I371	G357-K359 PolarHBondContact O-N 3.25Å; K359-Y361 PolarHBondContact O-N 3.37Å; K359-A369 HydrophobicContact CB-CB 3.43Å; K359-A369 VanDerWaalsContact CB-CB 3.43Å; K359-A369 HydrophobicContact CD-CB 4.17Å; K359-A369 HydrophobicContact CG-CB 4.36Å; K359-F370 CarbonylContact C-O 3.55Å; K359-F370 VanDerWaalsContact C-O 3.27Å; K359-F370 VanDerWaalsContact CA-O 3.32Å; K359-F370 WeakPolarHBondContact CA-O 2.94Å; K359-I371 HydrophobicContact CG-CG1 3.97Å
360	P	82	Confident	82.8	Confident	78 Å²	78	77.5 Å²	77.5	51%	0.506	41%	0.408	S	S	.	.			trans	-64	-24.5	-172.2	-22.4	34.5	0	0	0	113.3	E358	E358-P360 WeakPolarHBondContact O-CD 3.48Å
361	Y	84.1	Confident	82.8	Confident	96 Å²	96	76.1 Å²	76.1	38%	0.376	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	93.7	-171.1	-56.4	-77.2	0	0	0	110.7	K359 F370 I371 S373	K359-Y361 PolarHBondContact O-N 3.37Å; Y361-F370 PolarHBondContact N-O 3.27Å; Y361-F370 VanDerWaalsContact N-O 3.12Å; Y361-F370 PolarHBondContact O-N 3.42Å; Y361-I371 WeakPolarHBondContact CD2-O 3.4Å; Y361-I371 VanDerWaalsContact CE2-O 3.31Å; Y361-I371 WeakPolarHBondContact CE2-O 3.28Å; Y361-S373 VanDerWaalsContact CD2-N 3.32Å
362	K	85.4	Confident	82.8	Confident	133 Å²	133	80.7 Å²	80.7	58%	0.578	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	146.8	178.4	-62.8	-174.1	-180	-179.1	0	112	A369 L376	K362-A369 HydrophobicContact CG-CB 3.93Å; K362-L376 VanDerWaalsContact O-CD2 3.26Å; K362-L376 WeakPolarHBondContact O-CD2 3.39Å
363	C	89.9	Confident	82.8	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.007	42%	0.416	C	S	.	.			trans	-94.1	112.4	168.8	-173.6	0	0	0	0	109.1	E365 C366 G367 K368 F370 L376 H383	C363-E365 PolarHBondContact O-N 3Å; C363-C366 PolarHBondContact O-N 2.87Å; C363-G367 VanDerWaalsContact O-CA 3.29Å; C363-G367 WeakPolarHBondContact O-CA 3.02Å; C363-G367 PolarHBondContact O-N 3.2Å; C363-K368 WeakPolarHBondContact CB-O 3.45Å; C363-K368 PolarHBondContact N-O 2.93Å; C363-F370 HydrophobicContact CB-CE2 4.38Å; C363-L376 HydrophobicContact CB-CD1 3.58Å; C363-H383 VanDerWaalsContact SG-CD2 3.58Å; C363-H383 PolarHBondContact SG-NE2 3.14Å
364	E	86.9	Confident	82.8	Confident	163 Å²	163	80.8 Å²	80.8	76%	0.762	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.8	-179.8	-55	-50.6	129.1	0	0	113
365	E	85	Confident	82.9	Confident	116 Å²	116	79 Å²	79	54%	0.542	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-21.5	-174.4	-63.9	169.1	-109.7	0	0	114.2	C363 H383	C363-E365 PolarHBondContact O-N 3Å; E365-H383 IonicContact OE1-CD2 3.87Å; E365-H383 WeakPolarHBondContact OE2-CB 3.32Å; E365-H383 IonicContact OE2-CD2 3.81Å; E365-H383 IonicContact OE2-CG 3.16Å
366	C	85.4	Confident	83.2	Confident	48 Å²	48	76.3 Å²	76.3	32%	0.324	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.3	10.1	-178.4	73.2	0	0	0	0	114.9	C363 K368 H379 H383	C363-C366 PolarHBondContact O-N 2.87Å; C366-K368 PolarHBondContact O-N 3.31Å; C366-H379 PolarHBondContact SG-NE2 3.19Å; C366-H383 WeakPolarHBondContact CB-CE1 3.26Å; C366-H383 PolarHBondContact SG-CE1 2.8Å; C366-H383 PolarHBondContact SG-NE2 3.12Å
367	G	83.2	Confident	83.5	Confident	56 Å²	56	76.7 Å²	76.7	58%	0.577	41%	0.412	S	S	*	.			trans	67.2	-8.1	-179	0	0	0	0	0	115.9	C363 A369	C363-G367 VanDerWaalsContact O-CA 3.29Å; C363-G367 WeakPolarHBondContact O-CA 3.02Å; C363-G367 PolarHBondContact O-N 3.2Å; G367-A369 PolarHBondContact O-N 3.36Å
368	K	83.8	Confident	83.9	Confident	127 Å²	127	81 Å²	81	55%	0.552	42%	0.419	S	S	*	.			trans	-64.5	129.2	-176	-70.9	-178.8	-179.2	176.2	0	111.1	C363 C366 F370	C363-K368 WeakPolarHBondContact CB-O 3.45Å; C363-K368 PolarHBondContact N-O 2.93Å; C366-K368 PolarHBondContact O-N 3.31Å; K368-F370 HydrophobicContact CB-CE2 3.92Å; K368-F370 HydrophobicContact CB-CZ 4.09Å; K368-F370 WeakPolarHBondContact O-CE2 2.98Å
369	A	85.9	Confident	84.3	Confident	33 Å²	33	76.1 Å²	76.1	27%	0.273	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	142.5	-176.3	0	0	0	0	0	111.6	K359 K362 G367	K359-A369 HydrophobicContact CB-CB 3.43Å; K359-A369 VanDerWaalsContact CB-CB 3.43Å; K359-A369 HydrophobicContact CD-CB 4.17Å; K359-A369 HydrophobicContact CG-CB 4.36Å; K362-A369 HydrophobicContact CG-CB 3.93Å; G367-A369 PolarHBondContact O-N 3.36Å
370	F	84.3	Confident	84.3	Confident	46 Å²	46	74.9 Å²	74.9	20%	0.202	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.4	-175.9	-59.6	-89.7	0	0	0	111.6	K359 Y361 C363 K368 W372 L376 H379	K359-F370 CarbonylContact C-O 3.55Å; K359-F370 VanDerWaalsContact C-O 3.27Å; K359-F370 VanDerWaalsContact CA-O 3.32Å; K359-F370 WeakPolarHBondContact CA-O 2.94Å; Y361-F370 PolarHBondContact N-O 3.27Å; Y361-F370 VanDerWaalsContact N-O 3.12Å; Y361-F370 PolarHBondContact O-N 3.42Å; C363-F370 HydrophobicContact CB-CE2 4.38Å; K368-F370 HydrophobicContact CB-CE2 3.92Å; K368-F370 HydrophobicContact CB-CZ 4.09Å; K368-F370 WeakPolarHBondContact O-CE2 2.98Å; F370-W372 VanDerWaalsContact C-N 3.34Å; F370-L376 HydrophobicContact CB-CB 4.34Å; F370-L376 HydrophobicContact CD2-CB 4.01Å; F370-L376 HydrophobicContact CD2-CD1 3.86Å; F370-L376 HydrophobicContact CE2-CD1 4.06Å; F370-L376 HydrophobicContact CG-CB 4.33Å; F370-H379 HydrophobicContact CE1-CB 4.06Å; F370-H379 HydrophobicContact CE2-CB 3.98Å; F370-H379 AromaticContact CE2-CD2 3.3Å; F370-H379 WeakPolarHBondContact CE2-CD2 3.36Å; F370-H379 AromaticContact CE2-CG 3.66Å; F370-H379 AromaticContact CE2-NE2 3.99Å; F370-H379 HydrophobicContact CZ-CB 3.57Å; F370-H379 AromaticContact CZ-CD2 3.37Å; F370-H379 WeakPolarHBondContact CZ-CD2 3.48Å; F370-H379 AromaticContact CZ-CG 3.26Å; F370-H379 AromaticContact CZ-ND1 3.8Å; F370-H379 AromaticContact CZ-NE2 3.94Å
371	I	80.1	Confident	84.4	Confident	38 Å²	38	75.3 Å²	75.3	20%	0.195	38%	0.382	C	S	.	.	S	Bend	trans	-73.5	-27.3	177.7	-58.1	179.8	0	0	0	111.3	I353 I354 K359 Y361	I353-I371 HydrophobicContact CB-CG2 4.03Å; I353-I371 HydrophobicContact CG2-CG2 3.78Å; I354-I371 HydrophobicContact CG1-CD1 4.34Å; K359-I371 HydrophobicContact CG-CG1 3.97Å; Y361-I371 WeakPolarHBondContact CD2-O 3.4Å; Y361-I371 VanDerWaalsContact CE2-O 3.31Å; Y361-I371 WeakPolarHBondContact CE2-O 3.28Å
372	W	81.7	Confident	84.3	Confident	117 Å²	117	74.3 Å²	74.3	44%	0.443	38%	0.383	S	S	.	.	S	Bend	trans	-129	143.7	-176.5	-55.2	-46.6	0	0	0	112.5	I354 F370 S374 T375 L376	I354-W372 HydrophobicContact CD1-CZ2 4.42Å; F370-W372 VanDerWaalsContact C-N 3.34Å; W372-S374 VanDerWaalsContact C-N 3.26Å; W372-S374 PolarHBondContact O-N 2.83Å; W372-T375 HydrophobicContact CE3-CG2 3.94Å; W372-T375 PolarHBondContact O-N 2.91Å; W372-T375 PolarHBondContact O-OG1 3.26Å; W372-L376 PolarHBondContact O-N 3.01Å
373	S	82.1	Confident	84.1	Confident	61 Å²	61	71.1 Å²	71.1	43%	0.427	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-36.5	174.4	55.5	0	0	0	0	112.2	Y361 T375 L376 T377	Y361-S373 VanDerWaalsContact CD2-N 3.32Å; S373-T375 VanDerWaalsContact C-N 3.34Å; S373-T375 PolarHBondContact O-N 3.22Å; S373-L376 PolarHBondContact O-N 2.85Å; S373-T377 PolarHBondContact O-N 3.05Å; S373-T377 PolarHBondContact O-OG1 3.23Å
374	S	81.3	Confident	83.5	Confident	65 Å²	65	74.5 Å²	74.5	46%	0.455	39%	0.39	S	S	.	.	H	α-helix	trans	-65.8	-32.4	179.5	62	0	0	0	0	113.3	W372 K378	W372-S374 VanDerWaalsContact C-N 3.26Å; W372-S374 PolarHBondContact O-N 2.83Å; S374-K378 WeakPolarHBondContact O-CG 3.47Å; S374-K378 PolarHBondContact O-N 3.14Å; S374-K378 VanDerWaalsContact O-N 3.14Å
375	T	84.3	Confident	83	Confident	44 Å²	44	76.6 Å²	76.6	27%	0.27	39%	0.391	S	S	.	.	H	α-helix	trans	-78.7	-36	174.7	48.6	0	0	0	0	111.6	W372 S373 K378 H379	W372-T375 HydrophobicContact CE3-CG2 3.94Å; W372-T375 PolarHBondContact O-N 2.91Å; W372-T375 PolarHBondContact O-OG1 3.26Å; S373-T375 VanDerWaalsContact C-N 3.34Å; S373-T375 PolarHBondContact O-N 3.22Å; T375-K378 PolarHBondContact O-N 2.86Å; T375-H379 VanDerWaalsContact O-CB 3.32Å; T375-H379 WeakPolarHBondContact O-CB 3.27Å; T375-H379 PolarHBondContact O-N 3.22Å
376	L	86.7	Confident	82.6	Confident	20 Å²	20	76.3 Å²	76.3	11%	0.105	39%	0.39	C	S	.	.	H	α-helix	trans	-58.4	-46.8	167.6	173.8	62	0	0	0	111.6	K362 C363 F370 W372 S373 K378 H379 K380	K362-L376 VanDerWaalsContact O-CD2 3.26Å; K362-L376 WeakPolarHBondContact O-CD2 3.39Å; C363-L376 HydrophobicContact CB-CD1 3.58Å; F370-L376 HydrophobicContact CB-CB 4.34Å; F370-L376 HydrophobicContact CD2-CB 4.01Å; F370-L376 HydrophobicContact CD2-CD1 3.86Å; F370-L376 HydrophobicContact CE2-CD1 4.06Å; F370-L376 HydrophobicContact CG-CB 4.33Å; W372-L376 PolarHBondContact O-N 3.01Å; S373-L376 PolarHBondContact O-N 2.85Å; L376-K378 VanDerWaalsContact C-N 3.34Å; L376-K378 PolarHBondContact O-N 2.79Å; L376-H379 WeakPolarHBondContact O-CA 3.12Å; L376-H379 WeakPolarHBondContact O-CB 3.46Å; L376-H379 PolarHBondContact O-N 3.32Å; L376-H379 VanDerWaalsContact O-N 3.08Å; L376-K380 HydrophobicContact CD1-CG 4.31Å; L376-K380 PolarHBondContact O-N 3.47Å
377	T	84.1	Confident	82.5	Confident	92 Å²	92	79.4 Å²	79.4	56%	0.564	40%	0.398	S	S	*	.	H	α-helix	trans	-61.7	-40.6	178.2	-57	0	0	0	0	112.1	S373 H379	S373-T377 PolarHBondContact O-N 3.05Å; S373-T377 PolarHBondContact O-OG1 3.23Å; T377-H379 VanDerWaalsContact C-N 3.32Å
378	K	84.5	Confident	82.6	Confident	132 Å²	132	80.4 Å²	80.4	57%	0.574	39%	0.394	S	S	*	.	H	α-helix	trans	-65.7	-34.8	172.9	-74	175.2	-179.8	-178.1	0	112.5	S374 T375 L376	S374-K378 WeakPolarHBondContact O-CG 3.47Å; S374-K378 PolarHBondContact O-N 3.14Å; S374-K378 VanDerWaalsContact O-N 3.14Å; T375-K378 PolarHBondContact O-N 2.86Å; L376-K378 VanDerWaalsContact C-N 3.34Å; L376-K378 PolarHBondContact O-N 2.79Å
379	H	86.3	Confident	82.8	Confident	19 Å²	19	77.9 Å²	77.9	9%	0.088	38%	0.382	C	S	.	.	H	α-helix	trans	-69.8	-39.3	177.6	171.1	61.5	0	0	0	112.7	C366 F370 T375 L376 T377 R381 I382 H383	C366-H379 PolarHBondContact SG-NE2 3.19Å; F370-H379 HydrophobicContact CE1-CB 4.06Å; F370-H379 HydrophobicContact CE2-CB 3.98Å; F370-H379 AromaticContact CE2-CD2 3.3Å; F370-H379 WeakPolarHBondContact CE2-CD2 3.36Å; F370-H379 AromaticContact CE2-CG 3.66Å; F370-H379 AromaticContact CE2-NE2 3.99Å; F370-H379 HydrophobicContact CZ-CB 3.57Å; F370-H379 AromaticContact CZ-CD2 3.37Å; F370-H379 WeakPolarHBondContact CZ-CD2 3.48Å; F370-H379 AromaticContact CZ-CG 3.26Å; F370-H379 AromaticContact CZ-ND1 3.8Å; F370-H379 AromaticContact CZ-NE2 3.94Å; T375-H379 VanDerWaalsContact O-CB 3.32Å; T375-H379 WeakPolarHBondContact O-CB 3.27Å; T375-H379 PolarHBondContact O-N 3.22Å; L376-H379 WeakPolarHBondContact O-CA 3.12Å; L376-H379 WeakPolarHBondContact O-CB 3.46Å; L376-H379 PolarHBondContact O-N 3.32Å; L376-H379 VanDerWaalsContact O-N 3.08Å; T377-H379 VanDerWaalsContact C-N 3.32Å; H379-R381 PolarHBondContact O-N 3.33Å; H379-R381 VanDerWaalsContact O-N 3.13Å; H379-I382 VanDerWaalsContact O-CB 3.26Å; H379-I382 WeakPolarHBondContact O-CB 3.5Å; H379-I382 WeakPolarHBondContact O-CG1 3.41Å; H379-I382 PolarHBondContact O-N 3.29Å; H379-H383 AromaticContact CD2-NE2 3.46Å; H379-H383 PolarHBondContact CD2-NE2 3.2Å; H379-H383 AromaticContact CE1-NE2 3.46Å; H379-H383 PolarHBondContact CE1-NE2 2.92Å; H379-H383 AromaticContact NE2-NE2 2.67Å; H379-H383 PolarHBondContact NE2-NE2 2.91Å
380	K	83.9	Confident	83	Confident	87 Å²	87	82.7 Å²	82.7	38%	0.378	40%	0.396	S	S	.	.	H	α-helix	trans	-55.9	-29.9	177.8	-75.2	-169.1	172.7	-161	0	113.6	L376 I382 H383 T384	L376-K380 HydrophobicContact CD1-CG 4.31Å; L376-K380 PolarHBondContact O-N 3.47Å; K380-I382 PolarHBondContact O-N 3.09Å; K380-I382 VanDerWaalsContact O-N 3.13Å; K380-H383 PolarHBondContact O-N 3.35Å; K380-T384 PolarHBondContact O-N 3.34Å
381	R	82.9	Confident	83.4	Confident	87 Å²	87	80.6 Å²	80.6	33%	0.328	39%	0.387	S	S	.	.	H	α-helix	trans	-60.5	-19	173.2	-61.9	-174.1	176.9	-168.4	-3.8	114.6	H379 T384 I399	H379-R381 PolarHBondContact O-N 3.33Å; H379-R381 VanDerWaalsContact O-N 3.13Å; R381-T384 WeakPolarHBondContact CA-OG1 3.28Å; R381-T384 PolarHBondContact O-OG1 2.9Å; R381-I399 HydrophobicContact CB-CG2 3.74Å
382	I	82.4	Confident	83.9	Confident	76 Å²	76	86.3 Å²	86.3	39%	0.39	41%	0.413	S	S	.	.	H	α-helix	trans	-72.3	-36.1	174.7	-58.2	178.9	0	0	0	110.1	H379 K380 W400	H379-I382 VanDerWaalsContact O-CB 3.26Å; H379-I382 WeakPolarHBondContact O-CB 3.5Å; H379-I382 WeakPolarHBondContact O-CG1 3.41Å; H379-I382 PolarHBondContact O-N 3.29Å; K380-I382 PolarHBondContact O-N 3.09Å; K380-I382 VanDerWaalsContact O-N 3.13Å; I382-W400 HydrophobicContact CD1-CZ2 4.31Å
383	H	81.8	Confident	84.2	Confident	65 Å²	65	85.2 Å²	85.2	30%	0.301	41%	0.413	S	S	.	.	H	α-helix	trans	-79.8	-41.8	-179.1	-57.5	-52.8	0	0	0	112.6	C363 E365 C366 H379 K380 R385	C363-H383 VanDerWaalsContact SG-CD2 3.58Å; C363-H383 PolarHBondContact SG-NE2 3.14Å; E365-H383 IonicContact OE1-CD2 3.87Å; E365-H383 WeakPolarHBondContact OE2-CB 3.32Å; E365-H383 IonicContact OE2-CD2 3.81Å; E365-H383 IonicContact OE2-CG 3.16Å; C366-H383 WeakPolarHBondContact CB-CE1 3.26Å; C366-H383 PolarHBondContact SG-CE1 2.8Å; C366-H383 PolarHBondContact SG-NE2 3.12Å; H379-H383 AromaticContact CD2-NE2 3.46Å; H379-H383 PolarHBondContact CD2-NE2 3.2Å; H379-H383 AromaticContact CE1-NE2 3.46Å; H379-H383 PolarHBondContact CE1-NE2 2.92Å; H379-H383 AromaticContact NE2-NE2 2.67Å; H379-H383 PolarHBondContact NE2-NE2 2.91Å; K380-H383 PolarHBondContact O-N 3.35Å; H383-R385 PolarHBondContact O-N 3.2Å
384	T	77.9	Confident	84.6	Confident	73 Å²	73	84.5 Å²	84.5	45%	0.448	41%	0.407	S	S	.	.	S	Bend	trans	-63.8	-13.5	174.8	63.1	0	0	0	0	112.9	K380 R381 E386	K380-T384 PolarHBondContact O-N 3.34Å; R381-T384 WeakPolarHBondContact CA-OG1 3.28Å; R381-T384 PolarHBondContact O-OG1 2.9Å; T384-E386 PolarHBondContact O-N 3.47Å; T384-E386 WeakPolarHBondContact OG1-CG 3.34Å; T384-E386 PolarHBondContact OG1-OE2 2.91Å
385	R	74.7	Confident	84.8	Confident	207 Å²	207	84.1 Å²	84.1	78%	0.781	41%	0.413	S	S	*	.			trans	53.6	13.2	-173.1	-63.6	-177.9	174.5	-173.1	-1.2	113.9	H383 K387	H383-R385 PolarHBondContact O-N 3.2Å; R385-K387 PolarHBondContact O-N 3.35Å
386	E	77.2	Confident	85.1	Confident	109 Å²	109	86.2 Å²	86.2	51%	0.509	42%	0.419	S	S	.	.			trans	-60.4	127	176.8	-73.2	169	157.1	0	0	109.4	T384 P388	T384-E386 PolarHBondContact O-N 3.47Å; T384-E386 WeakPolarHBondContact OG1-CG 3.34Å; T384-E386 PolarHBondContact OG1-OE2 2.91Å; E386-P388 WeakPolarHBondContact O-CD 3.3Å
387	K	83.9	Confident	85.2	Confident	114 Å²	114	86.7 Å²	86.7	50%	0.496	43%	0.426	S	S	.	.			trans	-121.5	75.4	178.2	-73.3	164.5	167.4	-169.7	0	109.1	R385 Y389 A397 F398 I399	R385-K387 PolarHBondContact O-N 3.35Å; K387-Y389 PolarHBondContact O-N 2.84Å; K387-A397 HydrophobicContact CB-CB 3.59Å; K387-A397 HydrophobicContact CD-CB 4.12Å; K387-A397 WeakPolarHBondContact CD-O 3.37Å; K387-A397 HydrophobicContact CG-CB 4.42Å; K387-F398 CarbonylContact C-O 3.6Å; K387-F398 VanDerWaalsContact C-O 3.24Å; K387-F398 VanDerWaalsContact CA-O 3.23Å; K387-F398 WeakPolarHBondContact CA-O 3.28Å; K387-I399 HydrophobicContact CG-CG1 3.89Å
388	P	85.1	Confident	85.4	Confident	76 Å²	76	84.5 Å²	84.5	49%	0.494	41%	0.408	S	S	.	.			trans	-67.5	-17.1	-172.5	-19.2	33.3	0	0	0	113.7	E386	E386-P388 WeakPolarHBondContact O-CD 3.3Å
389	Y	88.6	Confident	85.4	Confident	75 Å²	75	80 Å²	80	29%	0.294	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	92.1	-172.3	-54.3	-76.4	0	0	0	109.5	K387 F398 I399	K387-Y389 PolarHBondContact O-N 2.84Å; Y389-F398 PolarHBondContact N-O 3.41Å; Y389-F398 PolarHBondContact O-N 2.93Å; Y389-I399 WeakPolarHBondContact CD2-O 2.92Å; Y389-I399 VanDerWaalsContact CE2-O 3.32Å; Y389-I399 WeakPolarHBondContact CE2-O 3.26Å
390	K	89.6	Confident	85.4	Confident	134 Å²	134	84.4 Å²	84.4	58%	0.583	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	151.4	175.8	-65.9	-175.6	178.6	-179.7	0	111.4	A397 L404	K390-A397 HydrophobicContact CG-CB 3.97Å; K390-L404 WeakPolarHBondContact O-CD1 3.36Å; K390-L404 WeakPolarHBondContact O-CD2 3.35Å
391	C	92.6	Very high	85.6	Confident	1 Å²	1	83.2 Å²	83.2	1%	0.007	41%	0.409	C	S	.	.			trans	-100.5	113.2	169.1	-170.1	0	0	0	0	108.5	E393 C394 G395 K396 F398 L404	C391-E393 PolarHBondContact O-N 3.33Å; C391-C394 PolarHBondContact O-N 2.94Å; C391-G395 VanDerWaalsContact O-CA 3.27Å; C391-G395 WeakPolarHBondContact O-CA 2.95Å; C391-G395 PolarHBondContact O-N 3.02Å; C391-K396 WeakPolarHBondContact CB-O 3.29Å; C391-K396 PolarHBondContact N-O 3.37Å; C391-F398 HydrophobicContact CB-CE2 4.35Å; C391-L404 HydrophobicContact CB-CD1 3.57Å
392	E	90.9	Very high	85.8	Confident	158 Å²	158	82.8 Å²	82.8	74%	0.738	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.1	-179.1	-51	-45	124.9	0	0	112.7	C394	E392-C394 PolarHBondContact O-N 3.39Å
393	E	88.2	Confident	86	Confident	95 Å²	95	80.4 Å²	80.4	44%	0.444	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.9	-175.5	-64.7	150.4	-110.1	0	0	114	C391 K408 H411	C391-E393 PolarHBondContact O-N 3.33Å; E393-K408 IonicContact OE1-NZ 3.03Å; E393-K408 PolarHBondContact OE1-NZ 3.48Å; E393-H411 WeakPolarHBondContact OE2-CB 3.32Å; E393-H411 IonicContact OE2-CD2 2.69Å; E393-H411 PolarHBondContact OE2-CD2 3.1Å; E393-H411 IonicContact OE2-CG 3.98Å
394	C	89.4	Confident	86.5	Confident	46 Å²	46	78.4 Å²	78.4	31%	0.311	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.5	11.9	-179.2	71.3	0	0	0	0	115.4	C391 E392 K396 H407 H411	C391-C394 PolarHBondContact O-N 2.94Å; E392-C394 PolarHBondContact O-N 3.39Å; C394-K396 PolarHBondContact O-N 2.87Å; C394-H407 PolarHBondContact SG-NE2 3.4Å; C394-H411 WeakPolarHBondContact CB-NE2 3.31Å; C394-H411 PolarHBondContact SG-NE2 2.97Å
395	G	87	Confident	87	Confident	56 Å²	56	78.9 Å²	78.9	58%	0.577	40%	0.403	S	S	*	.			trans	66.9	-9.2	-178.5	0	0	0	0	0	116.3	C391 A397	C391-G395 VanDerWaalsContact O-CA 3.27Å; C391-G395 WeakPolarHBondContact O-CA 2.95Å; C391-G395 PolarHBondContact O-N 3.02Å; G395-A397 PolarHBondContact O-N 2.92Å
396	K	88.7	Confident	87.7	Confident	89 Å²	89	74.5 Å²	74.5	39%	0.387	39%	0.386	S	S	.	.			trans	-65.5	127.6	-174.1	-70.8	-178.9	179.5	177.2	0	111.4	C391 C394 F398	C391-K396 WeakPolarHBondContact CB-O 3.29Å; C391-K396 PolarHBondContact N-O 3.37Å; C394-K396 PolarHBondContact O-N 2.87Å; K396-F398 HydrophobicContact CB-CE2 3.97Å; K396-F398 HydrophobicContact CB-CZ 4.09Å; K396-F398 WeakPolarHBondContact O-CD2 3.32Å; K396-F398 VanDerWaalsContact O-CE2 3.24Å; K396-F398 WeakPolarHBondContact O-CE2 3.34Å
397	A	90	Very high	88.3	Confident	30 Å²	30	70.1 Å²	70.1	25%	0.248	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.4	-175.3	0	0	0	0	0	112.7	K387 K390 G395	K387-A397 HydrophobicContact CB-CB 3.59Å; K387-A397 HydrophobicContact CD-CB 4.12Å; K387-A397 WeakPolarHBondContact CD-O 3.37Å; K387-A397 HydrophobicContact CG-CB 4.42Å; K390-A397 HydrophobicContact CG-CB 3.97Å; G395-A397 PolarHBondContact O-N 2.92Å
398	F	87.7	Confident	88.6	Confident	45 Å²	45	68.2 Å²	68.2	20%	0.197	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	150.4	-173.1	-59	-88.8	0	0	0	112.4	K387 Y389 C391 K396 L404 H407	K387-F398 CarbonylContact C-O 3.6Å; K387-F398 VanDerWaalsContact C-O 3.24Å; K387-F398 VanDerWaalsContact CA-O 3.23Å; K387-F398 WeakPolarHBondContact CA-O 3.28Å; Y389-F398 PolarHBondContact N-O 3.41Å; Y389-F398 PolarHBondContact O-N 2.93Å; C391-F398 HydrophobicContact CB-CE2 4.35Å; K396-F398 HydrophobicContact CB-CE2 3.97Å; K396-F398 HydrophobicContact CB-CZ 4.09Å; K396-F398 WeakPolarHBondContact O-CD2 3.32Å; K396-F398 VanDerWaalsContact O-CE2 3.24Å; K396-F398 WeakPolarHBondContact O-CE2 3.34Å; F398-L404 HydrophobicContact CB-CB 4.42Å; F398-L404 HydrophobicContact CD2-CB 4.01Å; F398-L404 HydrophobicContact CD2-CD1 3.89Å; F398-L404 HydrophobicContact CE2-CD1 4.06Å; F398-L404 HydrophobicContact CG-CB 4.38Å; F398-H407 HydrophobicContact CE1-CB 4.13Å; F398-H407 HydrophobicContact CE2-CB 4.01Å; F398-H407 AromaticContact CE2-CD2 3.29Å; F398-H407 WeakPolarHBondContact CE2-CD2 3.5Å; F398-H407 AromaticContact CE2-CG 3.76Å; F398-H407 HydrophobicContact CZ-CB 3.6Å; F398-H407 AromaticContact CZ-CD2 3.3Å; F398-H407 WeakPolarHBondContact CZ-CD2 3.32Å; F398-H407 AromaticContact CZ-CG 3.33Å; F398-H407 AromaticContact CZ-NE2 3.92Å
399	I	85.2	Confident	88.8	Confident	38 Å²	38	67.4 Å²	67.4	20%	0.195	34%	0.344	C	S	.	.	S	Bend	trans	-77	-25.9	179.5	-52.7	-179.9	0	0	0	111.4	R381 K387 Y389	R381-I399 HydrophobicContact CB-CG2 3.74Å; K387-I399 HydrophobicContact CG-CG1 3.89Å; Y389-I399 WeakPolarHBondContact CD2-O 2.92Å; Y389-I399 VanDerWaalsContact CE2-O 3.32Å; Y389-I399 WeakPolarHBondContact CE2-O 3.26Å
400	W	86.4	Confident	88.8	Confident	111 Å²	111	69.4 Å²	69.4	42%	0.42	36%	0.358	S	S	.	.	S	Bend	trans	-129.4	142.9	-177.8	-52.6	-43.5	0	0	0	112.5	I382 S402 T403 L404	I382-W400 HydrophobicContact CD1-CZ2 4.31Å; W400-S402 VanDerWaalsContact C-N 3.34Å; W400-S402 PolarHBondContact O-N 3.09Å; W400-T403 HydrophobicContact CE3-CG2 3.99Å; W400-T403 PolarHBondContact O-N 2.82Å; W400-T403 PolarHBondContact O-OG1 2.87Å; W400-L404 PolarHBondContact O-N 3.03Å
401	S	87.7	Confident	88.7	Confident	62 Å²	62	67.7 Å²	67.7	43%	0.434	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-41.2	176.9	52.1	0	0	0	0	112.3	T403 L404 T405	S401-T403 VanDerWaalsContact C-N 3.25Å; S401-T403 PolarHBondContact O-N 3.37Å; S401-L404 WeakPolarHBondContact O-CA 3.25Å; S401-L404 WeakPolarHBondContact O-CB 3.18Å; S401-L404 PolarHBondContact O-N 3.05Å; S401-T405 PolarHBondContact O-N 3.46Å; S401-T405 PolarHBondContact O-OG1 3.39Å; S401-T405 VanDerWaalsContact O-OG1 3.13Å
402	S	86.8	Confident	88.5	Confident	78 Å²	78	71.4 Å²	71.4	55%	0.545	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-33.3	177.5	56.1	0	0	0	0	113.2	W400 R406	W400-S402 VanDerWaalsContact C-N 3.34Å; W400-S402 PolarHBondContact O-N 3.09Å; S402-R406 WeakPolarHBondContact O-CB 3.25Å; S402-R406 PolarHBondContact O-N 3.35Å; S402-R406 VanDerWaalsContact O-N 3.11Å
403	T	87.8	Confident	88.3	Confident	26 Å²	26	66 Å²	66	16%	0.16	36%	0.361	C	S	.	.	H	α-helix	trans	-72.7	-34.6	173.6	43.5	0	0	0	0	112.7	W400 S401 H407	W400-T403 HydrophobicContact CE3-CG2 3.99Å; W400-T403 PolarHBondContact O-N 2.82Å; W400-T403 PolarHBondContact O-OG1 2.87Å; S401-T403 VanDerWaalsContact C-N 3.25Å; S401-T403 PolarHBondContact O-N 3.37Å; T403-H407 WeakPolarHBondContact O-CB 3.45Å; T403-H407 PolarHBondContact O-N 3.06Å
404	L	91.2	Very high	88.3	Confident	23 Å²	23	66.4 Å²	66.4	12%	0.12	36%	0.363	C	S	.	.	H	α-helix	trans	-66.5	-48.8	171.9	172.2	63.4	0	0	0	111.5	K390 C391 F398 W400 S401 R406 H407 K408	K390-L404 WeakPolarHBondContact O-CD1 3.36Å; K390-L404 WeakPolarHBondContact O-CD2 3.35Å; C391-L404 HydrophobicContact CB-CD1 3.57Å; F398-L404 HydrophobicContact CB-CB 4.42Å; F398-L404 HydrophobicContact CD2-CB 4.01Å; F398-L404 HydrophobicContact CD2-CD1 3.89Å; F398-L404 HydrophobicContact CE2-CD1 4.06Å; F398-L404 HydrophobicContact CG-CB 4.38Å; W400-L404 PolarHBondContact O-N 3.03Å; S401-L404 WeakPolarHBondContact O-CA 3.25Å; S401-L404 WeakPolarHBondContact O-CB 3.18Å; S401-L404 PolarHBondContact O-N 3.05Å; L404-R406 VanDerWaalsContact C-N 3.27Å; L404-R406 PolarHBondContact O-N 2.89Å; L404-H407 CarbonylContact O-C 3.57Å; L404-H407 WeakPolarHBondContact O-CA 3.15Å; L404-H407 WeakPolarHBondContact O-CB 3.24Å; L404-H407 PolarHBondContact O-N 3.21Å; L404-K408 HydrophobicContact CD1-CG 4.35Å; L404-K408 PolarHBondContact O-N 3.14Å
405	T	88.4	Confident	88.4	Confident	84 Å²	84	70.2 Å²	70.2	52%	0.515	37%	0.374	S	S	.	.	H	α-helix	trans	-56.3	-43	177.2	-52.4	0	0	0	0	111.5	S401 H407 K408	S401-T405 PolarHBondContact O-N 3.46Å; S401-T405 PolarHBondContact O-OG1 3.39Å; S401-T405 VanDerWaalsContact O-OG1 3.13Å; T405-H407 VanDerWaalsContact C-N 3.33Å; T405-K408 PolarHBondContact O-N 3.48Å
406	R	89.1	Confident	88.6	Confident	114 Å²	114	71 Å²	71	43%	0.43	37%	0.369	S	S	.	.	H	α-helix	trans	-67.5	-32.9	175.6	-174.7	176.7	68.4	171.7	-7.3	112.9	S402 L404 Q428	S402-R406 WeakPolarHBondContact O-CB 3.25Å; S402-R406 PolarHBondContact O-N 3.35Å; S402-R406 VanDerWaalsContact O-N 3.11Å; L404-R406 VanDerWaalsContact C-N 3.27Å; L404-R406 PolarHBondContact O-N 2.89Å; R406-Q428 HydrophobicContact CG-CG 4.26Å
407	H	90.6	Very high	88.7	Confident	18 Å²	18	70.5 Å²	70.5	8%	0.083	37%	0.366	C	S	.	.	H	α-helix	trans	-71.2	-40.1	176.3	171.2	55.6	0	0	0	112.3	C394 F398 T403 L404 T405 R409 M410	C394-H407 PolarHBondContact SG-NE2 3.4Å; F398-H407 HydrophobicContact CE1-CB 4.13Å; F398-H407 HydrophobicContact CE2-CB 4.01Å; F398-H407 AromaticContact CE2-CD2 3.29Å; F398-H407 WeakPolarHBondContact CE2-CD2 3.5Å; F398-H407 AromaticContact CE2-CG 3.76Å; F398-H407 HydrophobicContact CZ-CB 3.6Å; F398-H407 AromaticContact CZ-CD2 3.3Å; F398-H407 WeakPolarHBondContact CZ-CD2 3.32Å; F398-H407 AromaticContact CZ-CG 3.33Å; F398-H407 AromaticContact CZ-NE2 3.92Å; T403-H407 WeakPolarHBondContact O-CB 3.45Å; T403-H407 PolarHBondContact O-N 3.06Å; L404-H407 CarbonylContact O-C 3.57Å; L404-H407 WeakPolarHBondContact O-CA 3.15Å; L404-H407 WeakPolarHBondContact O-CB 3.24Å; L404-H407 PolarHBondContact O-N 3.21Å; T405-H407 VanDerWaalsContact C-N 3.33Å; H407-R409 PolarHBondContact O-N 3.05Å; H407-R409 VanDerWaalsContact O-N 3.14Å; H407-M410 WeakPolarHBondContact O-CB 3.43Å; H407-M410 WeakPolarHBondContact O-CG 3.38Å; H407-M410 PolarHBondContact O-N 3.23Å
408	K	88.9	Confident	88.8	Confident	74 Å²	74	74.3 Å²	74.3	32%	0.322	38%	0.376	S	S	.	.	H	α-helix	trans	-54.6	-32.9	176.2	-76.6	-174.9	164.7	-93.6	0	113.3	E393 L404 T405 M410 H411 T412	E393-K408 IonicContact OE1-NZ 3.03Å; E393-K408 PolarHBondContact OE1-NZ 3.48Å; L404-K408 HydrophobicContact CD1-CG 4.35Å; L404-K408 PolarHBondContact O-N 3.14Å; T405-K408 PolarHBondContact O-N 3.48Å; K408-M410 PolarHBondContact O-N 3.49Å; K408-H411 PolarHBondContact O-N 3.37Å; K408-T412 PolarHBondContact O-N 2.78Å; K408-T412 VanDerWaalsContact O-N 3.1Å
409	R	90.8	Very high	89.1	Confident	58 Å²	58	72.1 Å²	72.1	22%	0.219	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-18.3	172.5	-62.7	-174.7	177.1	165.7	0.7	114.7	H407 G413 E414 S427	H407-R409 PolarHBondContact O-N 3.05Å; H407-R409 VanDerWaalsContact O-N 3.14Å; R409-G413 PolarHBondContact O-N 3.06Å; R409-E414 HydrophobicContact CB-CB 4.2Å; R409-E414 HydrophobicContact CG-CB 4.04Å; R409-E414 IonicContact NE-OE2 3.76Å; R409-E414 PolarHBondContact O-N 2.8Å; R409-S427 PolarHBondContact NH1-O 3.48Å
410	M	87.3	Confident	89.4	Confident	118 Å²	118	77 Å²	77	58%	0.581	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-29.2	173.6	-61.1	179.3	61.8	0	0	112.2	L21 H407 K408	L21-M410 HydrophobicContact CD1-CE 4.4Å; H407-M410 WeakPolarHBondContact O-CB 3.43Å; H407-M410 WeakPolarHBondContact O-CG 3.38Å; H407-M410 PolarHBondContact O-N 3.23Å; K408-M410 PolarHBondContact O-N 3.49Å
411	H	88.4	Confident	89.5	Confident	97 Å²	97	76.9 Å²	76.9	45%	0.449	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-46.8	178.5	-56.8	-52.7	0	0	0	111	E393 C394 K408 G413	E393-H411 WeakPolarHBondContact OE2-CB 3.32Å; E393-H411 IonicContact OE2-CD2 2.69Å; E393-H411 PolarHBondContact OE2-CD2 3.1Å; E393-H411 IonicContact OE2-CG 3.98Å; C394-H411 WeakPolarHBondContact CB-NE2 3.31Å; C394-H411 PolarHBondContact SG-NE2 2.97Å; K408-H411 PolarHBondContact O-N 3.37Å; H411-G413 PolarHBondContact O-N 3.23Å
412	T	87.4	Confident	89.7	Confident	80 Å²	80	76 Å²	76	49%	0.491	39%	0.387	S	S	.	.	S	Bend	trans	-72.4	-9.9	178	64.6	0	0	0	0	113.7	K408 E414	K408-T412 PolarHBondContact O-N 2.78Å; K408-T412 VanDerWaalsContact O-N 3.1Å; T412-E414 PolarHBondContact O-N 2.69Å; T412-E414 VanDerWaalsContact O-N 3.14Å; T412-E414 WeakPolarHBondContact OG1-CG 3.32Å; T412-E414 PolarHBondContact OG1-N 2.82Å
413	G	86.9	Confident	89.8	Confident	44 Å²	44	74 Å²	74	45%	0.454	38%	0.378	S	S	.	.			trans	69.2	2.9	-175.6	0	0	0	0	0	114.7	R409 H411 K415	R409-G413 PolarHBondContact O-N 3.06Å; H411-G413 PolarHBondContact O-N 3.23Å; G413-K415 WeakPolarHBondContact O-CG 3.38Å; G413-K415 PolarHBondContact O-N 3.26Å
414	E	89.1	Confident	89.9	Confident	103 Å²	103	78.8 Å²	78.8	48%	0.481	40%	0.397	S	S	.	.			trans	-55.3	122.2	-177.5	-86.2	177.5	-148.3	0	0	112.9	R409 T412 S427	R409-E414 HydrophobicContact CB-CB 4.2Å; R409-E414 HydrophobicContact CG-CB 4.04Å; R409-E414 IonicContact NE-OE2 3.76Å; R409-E414 PolarHBondContact O-N 2.8Å; T412-E414 PolarHBondContact O-N 2.69Å; T412-E414 VanDerWaalsContact O-N 3.14Å; T412-E414 WeakPolarHBondContact OG1-CG 3.32Å; T412-E414 PolarHBondContact OG1-N 2.82Å; E414-S427 WeakPolarHBondContact O-CB 3.39Å
415	K	91.2	Very high	89.9	Confident	126 Å²	126	80.1 Å²	80.1	55%	0.548	41%	0.408	S	S	.	.			trans	-127.8	76.3	177.3	-69.6	168.6	-164.4	176	0	110.6	G413 Y417 S425 F426	G413-K415 WeakPolarHBondContact O-CG 3.38Å; G413-K415 PolarHBondContact O-N 3.26Å; K415-Y417 PolarHBondContact O-N 3.3Å; K415-Y417 VanDerWaalsContact O-N 3.11Å; K415-S425 WeakPolarHBondContact CD-O 3.34Å; K415-S425 WeakPolarHBondContact O-CB 3.46Å; K415-F426 CarbonylContact C-O 3.59Å; K415-F426 VanDerWaalsContact CA-O 3.23Å; K415-F426 WeakPolarHBondContact CA-O 3.07Å
416	P	90.5	Very high	90	Very high	73 Å²	73	78.3 Å²	78.3	47%	0.474	39%	0.393	S	S	.	.			trans	-68	-11.3	-171.8	-21.5	34.7	0	0	0	115.3
417	Y	92.4	Very high	90	Very high	79 Å²	79	74.5 Å²	74.5	31%	0.31	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	91.4	-172.9	-53.7	-75.8	0	0	0	110.1	K415 S425 F426 S429	K415-Y417 PolarHBondContact O-N 3.3Å; K415-Y417 VanDerWaalsContact O-N 3.11Å; Y417-S425 CarbonylContact O-C 3.55Å; Y417-S425 WeakPolarHBondContact O-CA 3.26Å; Y417-F426 WeakPolarHBondContact CD2-O 3.36Å; Y417-F426 PolarHBondContact N-O 3.3Å; Y417-F426 PolarHBondContact O-N 3.2Å; Y417-S429 VanDerWaalsContact CD2-N 3.3Å; Y417-S429 VanDerWaalsContact CE2-N 3.33Å
418	K	92.2	Very high	89.9	Confident	109 Å²	109	76.3 Å²	76.3	47%	0.474	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	144.8	177.3	-166.1	-177.2	175	-157.5	0	111.5	E420 L432	K418-E420 IonicContact NZ-OE2 3.14Å; K418-L432 VanDerWaalsContact O-CD2 3.23Å; K418-L432 WeakPolarHBondContact O-CD2 3.39Å
419	C	93	Very high	90	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	40%	0.398	C	S	.	.			trans	-93.9	118.2	164.8	-179.3	0	0	0	0	108.7	E421 G423 K424 F426 L432 H439	C419-E421 VanDerWaalsContact C-N 3.3Å; C419-E421 PolarHBondContact O-N 3.37Å; C419-G423 CarbonylContact O-C 3.5Å; C419-G423 WeakPolarHBondContact O-CA 3.47Å; C419-G423 PolarHBondContact O-N 3.22Å; C419-K424 VanDerWaalsContact CB-O 3.28Å; C419-K424 WeakPolarHBondContact CB-O 3.43Å; C419-K424 PolarHBondContact N-O 2.68Å; C419-F426 HydrophobicContact CB-CE2 4.35Å; C419-L432 HydrophobicContact CB-CD1 3.59Å; C419-H439 PolarHBondContact SG-NE2 3.04Å
420	E	91.7	Very high	89.8	Confident	139 Å²	139	76 Å²	76	65%	0.65	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-30	-179.7	-55.7	-43.9	131.7	0	0	112.8	K418 C422	K418-E420 IonicContact NZ-OE2 3.14Å; E420-C422 PolarHBondContact O-N 3.45Å
421	E	89.3	Confident	89.8	Confident	109 Å²	109	72.8 Å²	72.8	51%	0.509	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-23.2	-175.6	-64.2	160.5	-110.7	0	0	114	C419 H439	C419-E421 VanDerWaalsContact C-N 3.3Å; C419-E421 PolarHBondContact O-N 3.37Å; E421-H439 WeakPolarHBondContact OE2-CB 3.35Å; E421-H439 IonicContact OE2-CD2 3.68Å; E421-H439 PolarHBondContact OE2-CD2 3.25Å; E421-H439 IonicContact OE2-CG 3.35Å
422	C	90.4	Very high	89.8	Confident	45 Å²	45	69.3 Å²	69.3	30%	0.304	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.5	11.5	-179.4	72.7	0	0	0	0	114.8	E420 K424 H435 H439	E420-C422 PolarHBondContact O-N 3.45Å; C422-K424 PolarHBondContact O-N 3.03Å; C422-H435 PolarHBondContact SG-NE2 2.9Å; C422-H439 WeakPolarHBondContact CB-CE1 3.41Å; C422-H439 WeakPolarHBondContact CB-NE2 3.49Å; C422-H439 PolarHBondContact SG-CE1 3.24Å; C422-H439 PolarHBondContact SG-NE2 3.08Å
423	G	88.8	Confident	89.8	Confident	36 Å²	36	70 Å²	70	37%	0.371	39%	0.385	S	S	.	.			trans	67.3	-8.8	-178.9	0	0	0	0	0	116.2	C419 S425	C419-G423 CarbonylContact O-C 3.5Å; C419-G423 WeakPolarHBondContact O-CA 3.47Å; C419-G423 PolarHBondContact O-N 3.22Å; G423-S425 PolarHBondContact O-N 3.09Å
424	K	90.4	Very high	89.7	Confident	126 Å²	126	71 Å²	71	55%	0.548	38%	0.381	S	S	.	.			trans	-67	126.4	-174.3	-70.7	178.2	-178	170.9	0	111.6	C419 C422 F426	C419-K424 VanDerWaalsContact CB-O 3.28Å; C419-K424 WeakPolarHBondContact CB-O 3.43Å; C419-K424 PolarHBondContact N-O 2.68Å; C422-K424 PolarHBondContact O-N 3.03Å; K424-F426 HydrophobicContact CB-CE2 3.98Å; K424-F426 HydrophobicContact CB-CZ 4.11Å; K424-F426 VanDerWaalsContact O-CE2 3.26Å; K424-F426 WeakPolarHBondContact O-CE2 3.48Å
425	S	91.8	Very high	89.6	Confident	50 Å²	50	67 Å²	67	35%	0.35	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	147.6	179.1	-56.6	0	0	0	0	112.8	K415 Y417 G423	K415-S425 WeakPolarHBondContact CD-O 3.34Å; K415-S425 WeakPolarHBondContact O-CB 3.46Å; Y417-S425 CarbonylContact O-C 3.55Å; Y417-S425 WeakPolarHBondContact O-CA 3.26Å; G423-S425 PolarHBondContact O-N 3.09Å
426	F	90.1	Very high	89.4	Confident	46 Å²	46	65.2 Å²	65.2	20%	0.202	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	151.7	-177.4	-58.9	-89.9	0	0	0	111.8	K415 Y417 C419 K424 L432 H435	K415-F426 CarbonylContact C-O 3.59Å; K415-F426 VanDerWaalsContact CA-O 3.23Å; K415-F426 WeakPolarHBondContact CA-O 3.07Å; Y417-F426 WeakPolarHBondContact CD2-O 3.36Å; Y417-F426 PolarHBondContact N-O 3.3Å; Y417-F426 PolarHBondContact O-N 3.2Å; C419-F426 HydrophobicContact CB-CE2 4.35Å; K424-F426 HydrophobicContact CB-CE2 3.98Å; K424-F426 HydrophobicContact CB-CZ 4.11Å; K424-F426 VanDerWaalsContact O-CE2 3.26Å; K424-F426 WeakPolarHBondContact O-CE2 3.48Å; F426-L432 HydrophobicContact CB-CB 4.49Å; F426-L432 HydrophobicContact CD2-CB 4.05Å; F426-L432 HydrophobicContact CD2-CD1 3.94Å; F426-L432 HydrophobicContact CE2-CD1 4.11Å; F426-L432 HydrophobicContact CG-CB 4.46Å; F426-H435 HydrophobicContact CE1-CB 4.18Å; F426-H435 HydrophobicContact CE2-CB 3.98Å; F426-H435 AromaticContact CE2-CD2 3.32Å; F426-H435 WeakPolarHBondContact CE2-CD2 3.21Å; F426-H435 AromaticContact CE2-CG 3.7Å; F426-H435 HydrophobicContact CZ-CB 3.64Å; F426-H435 AromaticContact CZ-CD2 3.35Å; F426-H435 WeakPolarHBondContact CZ-CD2 3.35Å; F426-H435 AromaticContact CZ-CG 3.31Å; F426-H435 AromaticContact CZ-ND1 3.86Å; F426-H435 AromaticContact CZ-NE2 3.9Å
427	S	88.8	Confident	89.2	Confident	34 Å²	34	63 Å²	63	24%	0.238	34%	0.339	C	S	.	.	S	Bend	trans	-83.7	-10.3	178.9	59.5	0	0	0	0	114.1	R409 E414	R409-S427 PolarHBondContact NH1-O 3.48Å; E414-S427 WeakPolarHBondContact O-CB 3.39Å
428	Q	89.4	Confident	88.9	Confident	56 Å²	56	63.4 Å²	63.4	26%	0.262	35%	0.346	S	S	.	.	S	Bend	trans	-134.1	142.8	177.8	-50.8	-177.9	51	0	0	111.3	R406 T431 L432	R406-Q428 HydrophobicContact CG-CG 4.26Å; Q428-T431 HydrophobicContact CB-CG2 4.49Å; Q428-T431 PolarHBondContact O-N 2.93Å; Q428-T431 PolarHBondContact O-OG1 3.28Å; Q428-L432 PolarHBondContact O-N 3.29Å
429	S	89.6	Confident	88.6	Confident	63 Å²	63	61.9 Å²	61.9	44%	0.441	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-40.5	177.1	50.9	0	0	0	0	112.1	Y417 T431 L432 T433	Y417-S429 VanDerWaalsContact CD2-N 3.3Å; Y417-S429 VanDerWaalsContact CE2-N 3.33Å; S429-T431 VanDerWaalsContact C-N 3.28Å; S429-T431 PolarHBondContact O-N 3.41Å; S429-L432 WeakPolarHBondContact O-CA 3.27Å; S429-L432 WeakPolarHBondContact O-CB 3.21Å; S429-L432 PolarHBondContact O-N 3.15Å; S429-T433 PolarHBondContact O-N 3.37Å; S429-T433 PolarHBondContact O-OG1 2.82Å
430	S	86.5	Confident	88.1	Confident	63 Å²	63	65.7 Å²	65.7	44%	0.441	36%	0.363	S	S	.	.	H	α-helix	trans	-57.7	-38.8	176.8	51.7	0	0	0	0	112.7	T433 T434	S430-T433 PolarHBondContact O-N 3.03Å; S430-T434 PolarHBondContact O-N 3.23Å; S430-T434 PolarHBondContact O-OG1 2.98Å
431	T	87.1	Confident	87.6	Confident	50 Å²	50	61.3 Å²	61.3	31%	0.307	36%	0.356	S	S	.	.	H	α-helix	trans	-69.7	-33.7	176.5	44.8	0	0	0	0	112.5	Q428 S429 T434 H435	Q428-T431 HydrophobicContact CB-CG2 4.49Å; Q428-T431 PolarHBondContact O-N 2.93Å; Q428-T431 PolarHBondContact O-OG1 3.28Å; S429-T431 VanDerWaalsContact C-N 3.28Å; S429-T431 PolarHBondContact O-N 3.41Å; T431-T434 WeakPolarHBondContact CA-OG1 3.49Å; T431-T434 PolarHBondContact O-OG1 3.34Å; T431-T434 VanDerWaalsContact O-OG1 3.06Å; T431-H435 VanDerWaalsContact O-CB 3.25Å; T431-H435 WeakPolarHBondContact O-CB 3.45Å; T431-H435 PolarHBondContact O-N 3.26Å
432	L	90.1	Very high	87.2	Confident	25 Å²	25	61.6 Å²	61.6	13%	0.131	36%	0.357	C	S	.	.	H	α-helix	trans	-65.8	-45.3	170.5	172.9	62.9	0	0	0	110.9	K418 C419 F426 Q428 S429 T434 H435 K436	K418-L432 VanDerWaalsContact O-CD2 3.23Å; K418-L432 WeakPolarHBondContact O-CD2 3.39Å; C419-L432 HydrophobicContact CB-CD1 3.59Å; F426-L432 HydrophobicContact CB-CB 4.49Å; F426-L432 HydrophobicContact CD2-CB 4.05Å; F426-L432 HydrophobicContact CD2-CD1 3.94Å; F426-L432 HydrophobicContact CE2-CD1 4.11Å; F426-L432 HydrophobicContact CG-CB 4.46Å; Q428-L432 PolarHBondContact O-N 3.29Å; S429-L432 WeakPolarHBondContact O-CA 3.27Å; S429-L432 WeakPolarHBondContact O-CB 3.21Å; S429-L432 PolarHBondContact O-N 3.15Å; L432-T434 PolarHBondContact O-N 3.05Å; L432-H435 WeakPolarHBondContact O-CB 3.23Å; L432-H435 PolarHBondContact O-N 3.21Å; L432-K436 HydrophobicContact CD1-CG 4.44Å; L432-K436 PolarHBondContact O-N 2.91Å
433	T	86.4	Confident	87	Confident	95 Å²	95	65.4 Å²	65.4	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-58	-46.6	176.5	-52.6	0	0	0	0	111.6	S429 S430 H435 K436	S429-T433 PolarHBondContact O-N 3.37Å; S429-T433 PolarHBondContact O-OG1 2.82Å; S430-T433 PolarHBondContact O-N 3.03Å; T433-H435 VanDerWaalsContact C-N 3.25Å; T433-H435 PolarHBondContact O-N 3Å; T433-K436 PolarHBondContact O-N 3.44Å
434	T	85	Confident	86.8	Confident	63 Å²	63	67.1 Å²	67.1	39%	0.387	37%	0.373	S	S	.	.	H	α-helix	trans	-70.9	-19.5	176.2	55.2	0	0	0	0	114	S430 T431 L432	S430-T434 PolarHBondContact O-N 3.23Å; S430-T434 PolarHBondContact O-OG1 2.98Å; T431-T434 WeakPolarHBondContact CA-OG1 3.49Å; T431-T434 PolarHBondContact O-OG1 3.34Å; T431-T434 VanDerWaalsContact O-OG1 3.06Å; L432-T434 PolarHBondContact O-N 3.05Å
435	H	87.8	Confident	86.6	Confident	19 Å²	19	65.4 Å²	65.4	9%	0.088	36%	0.364	C	S	.	.	H	α-helix	trans	-76.9	-39.4	174	175.1	55.4	0	0	0	111.7	C422 F426 T431 L432 T433 I437 I438 H439	C422-H435 PolarHBondContact SG-NE2 2.9Å; F426-H435 HydrophobicContact CE1-CB 4.18Å; F426-H435 HydrophobicContact CE2-CB 3.98Å; F426-H435 AromaticContact CE2-CD2 3.32Å; F426-H435 WeakPolarHBondContact CE2-CD2 3.21Å; F426-H435 AromaticContact CE2-CG 3.7Å; F426-H435 HydrophobicContact CZ-CB 3.64Å; F426-H435 AromaticContact CZ-CD2 3.35Å; F426-H435 WeakPolarHBondContact CZ-CD2 3.35Å; F426-H435 AromaticContact CZ-CG 3.31Å; F426-H435 AromaticContact CZ-ND1 3.86Å; F426-H435 AromaticContact CZ-NE2 3.9Å; T431-H435 VanDerWaalsContact O-CB 3.25Å; T431-H435 WeakPolarHBondContact O-CB 3.45Å; T431-H435 PolarHBondContact O-N 3.26Å; L432-H435 WeakPolarHBondContact O-CB 3.23Å; L432-H435 PolarHBondContact O-N 3.21Å; T433-H435 VanDerWaalsContact C-N 3.25Å; T433-H435 PolarHBondContact O-N 3Å; H435-I437 PolarHBondContact O-N 3.42Å; H435-I438 VanDerWaalsContact O-CB 3.25Å; H435-I438 WeakPolarHBondContact O-CB 3.29Å; H435-I438 WeakPolarHBondContact O-CG1 3.22Å; H435-I438 PolarHBondContact O-N 2.96Å; H435-H439 AromaticContact CD2-NE2 3.58Å; H435-H439 AromaticContact CE1-NE2 3.73Å; H435-H439 AromaticContact NE2-NE2 2.91Å; H435-H439 PolarHBondContact NE2-NE2 3.06Å
436	K	86.4	Confident	86.4	Confident	90 Å²	90	69.6 Å²	69.6	39%	0.391	38%	0.376	S	S	.	.	H	α-helix	trans	-56.9	-30.7	177.2	-71.9	-166.2	172.8	-150.9	0	113.6	L432 T433 I438 H439 T440	L432-K436 HydrophobicContact CD1-CG 4.44Å; L432-K436 PolarHBondContact O-N 2.91Å; T433-K436 PolarHBondContact O-N 3.44Å; K436-I438 PolarHBondContact O-N 3.38Å; K436-I438 VanDerWaalsContact O-N 3.12Å; K436-H439 PolarHBondContact O-N 3.13Å; K436-T440 PolarHBondContact O-N 3.43Å; K436-T440 VanDerWaalsContact O-N 3.14Å
437	I	86.9	Confident	86.4	Confident	26 Å²	26	67.4 Å²	67.4	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-55.7	-27.7	173.1	-56.3	176.5	0	0	0	112.2	H435 T440 G441 E442 N455	H435-I437 PolarHBondContact O-N 3.42Å; I437-T440 PolarHBondContact O-OG1 2.84Å; I437-G441 PolarHBondContact O-N 2.63Å; I437-E442 HydrophobicContact CG2-CB 4.28Å; I437-E442 WeakPolarHBondContact CG2-O 3.47Å; I437-N455 HydrophobicContact CG2-CB 3.97Å
438	I	84.9	Confident	86.4	Confident	88 Å²	88	73.5 Å²	73.5	45%	0.451	39%	0.391	S	S	.	.	H	α-helix	trans	-69.8	-35	177.2	-56.2	-180	0	0	0	111.1	H435 K436 W456	H435-I438 VanDerWaalsContact O-CB 3.25Å; H435-I438 WeakPolarHBondContact O-CB 3.29Å; H435-I438 WeakPolarHBondContact O-CG1 3.22Å; H435-I438 PolarHBondContact O-N 2.96Å; K436-I438 PolarHBondContact O-N 3.38Å; K436-I438 VanDerWaalsContact O-N 3.12Å; I438-W456 HydrophobicContact CD1-CZ2 4.22Å
439	H	85.4	Confident	86.3	Confident	77 Å²	77	76.1 Å²	76.1	36%	0.356	40%	0.403	S	S	.	.	H	α-helix	trans	-81	-41.7	-179.3	-60.2	-53.3	0	0	0	112.3	C419 E421 C422 H435 K436 G441	C419-H439 PolarHBondContact SG-NE2 3.04Å; E421-H439 WeakPolarHBondContact OE2-CB 3.35Å; E421-H439 IonicContact OE2-CD2 3.68Å; E421-H439 PolarHBondContact OE2-CD2 3.25Å; E421-H439 IonicContact OE2-CG 3.35Å; C422-H439 WeakPolarHBondContact CB-CE1 3.41Å; C422-H439 WeakPolarHBondContact CB-NE2 3.49Å; C422-H439 PolarHBondContact SG-CE1 3.24Å; C422-H439 PolarHBondContact SG-NE2 3.08Å; H435-H439 AromaticContact CD2-NE2 3.58Å; H435-H439 AromaticContact CE1-NE2 3.73Å; H435-H439 AromaticContact NE2-NE2 2.91Å; H435-H439 PolarHBondContact NE2-NE2 3.06Å; K436-H439 PolarHBondContact O-N 3.13Å; H439-G441 PolarHBondContact O-N 2.9Å
440	T	82.9	Confident	86.2	Confident	79 Å²	79	75.6 Å²	75.6	49%	0.485	40%	0.399	S	S	.	.	H	α-helix	trans	-68.5	-15.1	175	62.2	0	0	0	0	112.8	K436 I437 E442	K436-T440 PolarHBondContact O-N 3.43Å; K436-T440 VanDerWaalsContact O-N 3.14Å; I437-T440 PolarHBondContact O-OG1 2.84Å; T440-E442 PolarHBondContact O-N 2.58Å; T440-E442 VanDerWaalsContact O-N 3.09Å; T440-E442 WeakPolarHBondContact OG1-CB 3.4Å; T440-E442 WeakPolarHBondContact OG1-CG 3.39Å; T440-E442 PolarHBondContact OG1-N 3.26Å
441	G	81.1	Confident	86.1	Confident	48 Å²	48	75.2 Å²	75.2	50%	0.495	41%	0.405	S	S	.	.			trans	67.2	3.4	-175	0	0	0	0	0	114	I437 H439	I437-G441 PolarHBondContact O-N 2.63Å; H439-G441 PolarHBondContact O-N 2.9Å
442	E	82.1	Confident	86.1	Confident	115 Å²	115	79 Å²	79	54%	0.537	42%	0.417	S	S	.	.			trans	-59.7	142.1	-177.2	-76.4	178.2	167.8	0	0	111.2	I437 T440	I437-E442 HydrophobicContact CG2-CB 4.28Å; I437-E442 WeakPolarHBondContact CG2-O 3.47Å; T440-E442 PolarHBondContact O-N 2.58Å; T440-E442 VanDerWaalsContact O-N 3.09Å; T440-E442 WeakPolarHBondContact OG1-CB 3.4Å; T440-E442 WeakPolarHBondContact OG1-CG 3.39Å; T440-E442 PolarHBondContact OG1-N 3.26Å
443	K	85.3	Confident	86	Confident	124 Å²	124	79.4 Å²	79.4	54%	0.539	43%	0.425	S	S	.	.			trans	-128.5	75.4	177.1	-69.6	165.5	-178	172.4	0	109.1	Y445 A453 F454	K443-Y445 PolarHBondContact O-N 3.28Å; K443-Y445 VanDerWaalsContact O-N 3.12Å; K443-A453 HydrophobicContact CB-CB 3.43Å; K443-A453 VanDerWaalsContact CB-CB 3.43Å; K443-A453 HydrophobicContact CD-CB 4.09Å; K443-A453 HydrophobicContact CG-CB 4.34Å; K443-F454 CarbonylContact C-O 3.59Å; K443-F454 VanDerWaalsContact C-O 3.23Å; K443-F454 VanDerWaalsContact CA-O 3.27Å; K443-F454 WeakPolarHBondContact CA-O 3.21Å
444	P	84.5	Confident	86	Confident	73 Å²	73	76.9 Å²	76.9	47%	0.474	41%	0.406	S	S	.	.			trans	-63.5	-20.9	-172.7	-22	34.4	0	0	0	113.6
445	Y	87	Confident	85.9	Confident	90 Å²	90	75.9 Å²	75.9	35%	0.353	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	87.1	-171.7	-55.1	-73.7	0	0	0	110.6	K443 F454 N455 S457	K443-Y445 PolarHBondContact O-N 3.28Å; K443-Y445 VanDerWaalsContact O-N 3.12Å; Y445-F454 WeakPolarHBondContact CB-O 3.38Å; Y445-F454 PolarHBondContact N-O 3.03Å; Y445-F454 VanDerWaalsContact N-O 3.12Å; Y445-F454 PolarHBondContact O-N 3.18Å; Y445-N455 WeakPolarHBondContact CE2-O 3.34Å; Y445-S457 VanDerWaalsContact CD2-N 3.34Å
446	K	87.4	Confident	85.7	Confident	137 Å²	137	79.9 Å²	79.9	60%	0.596	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	150.4	175.5	-64.9	-176.7	-179.7	178.8	0	111.8	A453 L460	K446-A453 HydrophobicContact CG-CB 3.94Å; K446-L460 VanDerWaalsContact O-CD2 3.26Å; K446-L460 WeakPolarHBondContact O-CD2 3.49Å
447	C	90.4	Very high	85.6	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	41%	0.414	C	S	.	.			trans	-102.4	108.3	172.4	179.7	0	0	0	0	109.1	E449 C450 G451 K452 F454 L460 H463 H467	C447-E449 PolarHBondContact O-N 3.38Å; C447-E449 VanDerWaalsContact O-N 3.17Å; C447-C450 PolarHBondContact O-N 2.83Å; C447-C450 VanDerWaalsContact SG-SG 3.68Å; C447-G451 WeakPolarHBondContact O-CA 3.49Å; C447-G451 PolarHBondContact O-N 3.03Å; C447-K452 VanDerWaalsContact CB-O 3.28Å; C447-K452 WeakPolarHBondContact CB-O 3.47Å; C447-K452 PolarHBondContact N-O 3.34Å; C447-F454 HydrophobicContact CB-CE2 4.31Å; C447-L460 HydrophobicContact CB-CD1 3.57Å; C447-H463 VanDerWaalsContact SG-CD2 3.58Å; C447-H467 PolarHBondContact SG-NE2 3.08Å; C447-H467 VanDerWaalsContact SG-NE2 3.35Å
448	E	88.4	Confident	85.5	Confident	162 Å²	162	80.3 Å²	80.3	76%	0.757	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-33.7	179.9	-49	-45	126	0	0	113.3	C450	E448-C450 VanDerWaalsContact C-N 3.34Å; E448-C450 PolarHBondContact O-N 2.85Å
449	E	86.7	Confident	85.5	Confident	111 Å²	111	78 Å²	78	52%	0.519	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-18.1	-175.7	-65.4	156.2	140.9	0	0	113.9	C447 H467	C447-E449 PolarHBondContact O-N 3.38Å; C447-E449 VanDerWaalsContact O-N 3.17Å; E449-H467 IonicContact OE2-CD2 3.06Å; E449-H467 PolarHBondContact OE2-CD2 2.98Å; E449-H467 IonicContact OE2-CG 3.2Å
450	C	87.3	Confident	85.6	Confident	52 Å²	52	75.4 Å²	75.4	35%	0.351	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.5	12.4	-177.1	74.7	0	0	0	0	115.5	C447 E448 K452 H463 H467	C447-C450 PolarHBondContact O-N 2.83Å; C447-C450 VanDerWaalsContact SG-SG 3.68Å; E448-C450 VanDerWaalsContact C-N 3.34Å; E448-C450 PolarHBondContact O-N 2.85Å; C450-K452 PolarHBondContact O-N 3.41Å; C450-H463 PolarHBondContact SG-NE2 3.36Å; C450-H467 PolarHBondContact SG-NE2 2.99Å
451	G	85.3	Confident	85.7	Confident	56 Å²	56	76 Å²	76	58%	0.577	41%	0.411	S	S	*	.			trans	66.8	-11.4	-177.8	0	0	0	0	0	116.2	C447 A453	C447-G451 WeakPolarHBondContact O-CA 3.49Å; C447-G451 PolarHBondContact O-N 3.03Å; G451-A453 PolarHBondContact O-N 3.49Å
452	K	87.1	Confident	85.9	Confident	129 Å²	129	79.4 Å²	79.4	56%	0.561	41%	0.412	S	S	*	.			trans	-64.4	125	-173.1	-71.6	179.6	-179.8	173.1	0	111.5	C447 C450 F454	C447-K452 VanDerWaalsContact CB-O 3.28Å; C447-K452 WeakPolarHBondContact CB-O 3.47Å; C447-K452 PolarHBondContact N-O 3.34Å; C450-K452 PolarHBondContact O-N 3.41Å; K452-F454 HydrophobicContact CB-CE2 3.93Å; K452-F454 HydrophobicContact CB-CZ 4.09Å; K452-F454 WeakPolarHBondContact O-CD2 3.45Å; K452-F454 VanDerWaalsContact O-CE2 3.28Å; K452-F454 WeakPolarHBondContact O-CE2 3.44Å
453	A	87.9	Confident	86.1	Confident	34 Å²	34	74.9 Å²	74.9	28%	0.281	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	141.5	-178.2	0	0	0	0	0	111.8	K443 K446 G451	K443-A453 HydrophobicContact CB-CB 3.43Å; K443-A453 VanDerWaalsContact CB-CB 3.43Å; K443-A453 HydrophobicContact CD-CB 4.09Å; K443-A453 HydrophobicContact CG-CB 4.34Å; K446-A453 HydrophobicContact CG-CB 3.94Å; G451-A453 PolarHBondContact O-N 3.49Å
454	F	85.4	Confident	86	Confident	42 Å²	42	73 Å²	73	18%	0.184	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.3	-178.2	-59.7	-89.2	0	0	0	111.3	K443 Y445 C447 K452 L460 H463	K443-F454 CarbonylContact C-O 3.59Å; K443-F454 VanDerWaalsContact C-O 3.23Å; K443-F454 VanDerWaalsContact CA-O 3.27Å; K443-F454 WeakPolarHBondContact CA-O 3.21Å; Y445-F454 WeakPolarHBondContact CB-O 3.38Å; Y445-F454 PolarHBondContact N-O 3.03Å; Y445-F454 VanDerWaalsContact N-O 3.12Å; Y445-F454 PolarHBondContact O-N 3.18Å; C447-F454 HydrophobicContact CB-CE2 4.31Å; K452-F454 HydrophobicContact CB-CE2 3.93Å; K452-F454 HydrophobicContact CB-CZ 4.09Å; K452-F454 WeakPolarHBondContact O-CD2 3.45Å; K452-F454 VanDerWaalsContact O-CE2 3.28Å; K452-F454 WeakPolarHBondContact O-CE2 3.44Å; F454-L460 HydrophobicContact CB-CB 4.4Å; F454-L460 HydrophobicContact CD2-CB 4.02Å; F454-L460 HydrophobicContact CD2-CD1 3.87Å; F454-L460 HydrophobicContact CE2-CD1 4.07Å; F454-L460 HydrophobicContact CG-CB 4.37Å; F454-H463 HydrophobicContact CE1-CB 4.15Å; F454-H463 HydrophobicContact CE2-CB 3.94Å; F454-H463 AromaticContact CE2-CD2 3.4Å; F454-H463 VanDerWaalsContact CE2-CD2 3.4Å; F454-H463 WeakPolarHBondContact CE2-CD2 3.43Å; F454-H463 AromaticContact CE2-CG 3.65Å; F454-H463 HydrophobicContact CZ-CB 3.59Å; F454-H463 AromaticContact CZ-CD2 3.48Å; F454-H463 VanDerWaalsContact CZ-CD2 3.48Å; F454-H463 WeakPolarHBondContact CZ-CD2 2.99Å; F454-H463 AromaticContact CZ-CG 3.27Å; F454-H463 AromaticContact CZ-ND1 3.7Å; F454-H463 AromaticContact CZ-NE2 3.99Å
455	N	84	Confident	86	Confident	42 Å²	42	71 Å²	71	23%	0.225	37%	0.368	C	S	.	.	S	Bend	trans	-76.8	-20.1	175.8	60.7	-14.7	0	0	0	113.4	I437 Y445	I437-N455 HydrophobicContact CG2-CB 3.97Å; Y445-N455 WeakPolarHBondContact CE2-O 3.34Å
456	W	82.9	Confident	85.8	Confident	102 Å²	102	71.1 Å²	71.1	39%	0.386	37%	0.374	S	S	.	.	S	Bend	trans	-132.7	143.4	-178.5	-55.2	-45.3	0	0	0	112.2	I438 S458 T459 L460	I438-W456 HydrophobicContact CD1-CZ2 4.22Å; W456-S458 VanDerWaalsContact C-N 3.29Å; W456-S458 PolarHBondContact O-N 3.13Å; W456-T459 HydrophobicContact CE3-CG2 3.92Å; W456-T459 PolarHBondContact O-N 3.11Å; W456-T459 PolarHBondContact O-OG1 3.47Å; W456-L460 PolarHBondContact O-N 3.18Å
457	S	85	Confident	85.5	Confident	63 Å²	63	67.7 Å²	67.7	44%	0.441	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-36.2	176.9	56.9	0	0	0	0	112.4	Y445 T459 L460 T461	Y445-S457 VanDerWaalsContact CD2-N 3.34Å; S457-T459 VanDerWaalsContact C-N 3.33Å; S457-T459 PolarHBondContact O-N 2.8Å; S457-L460 WeakPolarHBondContact O-CB 3.18Å; S457-L460 PolarHBondContact O-N 3.14Å; S457-T461 PolarHBondContact O-N 3.43Å; S457-T461 PolarHBondContact O-OG1 2.96Å
458	S	84.4	Confident	84.8	Confident	63 Å²	63	70.8 Å²	70.8	44%	0.441	38%	0.379	S	S	.	.	H	α-helix	trans	-68.9	-28	-179.1	65.9	0	0	0	0	113.6	W456 K462	W456-S458 VanDerWaalsContact C-N 3.29Å; W456-S458 PolarHBondContact O-N 3.13Å; S458-K462 VanDerWaalsContact O-CG 3.31Å; S458-K462 WeakPolarHBondContact O-CG 3.41Å; S458-K462 PolarHBondContact O-N 3.02Å
459	T	85.2	Confident	83.9	Confident	39 Å²	39	70.4 Å²	70.4	24%	0.239	38%	0.377	C	S	.	.	H	α-helix	trans	-77.3	-38	172.1	46.8	0	0	0	0	110.9	W456 S457 K462 H463	W456-T459 HydrophobicContact CE3-CG2 3.92Å; W456-T459 PolarHBondContact O-N 3.11Å; W456-T459 PolarHBondContact O-OG1 3.47Å; S457-T459 VanDerWaalsContact C-N 3.33Å; S457-T459 PolarHBondContact O-N 2.8Å; T459-K462 PolarHBondContact O-N 3.28Å; T459-H463 VanDerWaalsContact O-CB 3.3Å; T459-H463 WeakPolarHBondContact O-CB 3.34Å; T459-H463 PolarHBondContact O-N 3.02Å
460	L	87.4	Confident	83.5	Confident	22 Å²	22	69 Å²	69	12%	0.115	37%	0.371	C	S	.	.	H	α-helix	trans	-58.7	-46	168.6	175.2	62.8	0	0	0	111.9	K446 C447 F454 W456 S457 K462 H463 K464	K446-L460 VanDerWaalsContact O-CD2 3.26Å; K446-L460 WeakPolarHBondContact O-CD2 3.49Å; C447-L460 HydrophobicContact CB-CD1 3.57Å; F454-L460 HydrophobicContact CB-CB 4.4Å; F454-L460 HydrophobicContact CD2-CB 4.02Å; F454-L460 HydrophobicContact CD2-CD1 3.87Å; F454-L460 HydrophobicContact CE2-CD1 4.07Å; F454-L460 HydrophobicContact CG-CB 4.37Å; W456-L460 PolarHBondContact O-N 3.18Å; S457-L460 WeakPolarHBondContact O-CB 3.18Å; S457-L460 PolarHBondContact O-N 3.14Å; L460-K462 PolarHBondContact O-N 3.23Å; L460-H463 WeakPolarHBondContact O-CA 3.26Å; L460-H463 WeakPolarHBondContact O-CB 3.4Å; L460-H463 PolarHBondContact O-N 2.88Å; L460-H463 VanDerWaalsContact O-N 3.08Å; L460-K464 HydrophobicContact CD1-CG 4.3Å; L460-K464 PolarHBondContact O-N 3.37Å
461	T	85.5	Confident	83.2	Confident	92 Å²	92	72 Å²	72	56%	0.564	38%	0.377	S	S	*	.	H	α-helix	trans	-60.1	-43.9	177.4	-50.7	0	0	0	0	111.8	S457 H463 K464	S457-T461 PolarHBondContact O-N 3.43Å; S457-T461 PolarHBondContact O-OG1 2.96Å; T461-H463 VanDerWaalsContact C-N 3.28Å; T461-H463 PolarHBondContact O-N 3.48Å; T461-K464 PolarHBondContact O-N 2.99Å
462	K	84.3	Confident	83.1	Confident	119 Å²	119	72.9 Å²	72.9	52%	0.517	37%	0.373	S	S	.	.	H	α-helix	trans	-65.6	-31.4	174.8	-71.8	170.7	-176.7	177.6	0	112.5	S458 T459 L460	S458-K462 VanDerWaalsContact O-CG 3.31Å; S458-K462 WeakPolarHBondContact O-CG 3.41Å; S458-K462 PolarHBondContact O-N 3.02Å; T459-K462 PolarHBondContact O-N 3.28Å; L460-K462 PolarHBondContact O-N 3.23Å
463	H	86.4	Confident	83.1	Confident	21 Å²	21	69.4 Å²	69.4	10%	0.097	36%	0.357	C	S	.	.	H	α-helix	trans	-71.1	-40	176.9	176	64.4	0	0	0	112.3	C447 C450 F454 T459 L460 T461 I465 I466 H467	C447-H463 VanDerWaalsContact SG-CD2 3.58Å; C450-H463 PolarHBondContact SG-NE2 3.36Å; F454-H463 HydrophobicContact CE1-CB 4.15Å; F454-H463 HydrophobicContact CE2-CB 3.94Å; F454-H463 AromaticContact CE2-CD2 3.4Å; F454-H463 VanDerWaalsContact CE2-CD2 3.4Å; F454-H463 WeakPolarHBondContact CE2-CD2 3.43Å; F454-H463 AromaticContact CE2-CG 3.65Å; F454-H463 HydrophobicContact CZ-CB 3.59Å; F454-H463 AromaticContact CZ-CD2 3.48Å; F454-H463 VanDerWaalsContact CZ-CD2 3.48Å; F454-H463 WeakPolarHBondContact CZ-CD2 2.99Å; F454-H463 AromaticContact CZ-CG 3.27Å; F454-H463 AromaticContact CZ-ND1 3.7Å; F454-H463 AromaticContact CZ-NE2 3.99Å; T459-H463 VanDerWaalsContact O-CB 3.3Å; T459-H463 WeakPolarHBondContact O-CB 3.34Å; T459-H463 PolarHBondContact O-N 3.02Å; L460-H463 WeakPolarHBondContact O-CA 3.26Å; L460-H463 WeakPolarHBondContact O-CB 3.4Å; L460-H463 PolarHBondContact O-N 2.88Å; L460-H463 VanDerWaalsContact O-N 3.08Å; T461-H463 VanDerWaalsContact C-N 3.28Å; T461-H463 PolarHBondContact O-N 3.48Å; H463-I465 PolarHBondContact O-N 3.45Å; H463-I466 WeakPolarHBondContact O-CA 3.37Å; H463-I466 WeakPolarHBondContact O-CB 3.35Å; H463-I466 WeakPolarHBondContact O-CG1 3.42Å; H463-I466 PolarHBondContact O-N 2.83Å; H463-H467 AromaticContact CD2-NE2 3.8Å; H463-H467 AromaticContact CE1-NE2 3.72Å; H463-H467 AromaticContact NE2-CE1 3.79Å; H463-H467 AromaticContact NE2-NE2 3.11Å; H463-H467 PolarHBondContact NE2-NE2 3.06Å; H463-H467 VanDerWaalsContact NE2-NE2 3.11Å
464	K	84.3	Confident	83.1	Confident	83 Å²	83	75 Å²	75	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-58.5	-29.2	177.8	-70.8	-167.8	175	-160.3	0	113.7	L460 T461 I466 H467 T468	L460-K464 HydrophobicContact CD1-CG 4.3Å; L460-K464 PolarHBondContact O-N 3.37Å; T461-K464 PolarHBondContact O-N 2.99Å; K464-I466 PolarHBondContact O-N 3.02Å; K464-I466 VanDerWaalsContact O-N 3.15Å; K464-H467 PolarHBondContact O-N 2.99Å; K464-T468 PolarHBondContact O-N 2.81Å
465	I	84.6	Confident	83.3	Confident	31 Å²	31	73 Å²	73	16%	0.159	37%	0.367	C	S	.	.	H	α-helix	trans	-62	-19.6	172.8	-52	172.4	0	0	0	112.1	H463 E470 K483	H463-I465 PolarHBondContact O-N 3.45Å; I465-E470 WeakPolarHBondContact CG2-O 3.37Å; I465-K483 HydrophobicContact CG2-CB 3.96Å; I465-K483 HydrophobicContact CG2-CG 4.28Å; I465-K483 WeakPolarHBondContact O-CD 3.44Å; I465-K483 PolarHBondContact O-NZ 3.23Å
466	I	82.1	Confident	83.5	Confident	93 Å²	93	78.8 Å²	78.8	48%	0.477	39%	0.392	S	S	.	.	H	α-helix	trans	-67.7	-42.5	173.2	-58.1	-178.1	0	0	0	110.2	H463 K464 K483	H463-I466 WeakPolarHBondContact O-CA 3.37Å; H463-I466 WeakPolarHBondContact O-CB 3.35Å; H463-I466 WeakPolarHBondContact O-CG1 3.42Å; H463-I466 PolarHBondContact O-N 2.83Å; K464-I466 PolarHBondContact O-N 3.02Å; K464-I466 VanDerWaalsContact O-N 3.15Å; I466-K483 PolarHBondContact O-NZ 3.19Å
467	H	81.6	Confident	83.6	Confident	65 Å²	65	81 Å²	81	30%	0.301	40%	0.404	S	S	.	.	H	α-helix	trans	-78.2	-38.5	-176.1	-55.8	-50.8	0	0	0	113.3	C447 E449 C450 H463 K464 E469	C447-H467 PolarHBondContact SG-NE2 3.08Å; C447-H467 VanDerWaalsContact SG-NE2 3.35Å; E449-H467 IonicContact OE2-CD2 3.06Å; E449-H467 PolarHBondContact OE2-CD2 2.98Å; E449-H467 IonicContact OE2-CG 3.2Å; C450-H467 PolarHBondContact SG-NE2 2.99Å; H463-H467 AromaticContact CD2-NE2 3.8Å; H463-H467 AromaticContact CE1-NE2 3.72Å; H463-H467 AromaticContact NE2-CE1 3.79Å; H463-H467 AromaticContact NE2-NE2 3.11Å; H463-H467 PolarHBondContact NE2-NE2 3.06Å; H463-H467 VanDerWaalsContact NE2-NE2 3.11Å; K464-H467 PolarHBondContact O-N 2.99Å; H467-E469 PolarHBondContact O-N 3.22Å
468	T	75.4	Confident	83.8	Confident	66 Å²	66	80.5 Å²	80.5	41%	0.405	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	2.7	-175.1	61.1	0	0	0	0	115.1	K464 E470	K464-T468 PolarHBondContact O-N 2.81Å; T468-E470 PolarHBondContact O-N 3.34Å
469	E	69.2	Low	83.8	Confident	154 Å²	154	80.2 Å²	80.2	72%	0.72	41%	0.407	S	S	*	.			trans	52.8	-12.6	-167.4	-62.6	-134.5	128.9	0	0	117	H467 K471	H467-E469 PolarHBondContact O-N 3.22Å; E469-K471 PolarHBondContact O-N 2.9Å
470	E	77.3	Confident	83.9	Confident	82 Å²	82	84.6 Å²	84.6	38%	0.383	42%	0.423	S	S	.	.			trans	-49.9	127.8	-178.6	-66.8	-171.4	134	0	0	110.4	R38 I465 T468 P472	R38-E470 IonicContact NH2-OE1 3.34Å; R38-E470 PolarHBondContact NH2-OE1 2.85Å; R38-E470 IonicContact NH2-OE2 2.67Å; R38-E470 PolarHBondContact NH2-OE2 2.93Å; R38-E470 VanDerWaalsContact NH2-OE2 3.1Å; I465-E470 WeakPolarHBondContact CG2-O 3.37Å; T468-E470 PolarHBondContact O-N 3.34Å; E470-P472 HydrophobicContact CB-CG 4.46Å; E470-P472 WeakPolarHBondContact O-CD 3.11Å
471	K	81.9	Confident	84	Confident	113 Å²	113	85.1 Å²	85.1	49%	0.491	43%	0.43	S	S	.	.			trans	-117	78.2	172.3	-71.2	162.2	-177.6	166.4	0	107.8	E469 Y473 A481 F482 K483	E469-K471 PolarHBondContact O-N 2.9Å; K471-Y473 PolarHBondContact O-N 3.19Å; K471-A481 HydrophobicContact CB-CB 3.51Å; K471-A481 HydrophobicContact CD-CB 4.11Å; K471-A481 HydrophobicContact CG-CB 4.38Å; K471-F482 CarbonylContact C-O 3.59Å; K471-F482 VanDerWaalsContact C-O 3.31Å; K471-F482 WeakPolarHBondContact CA-O 3.47Å; K471-K483 HydrophobicContact CG-CG 3.93Å
472	P	83.6	Confident	84	Confident	75 Å²	75	82.7 Å²	82.7	49%	0.487	41%	0.412	S	S	.	.			trans	-65.8	-22.9	-169.1	-20.4	33.5	0	0	0	113.3	E470 K474	E470-P472 HydrophobicContact CB-CG 4.46Å; E470-P472 WeakPolarHBondContact O-CD 3.11Å; P472-K474 PolarHBondContact O-N 3.31Å
473	Y	86.3	Confident	83.9	Confident	57 Å²	57	80 Å²	80	22%	0.224	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	88	-170.8	-54.3	-78.9	0	0	0	109.9	K471 F482 Q484	K471-Y473 PolarHBondContact O-N 3.19Å; Y473-F482 WeakPolarHBondContact CD2-O 3.36Å; Y473-F482 PolarHBondContact N-O 3.03Å; Y473-F482 PolarHBondContact O-N 3.39Å; Y473-Q484 VanDerWaalsContact CD2-C 3.41Å
474	K	87.4	Confident	83.8	Confident	150 Å²	150	82.9 Å²	82.9	65%	0.652	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	143.3	177.1	-60.6	-168.2	178.4	-175.5	0	111.6	P472 A481 L488	P472-K474 PolarHBondContact O-N 3.31Å; K474-A481 HydrophobicContact CG-CB 3.9Å; K474-L488 WeakPolarHBondContact O-CD2 3.48Å
475	C	91.1	Very high	83.9	Confident	2 Å²	2	81.9 Å²	81.9	1%	0.014	42%	0.417	C	S	.	.			trans	-90.8	118.6	169.7	-171.7	0	0	0	0	110.1	K477 C478 G479 K480 F482 L488 H495	C475-K477 VanDerWaalsContact C-N 3.33Å; C475-K477 PolarHBondContact O-N 2.82Å; C475-C478 PolarHBondContact O-N 3.01Å; C475-G479 WeakPolarHBondContact O-CA 3.36Å; C475-G479 PolarHBondContact O-N 2.88Å; C475-K480 WeakPolarHBondContact CB-O 3.4Å; C475-K480 PolarHBondContact N-O 2.99Å; C475-F482 HydrophobicContact CB-CE2 4.35Å; C475-L488 HydrophobicContact CB-CD1 3.61Å; C475-H495 PolarHBondContact SG-NE2 2.67Å
476	E	88.4	Confident	83.9	Confident	163 Å²	163	83.1 Å²	83.1	76%	0.762	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-38.3	-179.8	-65.9	133.6	158.3	0	0	112.4	C478 K492	E476-C478 VanDerWaalsContact C-N 3.34Å; E476-C478 PolarHBondContact O-N 3.1Å; E476-K492 IonicContact OE2-NZ 2.71Å; E476-K492 PolarHBondContact OE2-NZ 3.3Å
477	K	84.6	Confident	84.1	Confident	148 Å²	148	82.1 Å²	82.1	64%	0.643	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-22	-176.5	-73.1	-168.4	172	-167.9	0	115.2	C475 H495	C475-K477 VanDerWaalsContact C-N 3.33Å; C475-K477 PolarHBondContact O-N 2.82Å; K477-H495 HydrophobicContact CD-CB 3.61Å
478	C	88.1	Confident	84.4	Confident	53 Å²	53	80.1 Å²	80.1	36%	0.358	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.3	10.9	-173	71.7	0	0	0	0	115.1	C475 E476 K480 H491 H495	C475-C478 PolarHBondContact O-N 3.01Å; E476-C478 VanDerWaalsContact C-N 3.34Å; E476-C478 PolarHBondContact O-N 3.1Å; C478-K480 PolarHBondContact O-N 3.5Å; C478-H491 PolarHBondContact SG-NE2 3.21Å; C478-H495 PolarHBondContact SG-NE2 3.1Å; C478-H495 VanDerWaalsContact SG-NE2 3.38Å
479	G	85.3	Confident	85	Confident	56 Å²	56	80.7 Å²	80.7	58%	0.577	42%	0.418	S	S	*	.			trans	68	-16	-178.8	0	0	0	0	0	116.3	C475 A481	C475-G479 WeakPolarHBondContact O-CA 3.36Å; C475-G479 PolarHBondContact O-N 2.88Å; G479-A481 PolarHBondContact O-N 3.15Å
480	K	87.3	Confident	85.8	Confident	132 Å²	132	75.3 Å²	75.3	57%	0.574	40%	0.395	S	S	*	.			trans	-60.8	128.2	-173.4	-68.5	-176.8	179.8	178.9	0	111.6	C475 C478 F482	C475-K480 WeakPolarHBondContact CB-O 3.4Å; C475-K480 PolarHBondContact N-O 2.99Å; C478-K480 PolarHBondContact O-N 3.5Å; K480-F482 HydrophobicContact CB-CE2 4.05Å; K480-F482 HydrophobicContact CB-CZ 3.94Å; K480-F482 VanDerWaalsContact O-CE2 3.31Å; K480-F482 WeakPolarHBondContact O-CE2 3.43Å
481	A	88.4	Confident	86.3	Confident	33 Å²	33	72.3 Å²	72.3	27%	0.273	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.2	-175	0	0	0	0	0	112	K471 K474 G479	K471-A481 HydrophobicContact CB-CB 3.51Å; K471-A481 HydrophobicContact CD-CB 4.11Å; K471-A481 HydrophobicContact CG-CB 4.38Å; K474-A481 HydrophobicContact CG-CB 3.9Å; G479-A481 PolarHBondContact O-N 3.15Å
482	F	85.6	Confident	86.6	Confident	40 Å²	40	71.1 Å²	71.1	18%	0.175	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	151	-175	-56.1	-82.5	0	0	0	111.9	K471 Y473 C475 K480 Q484 I487 L488 H491	K471-F482 CarbonylContact C-O 3.59Å; K471-F482 VanDerWaalsContact C-O 3.31Å; K471-F482 WeakPolarHBondContact CA-O 3.47Å; Y473-F482 WeakPolarHBondContact CD2-O 3.36Å; Y473-F482 PolarHBondContact N-O 3.03Å; Y473-F482 PolarHBondContact O-N 3.39Å; C475-F482 HydrophobicContact CB-CE2 4.35Å; K480-F482 HydrophobicContact CB-CE2 4.05Å; K480-F482 HydrophobicContact CB-CZ 3.94Å; K480-F482 VanDerWaalsContact O-CE2 3.31Å; K480-F482 WeakPolarHBondContact O-CE2 3.43Å; F482-Q484 VanDerWaalsContact C-N 3.32Å; F482-I487 HydrophobicContact CB-CB 4.42Å; F482-I487 HydrophobicContact CB-CG2 4.39Å; F482-I487 HydrophobicContact CD1-CB 4.4Å; F482-I487 HydrophobicContact CD1-CG2 3.51Å; F482-I487 HydrophobicContact CE1-CG2 4.09Å; F482-I487 HydrophobicContact CG-CG2 4.11Å; F482-L488 HydrophobicContact CD2-CB 3.96Å; F482-L488 HydrophobicContact CD2-CD1 3.87Å; F482-L488 HydrophobicContact CE2-CD1 4.01Å; F482-H491 HydrophobicContact CE1-CB 4.32Å; F482-H491 HydrophobicContact CE2-CB 3.9Å; F482-H491 AromaticContact CE2-CD2 3.41Å; F482-H491 VanDerWaalsContact CE2-CD2 3.41Å; F482-H491 WeakPolarHBondContact CE2-CD2 3.43Å; F482-H491 AromaticContact CE2-CG 3.67Å; F482-H491 HydrophobicContact CZ-CB 3.66Å; F482-H491 AromaticContact CZ-CD2 3.46Å; F482-H491 VanDerWaalsContact CZ-CD2 3.46Å; F482-H491 WeakPolarHBondContact CZ-CD2 3.48Å; F482-H491 AromaticContact CZ-CG 3.33Å; F482-H491 AromaticContact CZ-ND1 3.85Å
483	K	83.8	Confident	86.8	Confident	62 Å²	62	69.9 Å²	69.9	27%	0.27	36%	0.361	S	S	.	.	S	Bend	trans	-78.1	-12.3	176.8	-62.8	-166.3	170.8	-170.9	0	113.5	I465 I466 K471	I465-K483 HydrophobicContact CG2-CB 3.96Å; I465-K483 HydrophobicContact CG2-CG 4.28Å; I465-K483 WeakPolarHBondContact O-CD 3.44Å; I465-K483 PolarHBondContact O-NZ 3.23Å; I466-K483 PolarHBondContact O-NZ 3.19Å; K471-K483 HydrophobicContact CG-CG 3.93Å
484	Q	83.8	Confident	86.9	Confident	82 Å²	82	71.7 Å²	71.7	38%	0.383	37%	0.374	S	S	.	.	S	Bend	trans	-142	142.7	-178.3	-64.2	-176.6	2.9	0	0	112.1	Y473 F482 I487 L488	Y473-Q484 VanDerWaalsContact CD2-C 3.41Å; F482-Q484 VanDerWaalsContact C-N 3.32Å; Q484-I487 HydrophobicContact CB-CG1 4.07Å; Q484-I487 PolarHBondContact O-N 3.46Å; Q484-L488 PolarHBondContact O-N 2.84Å
485	S	85.6	Confident	86.8	Confident	62 Å²	62	67.7 Å²	67.7	43%	0.434	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-43.1	178.8	52	0	0	0	0	113.2	I487 L488 T489	S485-I487 PolarHBondContact O-N 2.71Å; S485-L488 CarbonylContact O-C 3.27Å; S485-L488 WeakPolarHBondContact O-CA 3.47Å; S485-L488 WeakPolarHBondContact O-CB 3.13Å; S485-L488 PolarHBondContact O-N 3.12Å; S485-T489 PolarHBondContact O-N 3.45Å; S485-T489 PolarHBondContact O-OG1 2.84Å
486	S	85.6	Confident	86.5	Confident	57 Å²	57	71.1 Å²	71.1	40%	0.399	38%	0.378	S	S	.	.	H	α-helix	trans	-58.6	-32.7	177.8	55.4	0	0	0	0	113.1	N490	S486-N490 WeakPolarHBondContact O-CB 3.29Å; S486-N490 PolarHBondContact O-N 2.8Å; S486-N490 PolarHBondContact O-ND2 2.99Å
487	I	85.4	Confident	86.4	Confident	73 Å²	73	65.8 Å²	65.8	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-74.5	-39	175.5	-54.7	-60.1	0	0	0	110.5	F482 Q484 S485 N490 H491	F482-I487 HydrophobicContact CB-CB 4.42Å; F482-I487 HydrophobicContact CB-CG2 4.39Å; F482-I487 HydrophobicContact CD1-CB 4.4Å; F482-I487 HydrophobicContact CD1-CG2 3.51Å; F482-I487 HydrophobicContact CE1-CG2 4.09Å; F482-I487 HydrophobicContact CG-CG2 4.11Å; Q484-I487 HydrophobicContact CB-CG1 4.07Å; Q484-I487 PolarHBondContact O-N 3.46Å; S485-I487 PolarHBondContact O-N 2.71Å; I487-N490 PolarHBondContact O-N 3.27Å; I487-H491 VanDerWaalsContact O-CB 3.29Å; I487-H491 WeakPolarHBondContact O-CB 3.46Å; I487-H491 PolarHBondContact O-N 2.86Å
488	L	88.4	Confident	86.5	Confident	22 Å²	22	63.2 Å²	63.2	12%	0.115	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-45.4	171.3	173.9	62.4	0	0	0	111.5	K474 C475 F482 Q484 S485 H491 K492	K474-L488 WeakPolarHBondContact O-CD2 3.48Å; C475-L488 HydrophobicContact CB-CD1 3.61Å; F482-L488 HydrophobicContact CD2-CB 3.96Å; F482-L488 HydrophobicContact CD2-CD1 3.87Å; F482-L488 HydrophobicContact CE2-CD1 4.01Å; Q484-L488 PolarHBondContact O-N 2.84Å; S485-L488 CarbonylContact O-C 3.27Å; S485-L488 WeakPolarHBondContact O-CA 3.47Å; S485-L488 WeakPolarHBondContact O-CB 3.13Å; S485-L488 PolarHBondContact O-N 3.12Å; L488-H491 CarbonylContact O-C 3.17Å; L488-H491 WeakPolarHBondContact O-CA 3.29Å; L488-H491 WeakPolarHBondContact O-CB 3.2Å; L488-H491 PolarHBondContact O-N 2.84Å; L488-H491 VanDerWaalsContact O-N 3.09Å; L488-K492 HydrophobicContact CD1-CG 4.22Å; L488-K492 PolarHBondContact O-N 3.32Å
489	T	87.3	Confident	86.5	Confident	78 Å²	78	66.8 Å²	66.8	48%	0.479	37%	0.366	S	S	.	.	H	α-helix	trans	-59.9	-48.3	176.5	-53.7	0	0	0	0	111.4	S485 H491 K492 R493	S485-T489 PolarHBondContact O-N 3.45Å; S485-T489 PolarHBondContact O-OG1 2.84Å; T489-H491 PolarHBondContact O-N 3Å; T489-K492 PolarHBondContact O-N 3.03Å; T489-R493 PolarHBondContact O-N 3.18Å
490	N	86.9	Confident	86.6	Confident	41 Å²	41	67.6 Å²	67.6	22%	0.219	36%	0.361	C	S	.	.	H	α-helix	trans	-63.8	-24	174.8	-76.9	-55.1	0	0	0	113.6	S486 I487	S486-N490 WeakPolarHBondContact O-CB 3.29Å; S486-N490 PolarHBondContact O-N 2.8Å; S486-N490 PolarHBondContact O-ND2 2.99Å; I487-N490 PolarHBondContact O-N 3.27Å
491	H	88.5	Confident	86.7	Confident	20 Å²	20	64.4 Å²	64.4	9%	0.093	35%	0.346	C	S	.	.	H	α-helix	trans	-80.3	-38.7	172.9	176.7	64.2	0	0	0	112.3	C478 F482 I487 L488 T489 R493 I494 H495	C478-H491 PolarHBondContact SG-NE2 3.21Å; F482-H491 HydrophobicContact CE1-CB 4.32Å; F482-H491 HydrophobicContact CE2-CB 3.9Å; F482-H491 AromaticContact CE2-CD2 3.41Å; F482-H491 VanDerWaalsContact CE2-CD2 3.41Å; F482-H491 WeakPolarHBondContact CE2-CD2 3.43Å; F482-H491 AromaticContact CE2-CG 3.67Å; F482-H491 HydrophobicContact CZ-CB 3.66Å; F482-H491 AromaticContact CZ-CD2 3.46Å; F482-H491 VanDerWaalsContact CZ-CD2 3.46Å; F482-H491 WeakPolarHBondContact CZ-CD2 3.48Å; F482-H491 AromaticContact CZ-CG 3.33Å; F482-H491 AromaticContact CZ-ND1 3.85Å; I487-H491 VanDerWaalsContact O-CB 3.29Å; I487-H491 WeakPolarHBondContact O-CB 3.46Å; I487-H491 PolarHBondContact O-N 2.86Å; L488-H491 CarbonylContact O-C 3.17Å; L488-H491 WeakPolarHBondContact O-CA 3.29Å; L488-H491 WeakPolarHBondContact O-CB 3.2Å; L488-H491 PolarHBondContact O-N 2.84Å; L488-H491 VanDerWaalsContact O-N 3.09Å; T489-H491 PolarHBondContact O-N 3Å; H491-R493 PolarHBondContact O-N 3.27Å; H491-I494 VanDerWaalsContact O-CB 3.31Å; H491-I494 WeakPolarHBondContact O-CB 3.22Å; H491-I494 PolarHBondContact O-N 3Å; H491-H495 AromaticContact CD2-NE2 3.73Å; H491-H495 AromaticContact CE1-NE2 3.58Å; H491-H495 AromaticContact NE2-CD2 3.92Å; H491-H495 AromaticContact NE2-CE1 3.82Å; H491-H495 AromaticContact NE2-NE2 3.01Å; H491-H495 PolarHBondContact NE2-NE2 3.17Å
492	K	87.3	Confident	86.8	Confident	88 Å²	88	67.7 Å²	67.7	38%	0.383	35%	0.354	S	S	.	.	H	α-helix	trans	-55.9	-36.3	175.3	-76.6	-167.4	171.9	-160.7	0	111.4	E476 L488 T489 I494 H495 T496	E476-K492 IonicContact OE2-NZ 2.71Å; E476-K492 PolarHBondContact OE2-NZ 3.3Å; L488-K492 HydrophobicContact CD1-CG 4.22Å; L488-K492 PolarHBondContact O-N 3.32Å; T489-K492 PolarHBondContact O-N 3.03Å; K492-I494 PolarHBondContact O-N 3.12Å; K492-I494 VanDerWaalsContact O-N 3.16Å; K492-H495 WeakPolarHBondContact O-CB 3.3Å; K492-H495 PolarHBondContact O-N 2.82Å; K492-T496 PolarHBondContact O-N 3.3Å
493	R	88.7	Confident	87	Confident	48 Å²	48	65.9 Å²	65.9	18%	0.181	35%	0.347	C	S	.	.	H	α-helix	trans	-57.8	-22.6	172.7	-67.2	-177.6	177.6	172.9	-0.9	115.4	T489 H491 H495 T496 G497 E498 N511	T489-R493 PolarHBondContact O-N 3.18Å; H491-R493 PolarHBondContact O-N 3.27Å; R493-H495 VanDerWaalsContact C-N 3.34Å; R493-T496 WeakPolarHBondContact CA-OG1 3.35Å; R493-G497 PolarHBondContact O-N 3.5Å; R493-G497 VanDerWaalsContact O-N 3.09Å; R493-E498 HydrophobicContact CB-CB 4.26Å; R493-E498 HydrophobicContact CG-CB 4.08Å; R493-E498 PolarHBondContact O-N 3.41Å; R493-N511 HydrophobicContact CB-CB 4.4Å; R493-N511 WeakPolarHBondContact CD-O 2.9Å; R493-N511 PolarHBondContact NH1-O 3.18Å
494	I	86.6	Confident	87.3	Confident	96 Å²	96	69.3 Å²	69.3	49%	0.492	36%	0.364	S	S	.	.	H	α-helix	trans	-71.9	-34.5	174.2	-55.7	178.1	0	0	0	110.1	H491 K492	H491-I494 VanDerWaalsContact O-CB 3.31Å; H491-I494 WeakPolarHBondContact O-CB 3.22Å; H491-I494 PolarHBondContact O-N 3Å; K492-I494 PolarHBondContact O-N 3.12Å; K492-I494 VanDerWaalsContact O-N 3.16Å
495	H	86.4	Confident	87.4	Confident	66 Å²	66	71.2 Å²	71.2	31%	0.306	37%	0.373	S	S	.	.	H	α-helix	trans	-84.2	-16.5	179.9	-57	-60.3	0	0	0	114.4	C475 K477 C478 H491 K492 R493	C475-H495 PolarHBondContact SG-NE2 2.67Å; K477-H495 HydrophobicContact CD-CB 3.61Å; C478-H495 PolarHBondContact SG-NE2 3.1Å; C478-H495 VanDerWaalsContact SG-NE2 3.38Å; H491-H495 AromaticContact CD2-NE2 3.73Å; H491-H495 AromaticContact CE1-NE2 3.58Å; H491-H495 AromaticContact NE2-CD2 3.92Å; H491-H495 AromaticContact NE2-CE1 3.82Å; H491-H495 AromaticContact NE2-NE2 3.01Å; H491-H495 PolarHBondContact NE2-NE2 3.17Å; K492-H495 WeakPolarHBondContact O-CB 3.3Å; K492-H495 PolarHBondContact O-N 2.82Å; R493-H495 VanDerWaalsContact C-N 3.34Å
496	T	85.8	Confident	87.6	Confident	74 Å²	74	70.6 Å²	70.6	45%	0.454	37%	0.368	S	S	.	.	H	α-helix	trans	-103	-9.8	175.4	57.3	0	0	0	0	112.7	K492 R493 E498	K492-T496 PolarHBondContact O-N 3.3Å; R493-T496 WeakPolarHBondContact CA-OG1 3.35Å; T496-E498 WeakPolarHBondContact CB-OE1 3.48Å; T496-E498 PolarHBondContact O-N 3.08Å; T496-E498 WeakPolarHBondContact OG1-CG 3.23Å; T496-E498 PolarHBondContact OG1-OE1 3.46Å
497	G	84.4	Confident	87.6	Confident	50 Å²	50	69.9 Å²	69.9	52%	0.515	37%	0.369	S	S	.	.			trans	72.7	-1.1	-175.3	0	0	0	0	0	114.4	R493 K499	R493-G497 PolarHBondContact O-N 3.5Å; R493-G497 VanDerWaalsContact O-N 3.09Å; G497-K499 PolarHBondContact O-N 2.9Å
498	E	86.8	Confident	87.7	Confident	94 Å²	94	72.4 Å²	72.4	44%	0.439	38%	0.377	S	S	.	.			trans	-54.5	122.6	-177.8	-80.1	164.2	-121.4	0	0	112.6	R493 T496 N511	R493-E498 HydrophobicContact CB-CB 4.26Å; R493-E498 HydrophobicContact CG-CB 4.08Å; R493-E498 PolarHBondContact O-N 3.41Å; T496-E498 WeakPolarHBondContact CB-OE1 3.48Å; T496-E498 PolarHBondContact O-N 3.08Å; T496-E498 WeakPolarHBondContact OG1-CG 3.23Å; T496-E498 PolarHBondContact OG1-OE1 3.46Å; E498-N511 WeakPolarHBondContact O-CB 3.47Å
499	K	88.3	Confident	87.8	Confident	128 Å²	128	73.5 Å²	73.5	56%	0.557	39%	0.387	S	S	*	.			trans	-126.1	74.4	174.7	-69.9	164.1	174.5	-179.6	0	110.2	G497 Y501 S509 F510 N511	G497-K499 PolarHBondContact O-N 2.9Å; K499-Y501 PolarHBondContact O-N 3.29Å; K499-Y501 VanDerWaalsContact O-N 3.08Å; K499-S509 WeakPolarHBondContact CD-O 3.36Å; K499-F510 CarbonylContact C-O 3.22Å; K499-F510 VanDerWaalsContact CA-O 3.25Å; K499-F510 WeakPolarHBondContact CA-O 3.4Å; K499-N511 HydrophobicContact CG-CB 4.49Å
500	P	88.6	Confident	87.8	Confident	73 Å²	73	72 Å²	72	47%	0.474	37%	0.374	S	S	.	.			trans	-65.8	-14.2	-171.7	-22.4	35.5	0	0	0	114.9
501	Y	89.7	Confident	87.8	Confident	65 Å²	65	72.2 Å²	72.2	26%	0.255	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	87.5	-175.8	-51.8	-74.8	0	0	0	109.9	K499 S509 F510 R512 F516	K499-Y501 PolarHBondContact O-N 3.29Å; K499-Y501 VanDerWaalsContact O-N 3.08Å; Y501-S509 CarbonylContact O-C 3.57Å; Y501-S509 WeakPolarHBondContact O-CA 3.32Å; Y501-F510 WeakPolarHBondContact CD2-O 3.36Å; Y501-F510 PolarHBondContact N-O 3.44Å; Y501-F510 PolarHBondContact O-N 3.14Å; Y501-R512 VanDerWaalsContact CE2-C 3.47Å; Y501-F516 HydrophobicContact CD1-CD1 4.34Å; Y501-F516 HydrophobicContact CG-CB 4.38Å; Y501-F516 HydrophobicContact CG-CD1 4.4Å
502	K	88.9	Confident	87.6	Confident	102 Å²	102	76.2 Å²	76.2	44%	0.443	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	140.3	174.5	-172.5	179.3	172.8	-130.1	0	110.9	E504 F516	K502-E504 WeakPolarHBondContact CD-OE1 3.33Å; K502-E504 WeakPolarHBondContact CG-OE1 3.29Å; K502-E504 IonicContact NZ-OE1 3.51Å; K502-E504 IonicContact NZ-OE2 3.06Å; K502-E504 PolarHBondContact NZ-OE2 3.49Å; K502-F516 WeakPolarHBondContact O-CE2 3.46Å; K502-F516 WeakPolarHBondContact O-CZ 3.38Å
503	C	91.3	Very high	87.6	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.014	39%	0.39	C	S	.	.			trans	-94.4	115.4	167.6	179.6	0	0	0	0	109.2	E505 C506 G507 K508 F516 H523	C503-E505 VanDerWaalsContact C-N 3.35Å; C503-C506 VanDerWaalsContact SG-SG 3.62Å; C503-G507 CarbonylContact O-C 3.49Å; C503-G507 WeakPolarHBondContact O-CA 3.48Å; C503-G507 PolarHBondContact O-N 2.71Å; C503-K508 VanDerWaalsContact CB-O 3.27Å; C503-K508 WeakPolarHBondContact CB-O 3.3Å; C503-K508 PolarHBondContact N-O 2.91Å; C503-F516 HydrophobicContact CB-CD2 4.45Å; C503-F516 HydrophobicContact CB-CE2 3.86Å; C503-H523 PolarHBondContact SG-NE2 2.91Å
504	E	89.5	Confident	87.5	Confident	134 Å²	134	76 Å²	76	63%	0.626	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-33.1	178	-55.3	-44.8	128.6	0	0	112.1	K502 C506	K502-E504 WeakPolarHBondContact CD-OE1 3.33Å; K502-E504 WeakPolarHBondContact CG-OE1 3.29Å; K502-E504 IonicContact NZ-OE1 3.51Å; K502-E504 IonicContact NZ-OE2 3.06Å; K502-E504 PolarHBondContact NZ-OE2 3.49Å; E504-C506 VanDerWaalsContact C-N 3.26Å; E504-C506 PolarHBondContact O-N 3.45Å
505	E	86.6	Confident	87.5	Confident	123 Å²	123	74 Å²	74	58%	0.575	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.1	179.4	-66.5	151.5	-142.3	0	0	114.2	C503 H523	C503-E505 VanDerWaalsContact C-N 3.35Å; E505-H523 WeakPolarHBondContact OE2-CB 3.42Å; E505-H523 IonicContact OE2-CD2 2.96Å; E505-H523 PolarHBondContact OE2-CD2 3.26Å; E505-H523 IonicContact OE2-CG 3.3Å; E505-H523 VanDerWaalsContact OE2-CG 3.24Å
506	C	88.1	Confident	87.6	Confident	49 Å²	49	72.4 Å²	72.4	33%	0.331	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.6	15.4	179.5	74.9	0	0	0	0	115.5	C503 E504 K508 H519 H523	C503-C506 VanDerWaalsContact SG-SG 3.62Å; E504-C506 VanDerWaalsContact C-N 3.26Å; E504-C506 PolarHBondContact O-N 3.45Å; C506-K508 PolarHBondContact O-N 2.99Å; C506-H519 VanDerWaalsContact SG-CE1 3.56Å; C506-H519 PolarHBondContact SG-NE2 2.86Å; C506-H523 VanDerWaalsContact SG-CE1 3.54Å; C506-H523 PolarHBondContact SG-NE2 3.19Å; C506-H523 VanDerWaalsContact SG-NE2 3.4Å
507	G	86	Confident	87.6	Confident	42 Å²	42	72.7 Å²	72.7	43%	0.433	39%	0.393	S	S	.	.			trans	66.7	-9.4	-179.2	0	0	0	0	0	116.9	C503 S509	C503-G507 CarbonylContact O-C 3.49Å; C503-G507 WeakPolarHBondContact O-CA 3.48Å; C503-G507 PolarHBondContact O-N 2.71Å; G507-S509 PolarHBondContact O-N 3.44Å
508	K	88.4	Confident	87.6	Confident	125 Å²	125	76.3 Å²	76.3	54%	0.543	40%	0.395	S	S	.	.			trans	-70.1	124.7	-172.5	-69.3	175.9	-174.9	170.2	0	112.2	C503 C506 F510	C503-K508 VanDerWaalsContact CB-O 3.27Å; C503-K508 WeakPolarHBondContact CB-O 3.3Å; C503-K508 PolarHBondContact N-O 2.91Å; C506-K508 PolarHBondContact O-N 2.99Å; K508-F510 HydrophobicContact CB-CE2 3.88Å; K508-F510 HydrophobicContact CB-CZ 4.04Å; K508-F510 VanDerWaalsContact O-CE2 3.26Å; K508-F510 WeakPolarHBondContact O-CE2 3.46Å
509	S	89.6	Confident	87.6	Confident	46 Å²	46	72.7 Å²	72.7	32%	0.322	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	140.8	178.6	-50	0	0	0	0	113.4	K499 Y501 G507	K499-S509 WeakPolarHBondContact CD-O 3.36Å; Y501-S509 CarbonylContact O-C 3.57Å; Y501-S509 WeakPolarHBondContact O-CA 3.32Å; G507-S509 PolarHBondContact O-N 3.44Å
510	F	87.9	Confident	87.4	Confident	45 Å²	45	71 Å²	71	20%	0.197	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.3	-175.6	-56.6	-95.1	0	0	0	111.7	K499 Y501 K508 F516 H519	K499-F510 CarbonylContact C-O 3.22Å; K499-F510 VanDerWaalsContact CA-O 3.25Å; K499-F510 WeakPolarHBondContact CA-O 3.4Å; Y501-F510 WeakPolarHBondContact CD2-O 3.36Å; Y501-F510 PolarHBondContact N-O 3.44Å; Y501-F510 PolarHBondContact O-N 3.14Å; K508-F510 HydrophobicContact CB-CE2 3.88Å; K508-F510 HydrophobicContact CB-CZ 4.04Å; K508-F510 VanDerWaalsContact O-CE2 3.26Å; K508-F510 WeakPolarHBondContact O-CE2 3.46Å; F510-F516 HydrophobicContact CB-CB 4.17Å; F510-F516 HydrophobicContact CD2-CB 4.07Å; F510-F516 AromaticContact CD2-CD2 3.86Å; F510-F516 HydrophobicContact CD2-CD2 3.86Å; F510-F516 HydrophobicContact CD2-CG 4.44Å; F510-F516 HydrophobicContact CE2-CD2 4.24Å; F510-F516 HydrophobicContact CG-CB 4.23Å; F510-H519 HydrophobicContact CE1-CB 4.14Å; F510-H519 HydrophobicContact CE2-CB 4.04Å; F510-H519 AromaticContact CE2-CD2 3.23Å; F510-H519 WeakPolarHBondContact CE2-CD2 3.34Å; F510-H519 AromaticContact CE2-CG 3.7Å; F510-H519 AromaticContact CE2-NE2 3.9Å; F510-H519 HydrophobicContact CZ-CB 3.61Å; F510-H519 AromaticContact CZ-CD2 3.36Å; F510-H519 WeakPolarHBondContact CZ-CD2 3.38Å; F510-H519 AromaticContact CZ-CG 3.34Å; F510-H519 AromaticContact CZ-ND1 3.96Å; F510-H519 AromaticContact CZ-NE2 3.94Å
511	N	85.6	Confident	87.3	Confident	47 Å²	47	69.7 Å²	69.7	25%	0.251	36%	0.361	S	S	.	.	S	Bend	trans	-85	-13.8	178.1	59.1	16	0	0	0	114	R493 E498 K499	R493-N511 HydrophobicContact CB-CB 4.4Å; R493-N511 WeakPolarHBondContact CD-O 2.9Å; R493-N511 PolarHBondContact NH1-O 3.18Å; E498-N511 WeakPolarHBondContact O-CB 3.47Å; K499-N511 HydrophobicContact CG-CB 4.49Å
512	R	85.9	Confident	87	Confident	104 Å²	104	70.1 Å²	70.1	39%	0.392	37%	0.367	S	S	.	.	S	Bend	trans	-129.7	137.9	-179.4	-65.6	169.6	-175.3	-172.3	1.5	111.5	Y501 S514 T515 F516	Y501-R512 VanDerWaalsContact CE2-C 3.47Å; R512-S514 VanDerWaalsContact C-N 3.34Å; R512-S514 PolarHBondContact O-N 3.36Å; R512-T515 PolarHBondContact O-N 3.49Å; R512-T515 PolarHBondContact O-OG1 2.86Å; R512-F516 PolarHBondContact O-N 3.42Å
513	S	86.8	Confident	86.8	Confident	56 Å²	56	68.8 Å²	68.8	39%	0.392	36%	0.362	S	S	.	.	H	α-helix	trans	-59.5	-43.5	176.1	174.5	0	0	0	0	111.6	T515 F516 T517	S513-T515 VanDerWaalsContact C-N 3.3Å; S513-T515 PolarHBondContact O-N 2.91Å; S513-F516 CarbonylContact O-C 3.6Å; S513-F516 WeakPolarHBondContact O-CA 3.17Å; S513-F516 WeakPolarHBondContact O-CB 3.38Å; S513-F516 PolarHBondContact O-N 3.31Å; S513-T517 PolarHBondContact O-N 3.35Å; S513-T517 PolarHBondContact O-OG1 2.99Å; S513-T517 VanDerWaalsContact O-OG1 3.09Å
514	S	86.1	Confident	86.3	Confident	76 Å²	76	73 Å²	73	53%	0.531	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-27.5	-178.2	57.7	0	0	0	0	114.8	R512 K518	R512-S514 VanDerWaalsContact C-N 3.34Å; R512-S514 PolarHBondContact O-N 3.36Å; S514-K518 VanDerWaalsContact O-CG 3.3Å; S514-K518 WeakPolarHBondContact O-CG 3.22Å; S514-K518 PolarHBondContact O-N 3.46Å
515	T	86.3	Confident	85.8	Confident	54 Å²	54	68.8 Å²	68.8	33%	0.331	38%	0.38	S	S	.	.	H	α-helix	trans	-77	-35.7	170.8	44.1	0	0	0	0	111.8	R512 S513 K518 H519	R512-T515 PolarHBondContact O-N 3.49Å; R512-T515 PolarHBondContact O-OG1 2.86Å; S513-T515 VanDerWaalsContact C-N 3.3Å; S513-T515 PolarHBondContact O-N 2.91Å; T515-K518 PolarHBondContact O-N 3.3Å; T515-H519 WeakPolarHBondContact O-CB 3.34Å; T515-H519 PolarHBondContact O-N 3.45Å
516	F	88.3	Confident	85.5	Confident	32 Å²	32	67.1 Å²	67.1	14%	0.14	38%	0.378	C	S	.	.	H	α-helix	trans	-65.9	-46.1	175.3	173.1	-124.3	0	0	0	112.3	Y501 K502 C503 F510 R512 S513 K518 H519 K520	Y501-F516 HydrophobicContact CD1-CD1 4.34Å; Y501-F516 HydrophobicContact CG-CB 4.38Å; Y501-F516 HydrophobicContact CG-CD1 4.4Å; K502-F516 WeakPolarHBondContact O-CE2 3.46Å; K502-F516 WeakPolarHBondContact O-CZ 3.38Å; C503-F516 HydrophobicContact CB-CD2 4.45Å; C503-F516 HydrophobicContact CB-CE2 3.86Å; F510-F516 HydrophobicContact CB-CB 4.17Å; F510-F516 HydrophobicContact CD2-CB 4.07Å; F510-F516 AromaticContact CD2-CD2 3.86Å; F510-F516 HydrophobicContact CD2-CD2 3.86Å; F510-F516 HydrophobicContact CD2-CG 4.44Å; F510-F516 HydrophobicContact CE2-CD2 4.24Å; F510-F516 HydrophobicContact CG-CB 4.23Å; R512-F516 PolarHBondContact O-N 3.42Å; S513-F516 CarbonylContact O-C 3.6Å; S513-F516 WeakPolarHBondContact O-CA 3.17Å; S513-F516 WeakPolarHBondContact O-CB 3.38Å; S513-F516 PolarHBondContact O-N 3.31Å; F516-K518 VanDerWaalsContact C-N 3.34Å; F516-K518 PolarHBondContact O-N 2.72Å; F516-H519 WeakPolarHBondContact O-CB 3.26Å; F516-H519 PolarHBondContact O-N 2.95Å; F516-K520 HydrophobicContact CE2-CG 4.23Å; F516-K520 HydrophobicContact CZ-CD 4.33Å; F516-K520 HydrophobicContact CZ-CG 4.42Å; F516-K520 PolarHBondContact O-N 3.35Å
517	T	85.9	Confident	85.4	Confident	80 Å²	80	69.5 Å²	69.5	49%	0.491	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-43.9	174.5	-46.4	0	0	0	0	111.6	S513 H519 K520 V521	S513-T517 PolarHBondContact O-N 3.35Å; S513-T517 PolarHBondContact O-OG1 2.99Å; S513-T517 VanDerWaalsContact O-OG1 3.09Å; T517-H519 PolarHBondContact O-N 3.06Å; T517-K520 PolarHBondContact O-N 3.04Å; T517-V521 PolarHBondContact O-N 3.17Å
518	K	85.1	Confident	85.3	Confident	126 Å²	126	70.9 Å²	70.9	55%	0.548	38%	0.384	S	S	.	.	H	α-helix	trans	-63.4	-29.9	175.3	-77.3	-179.8	179.2	-170.3	0	113.4	S514 T515 F516	S514-K518 VanDerWaalsContact O-CG 3.3Å; S514-K518 WeakPolarHBondContact O-CG 3.22Å; S514-K518 PolarHBondContact O-N 3.46Å; T515-K518 PolarHBondContact O-N 3.3Å; F516-K518 VanDerWaalsContact C-N 3.34Å; F516-K518 PolarHBondContact O-N 2.72Å
519	H	87.3	Confident	85.2	Confident	17 Å²	17	69.6 Å²	69.6	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-75	-40.9	176.2	169.3	58.7	0	0	0	112	C506 F510 T515 F516 T517 V521 I522 H523	C506-H519 VanDerWaalsContact SG-CE1 3.56Å; C506-H519 PolarHBondContact SG-NE2 2.86Å; F510-H519 HydrophobicContact CE1-CB 4.14Å; F510-H519 HydrophobicContact CE2-CB 4.04Å; F510-H519 AromaticContact CE2-CD2 3.23Å; F510-H519 WeakPolarHBondContact CE2-CD2 3.34Å; F510-H519 AromaticContact CE2-CG 3.7Å; F510-H519 AromaticContact CE2-NE2 3.9Å; F510-H519 HydrophobicContact CZ-CB 3.61Å; F510-H519 AromaticContact CZ-CD2 3.36Å; F510-H519 WeakPolarHBondContact CZ-CD2 3.38Å; F510-H519 AromaticContact CZ-CG 3.34Å; F510-H519 AromaticContact CZ-ND1 3.96Å; F510-H519 AromaticContact CZ-NE2 3.94Å; T515-H519 WeakPolarHBondContact O-CB 3.34Å; T515-H519 PolarHBondContact O-N 3.45Å; F516-H519 WeakPolarHBondContact O-CB 3.26Å; F516-H519 PolarHBondContact O-N 2.95Å; T517-H519 PolarHBondContact O-N 3.06Å; H519-V521 PolarHBondContact O-N 3.25Å; H519-I522 VanDerWaalsContact O-CB 3.25Å; H519-I522 WeakPolarHBondContact O-CB 3.19Å; H519-I522 WeakPolarHBondContact O-CG1 3.32Å; H519-I522 PolarHBondContact O-N 2.75Å; H519-H523 AromaticContact CD2-NE2 3.93Å; H519-H523 AromaticContact CE1-CE1 3.54Å; H519-H523 AromaticContact CE1-NE2 3.2Å; H519-H523 PolarHBondContact CE1-NE2 2.92Å; H519-H523 AromaticContact NE2-CD2 3.99Å; H519-H523 AromaticContact NE2-CE1 3.82Å; H519-H523 AromaticContact NE2-NE2 3.06Å; H519-H523 PolarHBondContact NE2-NE2 3.5Å
520	K	84.8	Confident	85	Confident	92 Å²	92	73.7 Å²	73.7	40%	0.4	39%	0.389	S	S	.	.	H	α-helix	trans	-55.3	-35.6	175.1	-73.1	-155.2	174.3	-149.6	0	113.4	F516 T517 I522 H523 T524	F516-K520 HydrophobicContact CE2-CG 4.23Å; F516-K520 HydrophobicContact CZ-CD 4.33Å; F516-K520 HydrophobicContact CZ-CG 4.42Å; F516-K520 PolarHBondContact O-N 3.35Å; T517-K520 PolarHBondContact O-N 3.04Å; K520-I522 PolarHBondContact O-N 3.43Å; K520-I522 VanDerWaalsContact O-N 3.15Å; K520-H523 PolarHBondContact O-N 3.46Å; K520-H523 VanDerWaalsContact O-N 3.12Å; K520-T524 PolarHBondContact O-N 3.16Å
521	V	84.9	Confident	85.1	Confident	47 Å²	47	71.6 Å²	71.6	29%	0.285	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-16.9	176.7	179.8	0	0	0	0	113	T517 H519 T524 F539	T517-V521 PolarHBondContact O-N 3.17Å; H519-V521 PolarHBondContact O-N 3.25Å; V521-T524 PolarHBondContact O-OG1 3.38Å; V521-F539 HydrophobicContact CG1-CD1 4.33Å
522	I	84.8	Confident	85.2	Confident	74 Å²	74	77 Å²	77	38%	0.379	40%	0.403	S	S	.	.	H	α-helix	trans	-74.3	-42.1	174.7	-55.3	175	0	0	0	110.1	H519 K520 G525 W540	H519-I522 VanDerWaalsContact O-CB 3.25Å; H519-I522 WeakPolarHBondContact O-CB 3.19Å; H519-I522 WeakPolarHBondContact O-CG1 3.32Å; H519-I522 PolarHBondContact O-N 2.75Å; K520-I522 PolarHBondContact O-N 3.43Å; K520-I522 VanDerWaalsContact O-N 3.15Å; I522-G525 PolarHBondContact O-N 3.06Å; I522-W540 HydrophobicContact CD1-CZ2 4.42Å
523	H	84	Confident	85.1	Confident	74 Å²	74	77.2 Å²	77.2	34%	0.343	41%	0.409	S	S	.	.	H	α-helix	trans	-72	-30.4	-177.2	-58.8	-46.4	0	0	0	113.1	C503 E505 C506 H519 K520 G525	C503-H523 PolarHBondContact SG-NE2 2.91Å; E505-H523 WeakPolarHBondContact OE2-CB 3.42Å; E505-H523 IonicContact OE2-CD2 2.96Å; E505-H523 PolarHBondContact OE2-CD2 3.26Å; E505-H523 IonicContact OE2-CG 3.3Å; E505-H523 VanDerWaalsContact OE2-CG 3.24Å; C506-H523 VanDerWaalsContact SG-CE1 3.54Å; C506-H523 PolarHBondContact SG-NE2 3.19Å; C506-H523 VanDerWaalsContact SG-NE2 3.4Å; H519-H523 AromaticContact CD2-NE2 3.93Å; H519-H523 AromaticContact CE1-CE1 3.54Å; H519-H523 AromaticContact CE1-NE2 3.2Å; H519-H523 PolarHBondContact CE1-NE2 2.92Å; H519-H523 AromaticContact NE2-CD2 3.99Å; H519-H523 AromaticContact NE2-CE1 3.82Å; H519-H523 AromaticContact NE2-NE2 3.06Å; H519-H523 PolarHBondContact NE2-NE2 3.5Å; K520-H523 PolarHBondContact O-N 3.46Å; K520-H523 VanDerWaalsContact O-N 3.12Å; H523-G525 PolarHBondContact O-N 2.86Å
524	T	81.1	Confident	85.1	Confident	90 Å²	90	76.9 Å²	76.9	55%	0.552	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-11.5	173.2	64.6	0	0	0	0	113	K520 V521 V526	K520-T524 PolarHBondContact O-N 3.16Å; V521-T524 PolarHBondContact O-OG1 3.38Å; T524-V526 PolarHBondContact O-N 3.06Å
525	G	78.5	Confident	85	Confident	45 Å²	45	76 Å²	76	46%	0.464	41%	0.409	S	S	.	.			trans	67.1	-14.5	-176.8	0	0	0	0	0	115.2	I522 H523 K527	I522-G525 PolarHBondContact O-N 3.06Å; H523-G525 PolarHBondContact O-N 2.86Å; G525-K527 PolarHBondContact O-N 3.03Å
526	V	80.9	Confident	85	Confident	88 Å²	88	79.5 Å²	79.5	53%	0.533	42%	0.419	S	S	.	.			trans	-65.8	118.8	-177.9	-176.2	0	0	0	0	109.7	T524 P528 F539	T524-V526 PolarHBondContact O-N 3.06Å; V526-P528 HydrophobicContact CG1-CG 4.24Å; V526-P528 VanDerWaalsContact O-CD 3.29Å; V526-P528 WeakPolarHBondContact O-CD 3.36Å; V526-F539 WeakPolarHBondContact O-CD1 3.2Å
527	K	85.6	Confident	85	Confident	100 Å²	100	79.6 Å²	79.6	44%	0.435	43%	0.426	S	S	.	.			trans	-102.3	91.5	173.3	-68.3	173.1	-175.2	175	0	108.6	G525 Y529 A537 F538 F539	G525-K527 PolarHBondContact O-N 3.03Å; K527-Y529 PolarHBondContact O-N 3.04Å; K527-A537 HydrophobicContact CB-CB 3.62Å; K527-A537 HydrophobicContact CD-CB 4.11Å; K527-F538 CarbonylContact C-O 3.24Å; K527-F538 WeakPolarHBondContact CA-O 3.3Å; K527-F539 HydrophobicContact CD-CE2 4.35Å; K527-F539 HydrophobicContact CD-CZ 4.33Å; K527-F539 HydrophobicContact CG-CD1 3.82Å; K527-F539 HydrophobicContact CG-CD2 4.17Å; K527-F539 HydrophobicContact CG-CE1 3.66Å; K527-F539 HydrophobicContact CG-CE2 4.02Å; K527-F539 HydrophobicContact CG-CG 4.09Å; K527-F539 HydrophobicContact CG-CZ 3.76Å
528	P	83.3	Confident	85	Confident	71 Å²	71	77.7 Å²	77.7	46%	0.461	41%	0.411	S	S	.	.			trans	-73.5	-17.8	-166.2	-14.1	30.7	0	0	0	113.4	V526 F538	V526-P528 HydrophobicContact CG1-CG 4.24Å; V526-P528 VanDerWaalsContact O-CD 3.29Å; V526-P528 WeakPolarHBondContact O-CD 3.36Å; P528-F538 WeakPolarHBondContact CD-O 3.27Å
529	Y	86.3	Confident	84.8	Confident	97 Å²	97	74.4 Å²	74.4	38%	0.38	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	93.6	-170.4	-56.7	-75	0	0	0	109.9	K527 A537 F538 F539 S541	K527-Y529 PolarHBondContact O-N 3.04Å; Y529-A537 CarbonylContact O-C 3.23Å; Y529-A537 WeakPolarHBondContact O-CA 3.45Å; Y529-F538 PolarHBondContact N-O 3.45Å; Y529-F538 VanDerWaalsContact N-O 3.16Å; Y529-F538 PolarHBondContact O-N 2.82Å; Y529-F539 WeakPolarHBondContact CE2-O 3.41Å; Y529-S541 VanDerWaalsContact CD2-N 3.28Å
530	K	86.4	Confident	84.7	Confident	133 Å²	133	78.8 Å²	78.8	58%	0.578	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	151.7	175.5	-63.5	-174.9	-179.8	-179.1	0	111.4	A537 L544	K530-A537 HydrophobicContact CG-CB 4.05Å; K530-L544 WeakPolarHBondContact O-CD2 3.33Å
531	C	89.6	Confident	84.7	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.007	41%	0.414	C	S	.	.			trans	-99.4	112.8	170.1	178.8	0	0	0	0	108.5	E533 C534 G535 K536 F538 L544 H551	C531-E533 PolarHBondContact O-N 3.38Å; C531-C534 PolarHBondContact O-N 3.09Å; C531-C534 VanDerWaalsContact SG-SG 3.61Å; C531-G535 VanDerWaalsContact O-CA 3.28Å; C531-G535 WeakPolarHBondContact O-CA 3.49Å; C531-G535 PolarHBondContact O-N 3.44Å; C531-K536 WeakPolarHBondContact CB-O 3.44Å; C531-K536 PolarHBondContact N-O 2.8Å; C531-F538 HydrophobicContact CB-CE2 4.46Å; C531-L544 HydrophobicContact CB-CD1 3.57Å; C531-H551 PolarHBondContact SG-NE2 3.12Å; C531-H551 VanDerWaalsContact SG-NE2 3.38Å
532	E	87.4	Confident	84.7	Confident	159 Å²	159	78.3 Å²	78.3	74%	0.743	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-33.2	-180	-50.2	-47.2	131	0	0	112.7	C534	E532-C534 PolarHBondContact O-N 3.39Å
533	E	84.6	Confident	84.7	Confident	109 Å²	109	77.1 Å²	77.1	51%	0.509	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-21	-176.2	-65.4	145.9	161.1	0	0	113.9	C531 H551	C531-E533 PolarHBondContact O-N 3.38Å; E533-H551 IonicContact OE2-CD2 3.24Å; E533-H551 PolarHBondContact OE2-CD2 3.36Å; E533-H551 IonicContact OE2-CG 3.57Å
534	C	87	Confident	84.9	Confident	50 Å²	50	74.8 Å²	74.8	34%	0.338	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.8	12.8	-175.9	76.2	0	0	0	0	115.4	C531 E532 K536 H547 H551	C531-C534 PolarHBondContact O-N 3.09Å; C531-C534 VanDerWaalsContact SG-SG 3.61Å; E532-C534 PolarHBondContact O-N 3.39Å; C534-K536 PolarHBondContact O-N 3.46Å; C534-H547 PolarHBondContact SG-NE2 3.12Å; C534-H551 PolarHBondContact SG-NE2 3.06Å; C534-H551 VanDerWaalsContact SG-NE2 3.38Å
535	G	83.5	Confident	85.1	Confident	57 Å²	57	74.3 Å²	74.3	59%	0.588	41%	0.406	S	S	*	.			trans	68	-12	-179.7	0	0	0	0	0	116.6	C531 A537	C531-G535 VanDerWaalsContact O-CA 3.28Å; C531-G535 WeakPolarHBondContact O-CA 3.49Å; C531-G535 PolarHBondContact O-N 3.44Å; G535-A537 PolarHBondContact O-N 3.21Å
536	K	86.4	Confident	85.4	Confident	127 Å²	127	77.2 Å²	77.2	55%	0.552	41%	0.406	S	S	*	.			trans	-63.4	124.4	-172.8	-71.1	177.9	-177.8	172.7	0	111.8	C531 C534 F538	C531-K536 WeakPolarHBondContact CB-O 3.44Å; C531-K536 PolarHBondContact N-O 2.8Å; C534-K536 PolarHBondContact O-N 3.46Å; K536-F538 HydrophobicContact CB-CE2 3.92Å; K536-F538 HydrophobicContact CB-CZ 4Å; K536-F538 WeakPolarHBondContact O-CD2 3.43Å; K536-F538 VanDerWaalsContact O-CE2 3.26Å; K536-F538 WeakPolarHBondContact O-CE2 3.33Å
537	A	87.2	Confident	85.6	Confident	34 Å²	34	73.9 Å²	73.9	28%	0.281	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	144.3	-179.1	0	0	0	0	0	112.5	K527 Y529 K530 G535	K527-A537 HydrophobicContact CB-CB 3.62Å; K527-A537 HydrophobicContact CD-CB 4.11Å; Y529-A537 CarbonylContact O-C 3.23Å; Y529-A537 WeakPolarHBondContact O-CA 3.45Å; K530-A537 HydrophobicContact CG-CB 4.05Å; G535-A537 PolarHBondContact O-N 3.21Å
538	F	85.8	Confident	85.5	Confident	40 Å²	40	72.9 Å²	72.9	18%	0.175	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.7	-177.8	-57.6	-86	0	0	0	112.1	K527 P528 Y529 C531 K536 T543 L544 H547	K527-F538 CarbonylContact C-O 3.24Å; K527-F538 WeakPolarHBondContact CA-O 3.3Å; P528-F538 WeakPolarHBondContact CD-O 3.27Å; Y529-F538 PolarHBondContact N-O 3.45Å; Y529-F538 VanDerWaalsContact N-O 3.16Å; Y529-F538 PolarHBondContact O-N 2.82Å; C531-F538 HydrophobicContact CB-CE2 4.46Å; K536-F538 HydrophobicContact CB-CE2 3.92Å; K536-F538 HydrophobicContact CB-CZ 4Å; K536-F538 WeakPolarHBondContact O-CD2 3.43Å; K536-F538 VanDerWaalsContact O-CE2 3.26Å; K536-F538 WeakPolarHBondContact O-CE2 3.33Å; F538-T543 HydrophobicContact CD1-CG2 3.5Å; F538-T543 VanDerWaalsContact CD1-CG2 3.5Å; F538-T543 HydrophobicContact CE1-CG2 4.04Å; F538-T543 HydrophobicContact CG-CG2 4.24Å; F538-L544 HydrophobicContact CD2-CB 4Å; F538-L544 HydrophobicContact CD2-CD1 3.94Å; F538-L544 HydrophobicContact CE2-CD1 4.06Å; F538-L544 HydrophobicContact CG-CB 4.49Å; F538-H547 HydrophobicContact CE1-CB 4.28Å; F538-H547 HydrophobicContact CE2-CB 3.95Å; F538-H547 AromaticContact CE2-CD2 3.35Å; F538-H547 WeakPolarHBondContact CE2-CD2 3.46Å; F538-H547 AromaticContact CE2-CG 3.71Å; F538-H547 HydrophobicContact CZ-CB 3.63Å; F538-H547 AromaticContact CZ-CD2 3.43Å; F538-H547 VanDerWaalsContact CZ-CD2 3.43Å; F538-H547 WeakPolarHBondContact CZ-CD2 3.49Å; F538-H547 AromaticContact CZ-CG 3.37Å; F538-H547 AromaticContact CZ-ND1 4Å
539	F	82.1	Confident	85.6	Confident	57 Å²	57	71.6 Å²	71.6	25%	0.25	37%	0.366	C	S	.	.	S	Bend	trans	-73	-23.4	175.6	-67	-73.3	0	0	0	113.9	V521 V526 K527 Y529	V521-F539 HydrophobicContact CG1-CD1 4.33Å; V526-F539 WeakPolarHBondContact O-CD1 3.2Å; K527-F539 HydrophobicContact CD-CE2 4.35Å; K527-F539 HydrophobicContact CD-CZ 4.33Å; K527-F539 HydrophobicContact CG-CD1 3.82Å; K527-F539 HydrophobicContact CG-CD2 4.17Å; K527-F539 HydrophobicContact CG-CE1 3.66Å; K527-F539 HydrophobicContact CG-CE2 4.02Å; K527-F539 HydrophobicContact CG-CG 4.09Å; K527-F539 HydrophobicContact CG-CZ 3.76Å; Y529-F539 WeakPolarHBondContact CE2-O 3.41Å
540	W	84.2	Confident	85.4	Confident	110 Å²	110	71.4 Å²	71.4	42%	0.417	37%	0.371	S	S	.	.	S	Bend	trans	-135	137.9	-176.3	-49.8	-45	0	0	0	112.2	I522 S542 T543 L544	I522-W540 HydrophobicContact CD1-CZ2 4.42Å; W540-S542 VanDerWaalsContact C-N 3.28Å; W540-S542 PolarHBondContact O-N 3.44Å; W540-T543 WeakPolarHBondContact O-CB 3.5Å; W540-T543 PolarHBondContact O-N 3.35Å; W540-L544 PolarHBondContact O-N 3.13Å
541	S	85.2	Confident	85.2	Confident	62 Å²	62	68.9 Å²	68.9	43%	0.434	36%	0.361	S	S	.	.	H	α-helix	trans	-56.2	-39.1	177.4	55.8	0	0	0	0	113	Y529 T543 L544 T545	Y529-S541 VanDerWaalsContact CD2-N 3.28Å; S541-T543 PolarHBondContact O-N 2.8Å; S541-L544 CarbonylContact O-C 3.35Å; S541-L544 WeakPolarHBondContact O-CB 3.47Å; S541-L544 PolarHBondContact O-N 3.04Å; S541-L544 VanDerWaalsContact O-N 3.12Å; S541-T545 PolarHBondContact O-N 3.43Å; S541-T545 PolarHBondContact O-OG1 3.43Å; S541-T545 VanDerWaalsContact O-OG1 3.04Å
542	S	85.4	Confident	84.7	Confident	66 Å²	66	72.5 Å²	72.5	46%	0.462	38%	0.383	S	S	.	.	H	α-helix	trans	-63.3	-26.4	177.4	56.9	0	0	0	0	113.7	W540 K546	W540-S542 VanDerWaalsContact C-N 3.28Å; W540-S542 PolarHBondContact O-N 3.44Å; S542-K546 VanDerWaalsContact O-CG 3.31Å; S542-K546 WeakPolarHBondContact O-CG 3.42Å; S542-K546 PolarHBondContact O-N 2.97Å
543	T	84.7	Confident	84.1	Confident	50 Å²	50	67.4 Å²	67.4	31%	0.307	37%	0.373	S	S	.	.	H	α-helix	trans	-77.5	-41.3	173.6	-50.2	0	0	0	0	110.3	F538 W540 S541 K546 H547	F538-T543 HydrophobicContact CD1-CG2 3.5Å; F538-T543 VanDerWaalsContact CD1-CG2 3.5Å; F538-T543 HydrophobicContact CE1-CG2 4.04Å; F538-T543 HydrophobicContact CG-CG2 4.24Å; W540-T543 WeakPolarHBondContact O-CB 3.5Å; W540-T543 PolarHBondContact O-N 3.35Å; S541-T543 PolarHBondContact O-N 2.8Å; T543-K546 PolarHBondContact O-N 3.46Å; T543-H547 WeakPolarHBondContact O-CB 3.17Å; T543-H547 PolarHBondContact O-N 3.18Å
544	L	87	Confident	83.8	Confident	24 Å²	24	67.2 Å²	67.2	13%	0.126	37%	0.372	C	S	.	.	H	α-helix	trans	-59.6	-46.2	171.7	174.3	62.6	0	0	0	111.6	K530 C531 F538 W540 S541 K546 H547 K548	K530-L544 WeakPolarHBondContact O-CD2 3.33Å; C531-L544 HydrophobicContact CB-CD1 3.57Å; F538-L544 HydrophobicContact CD2-CB 4Å; F538-L544 HydrophobicContact CD2-CD1 3.94Å; F538-L544 HydrophobicContact CE2-CD1 4.06Å; F538-L544 HydrophobicContact CG-CB 4.49Å; W540-L544 PolarHBondContact O-N 3.13Å; S541-L544 CarbonylContact O-C 3.35Å; S541-L544 WeakPolarHBondContact O-CB 3.47Å; S541-L544 PolarHBondContact O-N 3.04Å; S541-L544 VanDerWaalsContact O-N 3.12Å; L544-K546 VanDerWaalsContact C-N 3.33Å; L544-K546 PolarHBondContact O-N 3.16Å; L544-H547 CarbonylContact O-C 3.57Å; L544-H547 WeakPolarHBondContact O-CA 3.46Å; L544-H547 WeakPolarHBondContact O-CB 3.34Å; L544-H547 PolarHBondContact O-N 2.86Å; L544-K548 HydrophobicContact CD1-CG 4.26Å; L544-K548 PolarHBondContact O-N 3.26Å
545	T	85.7	Confident	83.3	Confident	81 Å²	81	69.4 Å²	69.4	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-59.5	-42.1	176.5	-50.8	0	0	0	0	111.9	S541 H547	S541-T545 PolarHBondContact O-N 3.43Å; S541-T545 PolarHBondContact O-OG1 3.43Å; S541-T545 VanDerWaalsContact O-OG1 3.04Å; T545-H547 VanDerWaalsContact C-N 3.29Å; T545-H547 PolarHBondContact O-N 3.13Å
546	K	84.5	Confident	83	Confident	105 Å²	105	70 Å²	70	46%	0.457	37%	0.371	S	S	.	.	H	α-helix	trans	-67.4	-29.1	174.2	-74.7	175.8	-179.2	-175	0	113	S542 T543 L544	S542-K546 VanDerWaalsContact O-CG 3.31Å; S542-K546 WeakPolarHBondContact O-CG 3.42Å; S542-K546 PolarHBondContact O-N 2.97Å; T543-K546 PolarHBondContact O-N 3.46Å; L544-K546 VanDerWaalsContact C-N 3.33Å; L544-K546 PolarHBondContact O-N 3.16Å
547	H	85.5	Confident	82.4	Confident	18 Å²	18	67.3 Å²	67.3	8%	0.083	36%	0.358	C	S	.	.	H	α-helix	trans	-75.3	-41.1	177	172.8	55.6	0	0	0	112	C534 F538 T543 L544 T545 R549 I550 H551	C534-H547 PolarHBondContact SG-NE2 3.12Å; F538-H547 HydrophobicContact CE1-CB 4.28Å; F538-H547 HydrophobicContact CE2-CB 3.95Å; F538-H547 AromaticContact CE2-CD2 3.35Å; F538-H547 WeakPolarHBondContact CE2-CD2 3.46Å; F538-H547 AromaticContact CE2-CG 3.71Å; F538-H547 HydrophobicContact CZ-CB 3.63Å; F538-H547 AromaticContact CZ-CD2 3.43Å; F538-H547 VanDerWaalsContact CZ-CD2 3.43Å; F538-H547 WeakPolarHBondContact CZ-CD2 3.49Å; F538-H547 AromaticContact CZ-CG 3.37Å; F538-H547 AromaticContact CZ-ND1 4Å; T543-H547 WeakPolarHBondContact O-CB 3.17Å; T543-H547 PolarHBondContact O-N 3.18Å; L544-H547 CarbonylContact O-C 3.57Å; L544-H547 WeakPolarHBondContact O-CA 3.46Å; L544-H547 WeakPolarHBondContact O-CB 3.34Å; L544-H547 PolarHBondContact O-N 2.86Å; T545-H547 VanDerWaalsContact C-N 3.29Å; T545-H547 PolarHBondContact O-N 3.13Å; H547-R549 PolarHBondContact O-N 2.85Å; H547-I550 VanDerWaalsContact O-CB 3.24Å; H547-I550 WeakPolarHBondContact O-CB 3.34Å; H547-I550 WeakPolarHBondContact O-CG1 3.42Å; H547-I550 PolarHBondContact O-N 3.1Å; H547-H551 AromaticContact CE1-CE1 3.94Å; H547-H551 AromaticContact CE1-NE2 3.57Å; H547-H551 AromaticContact NE2-CE1 3.95Å; H547-H551 AromaticContact NE2-NE2 3.22Å; H547-H551 PolarHBondContact NE2-NE2 3.11Å
548	K	84.3	Confident	81.9	Confident	79 Å²	79	72.9 Å²	72.9	34%	0.343	38%	0.376	S	S	.	.	H	α-helix	trans	-56.1	-31.8	176.1	-73.5	-162.4	170	-149.3	0	113.4	L544 I550 H551 T552	L544-K548 HydrophobicContact CD1-CG 4.26Å; L544-K548 PolarHBondContact O-N 3.26Å; K548-I550 PolarHBondContact O-N 2.96Å; K548-I550 VanDerWaalsContact O-N 3.12Å; K548-H551 PolarHBondContact O-N 3.38Å; K548-T552 PolarHBondContact O-N 2.87Å; K548-T552 PolarHBondContact O-OG1 3.12Å
549	R	84.8	Confident	81.5	Confident	44 Å²	44	71.9 Å²	71.9	17%	0.166	37%	0.371	C	S	.	.	H	α-helix	trans	-61	-16.3	172.7	-64.4	-175.7	178.9	165.4	-0.6	115.1	H547 G553 E554 Y557	H547-R549 PolarHBondContact O-N 2.85Å; R549-G553 CarbonylContact O-C 3.57Å; R549-G553 PolarHBondContact O-N 3.19Å; R549-E554 HydrophobicContact CB-CB 4.19Å; R549-E554 HydrophobicContact CG-CB 4.02Å; R549-E554 IonicContact NE-OE2 3.71Å; R549-E554 PolarHBondContact O-N 3.08Å; R549-Y557 VanDerWaalsContact NH1-CE2 3.32Å; R549-Y557 PolarHBondContact NH1-OH 3.23Å
550	I	82	Confident	80.9	Confident	93 Å²	93	78.6 Å²	78.6	48%	0.477	40%	0.403	S	S	.	.	H	α-helix	trans	-76.2	-37.2	173.8	-56.3	177.1	0	0	0	109.6	H547 K548	H547-I550 VanDerWaalsContact O-CB 3.24Å; H547-I550 WeakPolarHBondContact O-CB 3.34Å; H547-I550 WeakPolarHBondContact O-CG1 3.42Å; H547-I550 PolarHBondContact O-N 3.1Å; K548-I550 PolarHBondContact O-N 2.96Å; K548-I550 VanDerWaalsContact O-N 3.12Å
551	H	81.6	Confident	80	Confident	80 Å²	80	79.9 Å²	79.9	37%	0.37	41%	0.412	S	S	.	.	H	α-helix	trans	-77.7	-39.7	177.7	-54.9	-51.4	0	0	0	112.1	C531 E533 C534 H547 K548 G553	C531-H551 PolarHBondContact SG-NE2 3.12Å; C531-H551 VanDerWaalsContact SG-NE2 3.38Å; E533-H551 IonicContact OE2-CD2 3.24Å; E533-H551 PolarHBondContact OE2-CD2 3.36Å; E533-H551 IonicContact OE2-CG 3.57Å; C534-H551 PolarHBondContact SG-NE2 3.06Å; C534-H551 VanDerWaalsContact SG-NE2 3.38Å; H547-H551 AromaticContact CE1-CE1 3.94Å; H547-H551 AromaticContact CE1-NE2 3.57Å; H547-H551 AromaticContact NE2-CE1 3.95Å; H547-H551 AromaticContact NE2-NE2 3.22Å; H547-H551 PolarHBondContact NE2-NE2 3.11Å; K548-H551 PolarHBondContact O-N 3.38Å; H551-G553 VanDerWaalsContact C-N 3.33Å; H551-G553 PolarHBondContact O-N 3.2Å
552	T	79.9	Confident	79.2	Confident	77 Å²	77	82 Å²	82	47%	0.472	41%	0.413	S	S	.	.	S	Bend	trans	-83.3	-4.2	178.8	64.5	0	0	0	0	114.4	K548 E554	K548-T552 PolarHBondContact O-N 2.87Å; K548-T552 PolarHBondContact O-OG1 3.12Å; T552-E554 PolarHBondContact O-N 3.43Å; T552-E554 VanDerWaalsContact O-N 3.1Å; T552-E554 WeakPolarHBondContact OG1-CG 3.29Å
553	G	75.8	Confident	78.3	Confident	52 Å²	52	81.9 Å²	81.9	54%	0.536	42%	0.422	S	S	.	.			trans	65.7	5.4	-175.8	0	0	0	0	0	115.4	R549 H551 Q555	R549-G553 CarbonylContact O-C 3.57Å; R549-G553 PolarHBondContact O-N 3.19Å; H551-G553 VanDerWaalsContact C-N 3.33Å; H551-G553 PolarHBondContact O-N 3.2Å; G553-Q555 PolarHBondContact O-N 3.17Å
554	E	76.8	Confident	77.9	Confident	105 Å²	105	84.2 Å²	84.2	49%	0.491	43%	0.428	S	S	.	.			trans	-60	118.4	-174.4	-84.6	-177.4	-168.8	0	0	113.4	R549 T552 P556	R549-E554 HydrophobicContact CB-CB 4.19Å; R549-E554 HydrophobicContact CG-CB 4.02Å; R549-E554 IonicContact NE-OE2 3.71Å; R549-E554 PolarHBondContact O-N 3.08Å; T552-E554 PolarHBondContact O-N 3.43Å; T552-E554 VanDerWaalsContact O-N 3.1Å; T552-E554 WeakPolarHBondContact OG1-CG 3.29Å; E554-P556 VanDerWaalsContact C-CD 3.4Å; E554-P556 WeakPolarHBondContact O-CD 3.17Å
555	Q	76.8	Confident	77.3	Confident	97 Å²	97	84.4 Å²	84.4	45%	0.453	43%	0.433	S	S	.	.			trans	-115.2	74.4	173.2	-61.9	-167.8	-7	0	0	112.1	G553 Y557 A565 F566 N567	G553-Q555 PolarHBondContact O-N 3.17Å; Q555-Y557 PolarHBondContact O-N 3.36Å; Q555-A565 HydrophobicContact CB-CB 3.77Å; Q555-A565 PolarHBondContact OE1-O 2.83Å; Q555-F566 CarbonylContact C-O 3.58Å; Q555-F566 WeakPolarHBondContact CA-O 3.35Å; Q555-N567 HydrophobicContact CG-CB 4.5Å
556	P	77.1	Confident	76.8	Confident	68 Å²	68	82.1 Å²	82.1	44%	0.442	42%	0.417	S	S	.	.			trans	-75.7	-6.7	-175	31.1	-36.4	0	0	0	114.2	E554	E554-P556 VanDerWaalsContact C-CD 3.4Å; E554-P556 WeakPolarHBondContact O-CD 3.17Å
557	Y	74.5	Confident	76.3	Confident	72 Å²	72	79.2 Å²	79.2	28%	0.282	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	90	179.3	-53.8	-69	0	0	0	110	R549 Q555 F566 R568 S569	R549-Y557 VanDerWaalsContact NH1-CE2 3.32Å; R549-Y557 PolarHBondContact NH1-OH 3.23Å; Q555-Y557 PolarHBondContact O-N 3.36Å; Y557-F566 WeakPolarHBondContact CB-O 3.32Å; Y557-F566 WeakPolarHBondContact CD2-O 3.49Å; Y557-F566 PolarHBondContact N-O 3.09Å; Y557-F566 PolarHBondContact O-N 2.83Å; Y557-R568 VanDerWaalsContact CD2-C 3.46Å; Y557-S569 VanDerWaalsContact CE2-N 3.34Å
558	K	75.9	Confident	75.7	Confident	151 Å²	151	83.7 Å²	83.7	66%	0.657	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	146.8	176.5	-60.4	-170	176.6	-175.8	0	111.5	K564 A565	K558-K564 CarbonylContact C-O 3.59Å; K558-A565 HydrophobicContact CG-CB 3.98Å
559	W	77.1	Confident	75.2	Confident	19 Å²	19	82.6 Å²	82.6	7%	0.072	42%	0.424	C	S	.	.			trans	-101.2	101.2	167.2	-167.8	2.6	0	0	0	109.9	K561 F562 G563 K564 L572 D575 K576 H579	W559-K561 PolarHBondContact O-N 3.15Å; W559-K561 VanDerWaalsContact O-N 3.11Å; W559-F562 HydrophobicContact CD2-CB 4.26Å; W559-F562 HydrophobicContact CD2-CD2 4.01Å; W559-F562 AromaticContact CE2-CD2 3.67Å; W559-F562 HydrophobicContact CE3-CB 4.02Å; W559-F562 HydrophobicContact CE3-CD2 4.04Å; W559-F562 HydrophobicContact CE3-CG 4.4Å; W559-F562 AromaticContact CH2-CD2 3.38Å; W559-F562 HydrophobicContact CH2-CD2 3.38Å; W559-F562 AromaticContact CH2-CE2 3.67Å; W559-F562 HydrophobicContact CH2-CE2 3.67Å; W559-F562 HydrophobicContact CH2-CG 4.27Å; W559-F562 AromaticContact CZ2-CD2 3.37Å; W559-F562 HydrophobicContact CZ2-CD2 3.37Å; W559-F562 AromaticContact CZ2-CE2 3.65Å; W559-F562 HydrophobicContact CZ2-CE2 3.65Å; W559-F562 HydrophobicContact CZ3-CB 4.27Å; W559-F562 AromaticContact CZ3-CD2 3.73Å; W559-F562 HydrophobicContact CZ3-CD2 3.73Å; W559-F562 HydrophobicContact CZ3-CE2 4.41Å; W559-F562 HydrophobicContact CZ3-CG 4.22Å; W559-F562 PolarHBondContact O-N 3.03Å; W559-F562 VanDerWaalsContact O-N 3.1Å; W559-G563 PolarHBondContact O-N 2.83Å; W559-K564 HydrophobicContact CE3-CD 4.43Å; W559-K564 PolarHBondContact N-O 2.87Å; W559-L572 HydrophobicContact CB-CD1 3.58Å; W559-L572 HydrophobicContact CG-CD1 4.01Å; W559-D575 VanDerWaalsContact CE3-OD2 3.24Å; W559-D575 WeakPolarHBondContact CZ3-OD2 3.47Å; W559-K576 HydrophobicContact CD2-CG 4.21Å; W559-K576 HydrophobicContact CZ2-CG 4.15Å; W559-H579 HydrophobicContact CH2-CB 3.7Å; W559-H579 AromaticContact CH2-CD2 3.43Å; W559-H579 VanDerWaalsContact CH2-CD2 3.43Å; W559-H579 WeakPolarHBondContact CH2-CD2 3.36Å; W559-H579 AromaticContact CH2-CG 3.55Å; W559-H579 AromaticContact CZ2-CD2 3.61Å; W559-H579 HydrophobicContact CZ3-CB 4.5Å
560	E	71.1	Confident	74.9	Confident	197 Å²	197	83.2 Å²	83.2	92%	0.921	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-32.4	-175.1	-66.5	166.7	162.7	0	0	113.9	F562	E560-F562 PolarHBondContact O-N 3.07Å
561	K	65.3	Low	74.7	Confident	137 Å²	137	82.6 Å²	82.6	60%	0.596	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-23	-179.2	-165.7	-179.1	174.3	-166	0	114.2	W559	W559-K561 PolarHBondContact O-N 3.15Å; W559-K561 VanDerWaalsContact O-N 3.11Å
562	F	66.5	Low	74.4	Confident	106 Å²	106	79.7 Å²	79.7	47%	0.465	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.2	8.3	-172.8	-74.5	-83.4	0	0	0	114.7	W559 E560 K564 H579	W559-F562 HydrophobicContact CD2-CB 4.26Å; W559-F562 HydrophobicContact CD2-CD2 4.01Å; W559-F562 AromaticContact CE2-CD2 3.67Å; W559-F562 HydrophobicContact CE3-CB 4.02Å; W559-F562 HydrophobicContact CE3-CD2 4.04Å; W559-F562 HydrophobicContact CE3-CG 4.4Å; W559-F562 AromaticContact CH2-CD2 3.38Å; W559-F562 HydrophobicContact CH2-CD2 3.38Å; W559-F562 AromaticContact CH2-CE2 3.67Å; W559-F562 HydrophobicContact CH2-CE2 3.67Å; W559-F562 HydrophobicContact CH2-CG 4.27Å; W559-F562 AromaticContact CZ2-CD2 3.37Å; W559-F562 HydrophobicContact CZ2-CD2 3.37Å; W559-F562 AromaticContact CZ2-CE2 3.65Å; W559-F562 HydrophobicContact CZ2-CE2 3.65Å; W559-F562 HydrophobicContact CZ3-CB 4.27Å; W559-F562 AromaticContact CZ3-CD2 3.73Å; W559-F562 HydrophobicContact CZ3-CD2 3.73Å; W559-F562 HydrophobicContact CZ3-CE2 4.41Å; W559-F562 HydrophobicContact CZ3-CG 4.22Å; W559-F562 PolarHBondContact O-N 3.03Å; W559-F562 VanDerWaalsContact O-N 3.1Å; E560-F562 PolarHBondContact O-N 3.07Å; F562-K564 PolarHBondContact O-N 3.41Å; F562-H579 AromaticContact CE2-CE1 3.61Å; F562-H579 AromaticContact CE2-NE2 3.28Å; F562-H579 VanDerWaalsContact CE2-NE2 3.28Å; F562-H579 WeakPolarHBondContact CE2-NE2 3.42Å; F562-H579 AromaticContact CZ-CE1 3.43Å; F562-H579 VanDerWaalsContact CZ-CE1 3.43Å; F562-H579 WeakPolarHBondContact CZ-CE1 3.35Å; F562-H579 AromaticContact CZ-NE2 3.54Å
563	G	67.6	Low	74.3	Confident	64 Å²	64	79.7 Å²	79.7	66%	0.66	42%	0.418	S	S	*	.			trans	69	-19.7	178.5	0	0	0	0	0	116.2	W559 A565	W559-G563 PolarHBondContact O-N 2.83Å; G563-A565 PolarHBondContact O-N 2.75Å
564	K	75.4	Confident	74.5	Confident	99 Å²	99	81.1 Å²	81.1	43%	0.43	42%	0.416	S	S	.	.			trans	-53.2	131.2	179.1	-69.5	-175.7	-176.6	173.8	0	111.5	K558 W559 F562 F566 D575	K558-K564 CarbonylContact C-O 3.59Å; W559-K564 HydrophobicContact CE3-CD 4.43Å; W559-K564 PolarHBondContact N-O 2.87Å; F562-K564 PolarHBondContact O-N 3.41Å; K564-F566 HydrophobicContact CB-CE2 3.83Å; K564-F566 HydrophobicContact CB-CZ 4.07Å; K564-F566 HydrophobicContact CD-CZ 4.08Å; K564-D575 VanDerWaalsContact CD-OD2 3.27Å; K564-D575 WeakPolarHBondContact CD-OD2 3.4Å; K564-D575 VanDerWaalsContact NZ-CG 3.34Å; K564-D575 IonicContact NZ-OD1 3.15Å; K564-D575 PolarHBondContact NZ-OD1 3.06Å; K564-D575 IonicContact NZ-OD2 2.78Å; K564-D575 PolarHBondContact NZ-OD2 3.19Å
565	A	74.9	Confident	74.6	Confident	28 Å²	28	77.8 Å²	77.8	23%	0.231	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	149.5	176.7	0	0	0	0	0	110.8	Q555 K558 G563	Q555-A565 HydrophobicContact CB-CB 3.77Å; Q555-A565 PolarHBondContact OE1-O 2.83Å; K558-A565 HydrophobicContact CG-CB 3.98Å; G563-A565 PolarHBondContact O-N 2.75Å
566	F	75.4	Confident	74.7	Confident	34 Å²	34	76.8 Å²	76.8	15%	0.149	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	142.4	-175.4	-59.4	-88.7	0	0	0	111.5	Q555 Y557 K564 R568 H571 L572 D575	Q555-F566 CarbonylContact C-O 3.58Å; Q555-F566 WeakPolarHBondContact CA-O 3.35Å; Y557-F566 WeakPolarHBondContact CB-O 3.32Å; Y557-F566 WeakPolarHBondContact CD2-O 3.49Å; Y557-F566 PolarHBondContact N-O 3.09Å; Y557-F566 PolarHBondContact O-N 2.83Å; K564-F566 HydrophobicContact CB-CE2 3.83Å; K564-F566 HydrophobicContact CB-CZ 4.07Å; K564-F566 HydrophobicContact CD-CZ 4.08Å; F566-R568 VanDerWaalsContact C-N 3.31Å; F566-H571 HydrophobicContact CB-CB 4.48Å; F566-H571 HydrophobicContact CD1-CB 3.65Å; F566-H571 HydrophobicContact CE1-CB 4.2Å; F566-H571 HydrophobicContact CG-CB 4.27Å; F566-L572 HydrophobicContact CD2-CB 3.78Å; F566-L572 HydrophobicContact CD2-CD1 3.86Å; F566-L572 HydrophobicContact CD2-CG 4.39Å; F566-L572 HydrophobicContact CE2-CB 4.28Å; F566-L572 HydrophobicContact CE2-CD1 3.8Å; F566-L572 HydrophobicContact CG-CB 4.28Å; F566-D575 HydrophobicContact CE1-CB 4.4Å; F566-D575 HydrophobicContact CE2-CB 4.45Å; F566-D575 HydrophobicContact CZ-CB 3.77Å
567	N	73.6	Confident	74.9	Confident	43 Å²	43	77.8 Å²	77.8	23%	0.23	40%	0.397	C	S	.	.	S	Bend	trans	-75	-19	172.6	60.9	17.1	0	0	0	113.2	Q555	Q555-N567 HydrophobicContact CG-CB 4.5Å
568	R	72.6	Confident	75.1	Confident	112 Å²	112	76.9 Å²	76.9	42%	0.423	40%	0.399	S	S	.	.	S	Bend	trans	-128.5	129.6	-179.4	-70.3	177.4	179.5	-171.8	2	111.8	Y557 F566 S570 H571	Y557-R568 VanDerWaalsContact CD2-C 3.46Å; F566-R568 VanDerWaalsContact C-N 3.31Å; R568-S570 PolarHBondContact O-N 3.4Å; R568-H571 PolarHBondContact O-N 3.04Å; R568-H571 VanDerWaalsContact O-N 3.13Å
569	S	75.3	Confident	75.2	Confident	56 Å²	56	71.3 Å²	71.3	39%	0.392	38%	0.375	S	S	.	.	H	α-helix	trans	-60.8	-27.5	176	63.9	0	0	0	0	113.4	Y557 H571 L572 T573	Y557-S569 VanDerWaalsContact CE2-N 3.34Å; S569-H571 VanDerWaalsContact C-N 3.35Å; S569-L572 PolarHBondContact O-N 3.32Å; S569-T573 PolarHBondContact O-N 3.05Å; S569-T573 PolarHBondContact O-OG1 2.77Å
570	S	77.5	Confident	75	Confident	57 Å²	57	77.5 Å²	77.5	40%	0.399	40%	0.398	S	S	.	.	H	α-helix	trans	-64.4	-38	176.7	50.8	0	0	0	0	112.2	R568 T573 T574	R568-S570 PolarHBondContact O-N 3.4Å; S570-T573 VanDerWaalsContact CA-OG1 3.32Å; S570-T573 WeakPolarHBondContact CA-OG1 3.36Å; S570-T573 PolarHBondContact O-N 3.3Å; S570-T573 PolarHBondContact O-OG1 3.27Å; S570-T574 PolarHBondContact O-N 3.33Å; S570-T574 PolarHBondContact O-OG1 3.45Å
571	H	77	Confident	75.3	Confident	80 Å²	80	76 Å²	76	37%	0.37	38%	0.384	S	S	.	.	H	α-helix	trans	-69.5	-42	178.3	-59.6	178.6	0	0	0	110.3	F566 R568 S569 T573 T574 D575	F566-H571 HydrophobicContact CB-CB 4.48Å; F566-H571 HydrophobicContact CD1-CB 3.65Å; F566-H571 HydrophobicContact CE1-CB 4.2Å; F566-H571 HydrophobicContact CG-CB 4.27Å; R568-H571 PolarHBondContact O-N 3.04Å; R568-H571 VanDerWaalsContact O-N 3.13Å; S569-H571 VanDerWaalsContact C-N 3.35Å; H571-T573 VanDerWaalsContact C-N 3.31Å; H571-T573 PolarHBondContact O-N 2.92Å; H571-T574 PolarHBondContact O-N 3.26Å; H571-T574 VanDerWaalsContact O-N 3.14Å; H571-D575 WeakPolarHBondContact O-CB 3.24Å; H571-D575 PolarHBondContact O-N 3.02Å
572	L	77.2	Confident	75.8	Confident	20 Å²	20	75 Å²	75	11%	0.105	38%	0.381	C	S	.	.	H	α-helix	trans	-58.1	-39.7	172.2	177.4	62	0	0	0	112.6	W559 F566 S569 K576	W559-L572 HydrophobicContact CB-CD1 3.58Å; W559-L572 HydrophobicContact CG-CD1 4.01Å; F566-L572 HydrophobicContact CD2-CB 3.78Å; F566-L572 HydrophobicContact CD2-CD1 3.86Å; F566-L572 HydrophobicContact CD2-CG 4.39Å; F566-L572 HydrophobicContact CE2-CB 4.28Å; F566-L572 HydrophobicContact CE2-CD1 3.8Å; F566-L572 HydrophobicContact CG-CB 4.28Å; S569-L572 PolarHBondContact O-N 3.32Å; L572-K576 HydrophobicContact CD1-CD 4.3Å; L572-K576 HydrophobicContact CD1-CG 4.43Å; L572-K576 HydrophobicContact CG-CD 4.41Å; L572-K576 WeakPolarHBondContact O-CB 3.45Å; L572-K576 VanDerWaalsContact O-CG 3.28Å; L572-K576 WeakPolarHBondContact O-CG 3.3Å; L572-K576 PolarHBondContact O-N 3.2Å; L572-K576 VanDerWaalsContact O-N 3.1Å
573	T	77.4	Confident	75.9	Confident	77 Å²	77	73.2 Å²	73.2	47%	0.472	38%	0.376	S	S	.	.	H	α-helix	trans	-70.1	-37.4	174.6	43.4	0	0	0	0	112.7	S569 S570 H571 I577	S569-T573 PolarHBondContact O-N 3.05Å; S569-T573 PolarHBondContact O-OG1 2.77Å; S570-T573 VanDerWaalsContact CA-OG1 3.32Å; S570-T573 WeakPolarHBondContact CA-OG1 3.36Å; S570-T573 PolarHBondContact O-N 3.3Å; S570-T573 PolarHBondContact O-OG1 3.27Å; H571-T573 VanDerWaalsContact C-N 3.31Å; H571-T573 PolarHBondContact O-N 2.92Å; T573-I577 WeakPolarHBondContact O-CB 3.44Å; T573-I577 WeakPolarHBondContact O-CD1 3.13Å; T573-I577 WeakPolarHBondContact O-CG1 3.21Å; T573-I577 PolarHBondContact O-N 3.13Å
574	T	79.2	Confident	76	Confident	81 Å²	81	76.7 Å²	76.7	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-66.5	-47.8	176.4	-54	0	0	0	0	111.2	S570 H571 K576 I577 T578	S570-T574 PolarHBondContact O-N 3.33Å; S570-T574 PolarHBondContact O-OG1 3.45Å; H571-T574 PolarHBondContact O-N 3.26Å; H571-T574 VanDerWaalsContact O-N 3.14Å; T574-K576 VanDerWaalsContact C-N 3.29Å; T574-K576 PolarHBondContact O-N 3.4Å; T574-I577 CarbonylContact O-C 3.59Å; T574-I577 WeakPolarHBondContact O-CA 3.43Å; T574-I577 PolarHBondContact O-N 3.28Å; T574-T578 HydrophobicContact CG2-CG2 4.45Å; T574-T578 PolarHBondContact O-N 3.06Å; T574-T578 PolarHBondContact O-OG1 2.83Å
575	D	79	Confident	75.1	Confident	35 Å²	35	80 Å²	80	19%	0.187	40%	0.396	C	S	.	.	H	α-helix	trans	-61.2	-36.5	178.6	-165.4	73.2	0	0	0	111.6	W559 K564 F566 H571 T578 H579	W559-D575 VanDerWaalsContact CE3-OD2 3.24Å; W559-D575 WeakPolarHBondContact CZ3-OD2 3.47Å; K564-D575 VanDerWaalsContact CD-OD2 3.27Å; K564-D575 WeakPolarHBondContact CD-OD2 3.4Å; K564-D575 VanDerWaalsContact NZ-CG 3.34Å; K564-D575 IonicContact NZ-OD1 3.15Å; K564-D575 PolarHBondContact NZ-OD1 3.06Å; K564-D575 IonicContact NZ-OD2 2.78Å; K564-D575 PolarHBondContact NZ-OD2 3.19Å; F566-D575 HydrophobicContact CE1-CB 4.4Å; F566-D575 HydrophobicContact CE2-CB 4.45Å; F566-D575 HydrophobicContact CZ-CB 3.77Å; H571-D575 WeakPolarHBondContact O-CB 3.24Å; H571-D575 PolarHBondContact O-N 3.02Å; D575-T578 WeakPolarHBondContact CA-OG1 3.22Å; D575-T578 PolarHBondContact O-OG1 2.99Å; D575-T578 VanDerWaalsContact O-OG1 3.05Å; D575-H579 VanDerWaalsContact O-CB 3.26Å; D575-H579 WeakPolarHBondContact O-CB 3.34Å; D575-H579 PolarHBondContact O-N 3.07Å; D575-H579 VanDerWaalsContact O-N 3.08Å
576	K	80.1	Confident	73.7	Confident	77 Å²	77	87.5 Å²	87.5	34%	0.335	44%	0.438	S	S	.	.	H	α-helix	trans	-66.1	-41.3	169.5	-77.1	178.1	176.3	-175.6	0	112.7	W559 L572 T574 W580	W559-K576 HydrophobicContact CD2-CG 4.21Å; W559-K576 HydrophobicContact CZ2-CG 4.15Å; L572-K576 HydrophobicContact CD1-CD 4.3Å; L572-K576 HydrophobicContact CD1-CG 4.43Å; L572-K576 HydrophobicContact CG-CD 4.41Å; L572-K576 WeakPolarHBondContact O-CB 3.45Å; L572-K576 VanDerWaalsContact O-CG 3.28Å; L572-K576 WeakPolarHBondContact O-CG 3.3Å; L572-K576 PolarHBondContact O-N 3.2Å; L572-K576 VanDerWaalsContact O-N 3.1Å; T574-K576 VanDerWaalsContact C-N 3.29Å; T574-K576 PolarHBondContact O-N 3.4Å; K576-W580 WeakPolarHBondContact O-CB 3.45Å; K576-W580 PolarHBondContact O-N 3.46Å
577	I	80.6	Confident	73.7	Confident	89 Å²	89	90.2 Å²	90.2	46%	0.456	45%	0.453	S	S	.	.	H	α-helix	trans	-70.4	-39.2	-179.5	-71.7	163.6	0	0	0	111.4	T573 T574 R581	T573-I577 WeakPolarHBondContact O-CB 3.44Å; T573-I577 WeakPolarHBondContact O-CD1 3.13Å; T573-I577 WeakPolarHBondContact O-CG1 3.21Å; T573-I577 PolarHBondContact O-N 3.13Å; T574-I577 CarbonylContact O-C 3.59Å; T574-I577 WeakPolarHBondContact O-CA 3.43Å; T574-I577 PolarHBondContact O-N 3.28Å; I577-R581 VanDerWaalsContact O-CG 3.3Å; I577-R581 WeakPolarHBondContact O-CG 3.09Å; I577-R581 PolarHBondContact O-N 3.32Å
578	T	78.5	Confident	73.7	Confident	53 Å²	53	92.7 Å²	92.7	33%	0.325	47%	0.465	S	S	.	.	H	α-helix	trans	-65.3	-47.7	175	51.1	0	0	0	0	110.4	T574 D575 W580 R581 E582	T574-T578 HydrophobicContact CG2-CG2 4.45Å; T574-T578 PolarHBondContact O-N 3.06Å; T574-T578 PolarHBondContact O-OG1 2.83Å; D575-T578 WeakPolarHBondContact CA-OG1 3.22Å; D575-T578 PolarHBondContact O-OG1 2.99Å; D575-T578 VanDerWaalsContact O-OG1 3.05Å; T578-W580 PolarHBondContact O-N 3.26Å; T578-R581 WeakPolarHBondContact O-CA 3.48Å; T578-R581 WeakPolarHBondContact O-CB 3.48Å; T578-R581 PolarHBondContact O-N 3.25Å; T578-E582 WeakPolarHBondContact O-CG 3.49Å; T578-E582 PolarHBondContact O-N 3.06Å
579	H	78.6	Confident	73.7	Confident	33 Å²	33	91.6 Å²	91.6	15%	0.153	47%	0.467	C	S	.	.	H	α-helix	trans	-59.1	-41.6	176.3	-179.7	67.4	0	0	0	113.7	W559 F562 D575 R581 E582 I583	W559-H579 HydrophobicContact CH2-CB 3.7Å; W559-H579 AromaticContact CH2-CD2 3.43Å; W559-H579 VanDerWaalsContact CH2-CD2 3.43Å; W559-H579 WeakPolarHBondContact CH2-CD2 3.36Å; W559-H579 AromaticContact CH2-CG 3.55Å; W559-H579 AromaticContact CZ2-CD2 3.61Å; W559-H579 HydrophobicContact CZ3-CB 4.5Å; F562-H579 AromaticContact CE2-CE1 3.61Å; F562-H579 AromaticContact CE2-NE2 3.28Å; F562-H579 VanDerWaalsContact CE2-NE2 3.28Å; F562-H579 WeakPolarHBondContact CE2-NE2 3.42Å; F562-H579 AromaticContact CZ-CE1 3.43Å; F562-H579 VanDerWaalsContact CZ-CE1 3.43Å; F562-H579 WeakPolarHBondContact CZ-CE1 3.35Å; F562-H579 AromaticContact CZ-NE2 3.54Å; D575-H579 VanDerWaalsContact O-CB 3.26Å; D575-H579 WeakPolarHBondContact O-CB 3.34Å; D575-H579 PolarHBondContact O-N 3.07Å; D575-H579 VanDerWaalsContact O-N 3.08Å; H579-R581 VanDerWaalsContact C-N 3.3Å; H579-R581 PolarHBondContact O-N 2.77Å; H579-E582 PolarHBondContact O-N 3.15Å; H579-I583 VanDerWaalsContact NE2-CD1 3.25Å; H579-I583 WeakPolarHBondContact NE2-CD1 3.5Å; H579-I583 WeakPolarHBondContact O-CG1 3.44Å; H579-I583 PolarHBondContact O-N 3.41Å
580	W	71.8	Confident	73.6	Confident	149 Å²	149	93.7 Å²	93.7	56%	0.564	47%	0.471	S	S	*	.	H	α-helix	trans	-69	-26.1	174.7	-82.6	116.4	0	0	0	113.1	K576 T578 I583 L584	K576-W580 WeakPolarHBondContact O-CB 3.45Å; K576-W580 PolarHBondContact O-N 3.46Å; T578-W580 PolarHBondContact O-N 3.26Å; W580-I583 HydrophobicContact CE3-CG2 4.34Å; W580-I583 HydrophobicContact CZ3-CG2 4.4Å; W580-L584 WeakPolarHBondContact O-CB 3.41Å; W580-L584 WeakPolarHBondContact O-CD1 3.44Å; W580-L584 WeakPolarHBondContact O-CG 3.49Å; W580-L584 PolarHBondContact O-N 3.31Å
581	R	77.8	Confident	73.4	Confident	167 Å²	167	96 Å²	96	63%	0.63	48%	0.476	S	S	*	.	H	α-helix	trans	-74.5	-41.6	172	-75.7	171	173.7	-172.6	-4.5	111.8	I577 T578 H579 I583 L584 Q585	I577-R581 VanDerWaalsContact O-CG 3.3Å; I577-R581 WeakPolarHBondContact O-CG 3.09Å; I577-R581 PolarHBondContact O-N 3.32Å; T578-R581 WeakPolarHBondContact O-CA 3.48Å; T578-R581 WeakPolarHBondContact O-CB 3.48Å; T578-R581 PolarHBondContact O-N 3.25Å; H579-R581 VanDerWaalsContact C-N 3.3Å; H579-R581 PolarHBondContact O-N 2.77Å; R581-I583 VanDerWaalsContact C-N 3.34Å; R581-I583 PolarHBondContact O-N 2.98Å; R581-L584 CarbonylContact O-C 3.57Å; R581-L584 PolarHBondContact O-N 2.97Å; R581-L584 VanDerWaalsContact O-N 3.14Å; R581-Q585 WeakPolarHBondContact O-CG 3.41Å; R581-Q585 PolarHBondContact O-N 3.34Å
582	E	74.9	Confident	73.2	Confident	115 Å²	115	97.1 Å²	97.1	54%	0.537	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-42.8	174.6	-70	154.6	-163.1	0	0	111.1	T578 H579 L584 Q585	T578-E582 WeakPolarHBondContact O-CG 3.49Å; T578-E582 PolarHBondContact O-N 3.06Å; H579-E582 PolarHBondContact O-N 3.15Å; E582-L584 VanDerWaalsContact C-N 3.3Å; E582-L584 PolarHBondContact O-N 2.75Å; E582-Q585 PolarHBondContact O-N 3.25Å
583	I	70.4	Confident	72.9	Confident	68 Å²	68	102.6 Å²	102.6	35%	0.349	51%	0.51	S	S	.	.	H	α-helix	trans	-66.1	-28	174.8	-74	174.6	0	0	0	113.2	H579 W580 R581	H579-I583 VanDerWaalsContact NE2-CD1 3.25Å; H579-I583 WeakPolarHBondContact NE2-CD1 3.5Å; H579-I583 WeakPolarHBondContact O-CG1 3.44Å; H579-I583 PolarHBondContact O-N 3.41Å; W580-I583 HydrophobicContact CE3-CG2 4.34Å; W580-I583 HydrophobicContact CZ3-CG2 4.4Å; R581-I583 VanDerWaalsContact C-N 3.34Å; R581-I583 PolarHBondContact O-N 2.98Å
584	L	68.1	Low	72.5	Confident	138 Å²	138	104.5 Å²	104.5	72%	0.723	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	7	-179.3	-70.7	170.7	0	0	0	113.2	W580 R581 E582	W580-L584 WeakPolarHBondContact O-CB 3.41Å; W580-L584 WeakPolarHBondContact O-CD1 3.44Å; W580-L584 WeakPolarHBondContact O-CG 3.49Å; W580-L584 PolarHBondContact O-N 3.31Å; R581-L584 CarbonylContact O-C 3.57Å; R581-L584 PolarHBondContact O-N 2.97Å; R581-L584 VanDerWaalsContact O-N 3.14Å; E582-L584 VanDerWaalsContact C-N 3.3Å; E582-L584 PolarHBondContact O-N 2.75Å
585	Q	56.3	Low	72	Confident	168 Å²	168	106.5 Å²	106.5	79%	0.785	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	10.5	175.6	-72.9	-174.6	-51.2	0	0	112.9	R581 E582	R581-Q585 WeakPolarHBondContact O-CG 3.41Å; R581-Q585 PolarHBondContact O-N 3.34Å; E582-Q585 PolarHBondContact O-N 3.25Å
586	V	47.6	Very low	71.3	Confident	186 Å²	186	113 Å²	113	100%	1.127	54%	0.544	S	S	*	.			trans	-120.6	0	170.7	-176.2	0	0	0	0	108.2

Retrieved 586 of 586 residues in 788.6 ms (Link to these results)

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