A0A077YYG9_TRITR Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A077YYG9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 707 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	26.5	Very low	28	Very low	237 Å²	237	152.9 Å²	152.9	100%	1.167	84%	0.839	S	S	*	*				0	111.2	0	-87.3	164.6	54	0	0	108.9
2	I	31.4	Very low	27.9	Very low	171 Å²	171	153.3 Å²	153.3	88%	0.877	84%	0.836	S	S	*	*			trans	55.1	108.6	160.8	-50.9	178.5	0	0	0	119.1
3	Q	32.6	Very low	27.6	Very low	178 Å²	178	147.4 Å²	147.4	83%	0.832	82%	0.821	S	S	*	*			trans	-43	159.3	160.5	-77.2	163.5	-56.6	0	0	114.3
4	C	28.9	Very low	27.7	Very low	102 Å²	102	151.6 Å²	151.6	69%	0.689	83%	0.827	S	S	*	*			cis	-171	133.1	27.6	-129	0	0	0	0	111.8
5	R	31.6	Very low	28	Very low	219 Å²	219	151.3 Å²	151.3	83%	0.826	82%	0.822	S	S	*	*			trans	45.5	114.8	134	-63.7	-164.4	174	-173.6	-1.1	123
6	L	29.1	Very low	28	Very low	151 Å²	151	150.1 Å²	150.1	79%	0.791	83%	0.826	S	S	*	*				73.1	112.3	90.8	-90.5	105.3	0	0	0	114.3
7	S	26.2	Very low	27.8	Very low	102 Å²	102	150.1 Å²	150.1	71%	0.713	82%	0.824	S	S	*	*				86.4	138.3	60.6	77.6	0	0	0	0	116.2
8	C	24.1	Very low	27.8	Very low	122 Å²	122	151.1 Å²	151.1	82%	0.824	83%	0.828	S	S	*	*			trans	-28.1	160.8	-178.1	-58.3	0	0	0	0	121.5
9	V	26.9	Very low	27.6	Very low	135 Å²	135	150.9 Å²	150.9	82%	0.818	83%	0.825	S	S	*	*				170.1	139.8	116.8	158.4	0	0	0	0	113.1	V11	V9-V11 HydrophobicContact CG1-CG2 4.45Å
10	C	24.8	Very low	27.5	Very low	122 Å²	122	155.6 Å²	155.6	82%	0.824	83%	0.83	S	S	*	*			trans	-75.8	145.6	168.3	-62.5	0	0	0	0	113.3
11	V	26.1	Very low	27.4	Very low	143 Å²	143	154.5 Å²	154.5	87%	0.867	83%	0.829	S	S	*	*			trans	-150.5	148.4	152.9	-178.7	0	0	0	0	111.9	V9	V9-V11 HydrophobicContact CG1-CG2 4.45Å
12	I	26.1	Very low	27.5	Very low	157 Å²	157	149.6 Å²	149.6	81%	0.805	81%	0.812	S	S	*	*			trans	-91.7	149.5	-173.7	-71.7	164	0	0	0	113.4
13	A	24.6	Very low	27.5	Very low	77 Å²	77	146.1 Å²	146.1	64%	0.636	80%	0.803	S	S	*	*			trans	66.1	131.5	152	0	0	0	0	0	123.2
14	F	29.5	Very low	27.4	Very low	206 Å²	206	142.5 Å²	142.5	90%	0.904	80%	0.795	S	S	*	*				177.6	151.4	97.3	-116.2	-92.1	0	0	0	112.5
15	I	32.3	Very low	27.5	Very low	147 Å²	147	146.8 Å²	146.8	75%	0.754	80%	0.802	S	S	*	*			trans	-79.6	139.7	169.9	-66.7	167.3	0	0	0	109.5
16	C	27.8	Very low	27.3	Very low	132 Å²	132	142.3 Å²	142.3	89%	0.892	80%	0.795	S	S	*	*			trans	-154.5	120.7	149.5	-99.9	0	0	0	0	111.4
17	L	24.8	Very low	27.4	Very low	151 Å²	151	145.5 Å²	145.5	79%	0.791	80%	0.798	S	S	*	*			trans	-70.3	141	162.4	-95.6	141.1	0	0	0	109.8
18	N	27.2	Very low	27.5	Very low	168 Å²	168	144.6 Å²	144.6	90%	0.898	79%	0.791	S	S	*	*			trans	-147	116.1	156.4	-124.1	-23.7	0	0	0	109.7
19	L	23.5	Very low	27.6	Very low	148 Å²	148	148.2 Å²	148.2	78%	0.775	79%	0.789	S	S	*	*			trans	-88.2	137.9	171.1	-89.8	155.1	0	0	0	109.2
20	R	26.3	Very low	27.6	Very low	244 Å²	244	149.9 Å²	149.9	92%	0.921	79%	0.792	S	S	*	*			trans	-146.6	125.1	156.5	-120.8	-179.5	-174.1	178	1.8	110.9
21	V	25.2	Very low	27.7	Very low	132 Å²	132	153.7 Å²	153.7	80%	0.8	79%	0.789	S	S	*	*			trans	-94.1	131.2	170.4	174	0	0	0	0	108.4
22	V	29	Very low	27.8	Very low	134 Å²	134	153.5 Å²	153.5	81%	0.812	78%	0.783	S	S	*	*			trans	-153.9	125.5	150.5	-171.5	0	0	0	0	109
23	S	30	Very low	27.8	Very low	99 Å²	99	153.8 Å²	153.8	69%	0.692	78%	0.781	S	S	*	*			trans	-108.3	157.5	151.7	90.1	0	0	0	0	107
24	P	32	Very low	27.9	Very low	101 Å²	101	157.4 Å²	157.4	66%	0.656	79%	0.789	S	S	*	*				-156.9	167.4	75.9	29.9	-5.1	0	0	0	117.8
25	F	30.2	Very low	28	Very low	192 Å²	192	157.3 Å²	157.3	84%	0.842	79%	0.788	S	S	*	*			trans	43.3	149.6	142.6	-78.8	-102.8	0	0	0	121
26	D	27.6	Very low	27.9	Very low	126 Å²	126	158.4 Å²	158.4	67%	0.674	80%	0.795	S	S	*	*			cis	178.4	165.4	-11.3	-150.9	-14.5	0	0	0	105.6
27	Y	30.4	Very low	28.3	Very low	218 Å²	218	157.3 Å²	157.3	86%	0.855	79%	0.787	S	S	*	*			trans	152.9	95.8	150.6	-97.3	-90.6	0	0	0	114.6
28	S	28.5	Very low	28.6	Very low	82 Å²	82	155.3 Å²	155.3	57%	0.573	78%	0.783	S	S	*	*				61	119.7	111	-46.3	0	0	0	0	124.2
29	Y	25.9	Very low	28.7	Very low	199 Å²	199	154.3 Å²	154.3	78%	0.78	78%	0.777	S	S	*	*				89.3	110.4	126.3	-100.7	-97.6	0	0	0	123.6
30	L	28.7	Very low	28.9	Very low	169 Å²	169	157.8 Å²	157.8	89%	0.885	78%	0.779	S	S	*	*			trans	-178.3	90.6	131.7	-102.9	151.5	0	0	0	109.3
31	R	26.6	Very low	28.9	Very low	202 Å²	202	154.1 Å²	154.1	76%	0.762	77%	0.771	S	S	*	*				61.2	114.9	96.8	-116.3	-171.4	-172.1	179.1	3.2	116.8
32	L	27.5	Very low	29	Very low	140 Å²	140	155.1 Å²	155.1	73%	0.733	77%	0.771	S	S	*	*			trans	99.5	119.5	144.4	-77.8	151.6	0	0	0	120.6
33	Q	26.6	Very low	28.8	Very low	162 Å²	162	156.4 Å²	156.4	76%	0.757	77%	0.773	S	S	*	*			trans	89.7	107.7	150.3	-67.2	-179.2	-12	0	0	118.9
34	L	26.8	Very low	28.7	Very low	154 Å²	154	158.8 Å²	158.8	81%	0.806	78%	0.778	S	S	*	*	S	Bend	trans	50.1	76.8	140.1	-70	159	0	0	0	115.6
35	F	30.9	Very low	28.6	Very low	204 Å²	204	158.9 Å²	158.9	90%	0.895	78%	0.781	S	S	*	*			trans	-178.2	119	147.5	-91.3	-67.8	0	0	0	105.7	P37	F35-P37 WeakPolarHBondContact O-CD 3.29Å; F35-P37 VanDerWaalsContact O-N 3.14Å
36	N	31.2	Very low	28.5	Very low	169 Å²	169	158.9 Å²	158.9	90%	0.904	78%	0.78	S	S	*	*			trans	-63.6	108.4	168.6	-92.9	-25.6	0	0	0	107.8
37	P	35	Very low	28.7	Very low	109 Å²	109	157.9 Å²	157.9	71%	0.708	78%	0.779	S	S	*	*			trans	-85.7	138.8	-177.9	32.6	-24.2	0	0	0	109.1	F35 L39	F35-P37 WeakPolarHBondContact O-CD 3.29Å; F35-P37 VanDerWaalsContact O-N 3.14Å; P37-L39 PolarHBondContact O-N 3.06Å
38	P	31.7	Very low	28.6	Very low	109 Å²	109	153.4 Å²	153.4	71%	0.708	78%	0.778	S	S	*	*			trans	-68.7	131.1	166.8	28.9	-30.9	0	0	0	108.7	R40	P38-R40 PolarHBondContact O-N 3.43Å
39	L	29	Very low	28.7	Very low	148 Å²	148	159.6 Å²	159.6	78%	0.775	80%	0.795	S	S	*	*			trans	-56.2	111	166.9	-88.9	152.9	0	0	0	109	P37 F41	P37-L39 PolarHBondContact O-N 3.06Å; L39-F41 HydrophobicContact CB-CD2 4.48Å; L39-F41 HydrophobicContact CB-CE2 3.84Å; L39-F41 HydrophobicContact CB-CZ 4.41Å; L39-F41 HydrophobicContact CD2-CZ 4.26Å
40	R	27.3	Very low	29.2	Very low	220 Å²	220	154.3 Å²	154.3	83%	0.83	79%	0.787	S	S	*	*			trans	-80.4	128	168	-73.3	-179.3	-177.8	164.6	1.9	108.3	P38	P38-R40 PolarHBondContact O-N 3.43Å
41	F	26.3	Very low	29.3	Very low	168 Å²	168	154.7 Å²	154.7	74%	0.737	79%	0.79	S	S	*	*			trans	-115.2	110.2	163.9	-66.7	-83.5	0	0	0	107.4	L39	L39-F41 HydrophobicContact CB-CD2 4.48Å; L39-F41 HydrophobicContact CB-CE2 3.84Å; L39-F41 HydrophobicContact CB-CZ 4.41Å; L39-F41 HydrophobicContact CD2-CZ 4.26Å
42	D	27	Very low	29.5	Very low	152 Å²	152	152.1 Å²	152.1	81%	0.813	79%	0.787	S	S	*	*			trans	-79.2	115.9	167.3	-75.9	-38.8	0	0	0	107.9
43	L	25.9	Very low	29.7	Very low	162 Å²	162	152.1 Å²	152.1	85%	0.848	79%	0.793	S	S	*	*			trans	-112.9	89.5	170.7	-99.7	152.9	0	0	0	107.9	S45	L43-S45 PolarHBondContact O-N 3.16Å
44	D	27.6	Very low	29.7	Very low	149 Å²	149	154.5 Å²	154.5	80%	0.797	80%	0.796	S	S	*	*			trans	-69.8	104.9	169.5	-93.1	-18.1	0	0	0	109.4
45	S	29.7	Very low	29.8	Very low	103 Å²	103	158.7 Å²	158.7	72%	0.72	80%	0.802	S	S	*	*			trans	-98.7	96.2	163.8	-179.9	0	0	0	0	108.4	L43 T47	L43-S45 PolarHBondContact O-N 3.16Å; S45-T47 PolarHBondContact O-N 2.81Å
46	K	29.2	Very low	29.6	Very low	191 Å²	191	154.3 Å²	154.3	83%	0.83	79%	0.792	S	S	*	*			trans	-82.1	102	166.4	-78.7	-178	179.3	174.4	0	108.8
47	T	30.3	Very low	29.2	Very low	106 Å²	106	156 Å²	156	65%	0.65	79%	0.791	S	S	*	*			trans	-85.6	116.8	158.6	48.4	0	0	0	0	109.1	S45 K49	S45-T47 PolarHBondContact O-N 2.81Å; T47-K49 PolarHBondContact O-N 3.22Å
48	C	28.9	Very low	28.7	Very low	123 Å²	123	160 Å²	160	83%	0.831	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	96.9	173	-66.2	0	0	0	0	110.2
49	K	29.8	Very low	28.4	Very low	212 Å²	212	163.5 Å²	163.5	92%	0.922	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	158.1	12.9	144.4	-85.3	172.3	178.9	-174.7	0	116.9	T47	T47-K49 PolarHBondContact O-N 3.22Å
50	S	36.4	Very low	28.1	Very low	89 Å²	89	167.4 Å²	167.4	62%	0.622	81%	0.809	S	S	*	*			trans	-151.1	134.1	164.1	63.3	0	0	0	0	113.6	Q52	S50-Q52 PolarHBondContact O-N 3.08Å; S50-Q52 VanDerWaalsContact O-N 3.15Å
51	N	32.6	Very low	27.9	Very low	177 Å²	177	166.9 Å²	166.9	95%	0.947	81%	0.807	S	S	*	*			trans	-82.5	28.2	-173.6	-121.1	10.3	0	0	0	114.4
52	Q	30.9	Very low	28	Very low	148 Å²	148	168.3 Å²	168.3	69%	0.692	81%	0.813	S	S	*	*			trans	-105	113.1	179.6	-77.5	-175	-11.1	0	0	111.2	S50 Y54	S50-Q52 PolarHBondContact O-N 3.08Å; S50-Q52 VanDerWaalsContact O-N 3.15Å; Q52-Y54 PolarHBondContact O-N 3.2Å
53	T	31	Very low	28	Very low	140 Å²	140	171.3 Å²	171.3	86%	0.859	82%	0.815	S	S	*	*			trans	-79	106.4	171.1	32.2	0	0	0	0	109.8	R55	T53-R55 PolarHBondContact O-N 3.05Å
54	Y	26.3	Very low	27.9	Very low	212 Å²	212	169.9 Å²	169.9	83%	0.831	82%	0.816	S	S	*	*			trans	-77.6	108.9	166.7	-86	-93.5	0	0	0	109.4	Q52	Q52-Y54 PolarHBondContact O-N 3.2Å
55	R	28.3	Very low	28.1	Very low	242 Å²	242	171.1 Å²	171.1	91%	0.913	82%	0.822	S	S	*	*			trans	-95.5	112.2	171.6	-117.5	-179.2	-165.7	169.8	5.4	108.4	T53	T53-R55 PolarHBondContact O-N 3.05Å
56	T	26.2	Very low	28	Very low	112 Å²	112	172.7 Å²	172.7	69%	0.687	82%	0.823	S	S	*	*			trans	-118.4	126.1	166.8	176.3	0	0	0	0	109.4
57	K	24.7	Very low	28	Very low	205 Å²	205	173 Å²	173	89%	0.891	82%	0.82	S	S	*	*			trans	-91.2	121	179	-76.6	-178.3	178	179.5	0	108.4
58	F	24.4	Very low	27.8	Very low	193 Å²	193	176 Å²	176	85%	0.846	83%	0.827	S	S	*	*			trans	-117.7	126.7	165.2	-85.9	-86.9	0	0	0	109.2
59	E	23.6	Very low	27.7	Very low	181 Å²	181	178.6 Å²	178.6	85%	0.846	83%	0.831	S	S	*	*			trans	-118.2	125	177.9	-156.3	177.9	-154.6	0	0	107.8
60	R	24.5	Very low	27.4	Very low	231 Å²	231	177.7 Å²	177.7	87%	0.872	83%	0.827	S	S	*	*			trans	-143.8	120.4	172	-141.8	-179.4	-171.7	-175.8	3	109.9
61	R	23	Very low	26.8	Very low	209 Å²	209	180.9 Å²	180.9	79%	0.789	84%	0.835	S	S	*	*			trans	-77.2	137.8	-179.6	-64	179.5	-177.8	177.2	-0	110.7
62	F	27.7	Very low	26.3	Very low	197 Å²	197	183.6 Å²	183.6	86%	0.864	83%	0.832	S	S	*	*			trans	-108.1	134.1	165.8	-76.1	-89.9	0	0	0	109.1
63	Y	27.2	Very low	26.2	Very low	216 Å²	216	184.3 Å²	184.3	85%	0.847	83%	0.833	S	S	*	*			trans	-90.1	118.9	165.4	-74.3	-89.8	0	0	0	108.3
64	C	24.2	Very low	25.9	Very low	131 Å²	131	189 Å²	189	89%	0.885	84%	0.835	S	S	*	*			trans	-79.7	128.4	162.9	-105.9	0	0	0	0	108.1
65	L	30.3	Very low	25.7	Very low	176 Å²	176	186.2 Å²	186.2	92%	0.921	83%	0.833	S	S	*	*			trans	-101.9	115.9	156	-88.2	162.4	0	0	0	106.9
66	D	27.7	Very low	25.4	Very low	136 Å²	136	185.9 Å²	185.9	73%	0.727	83%	0.832	S	S	*	*			trans	-75.8	156.1	172.2	-135.4	-19.7	0	0	0	109.6
67	Y	29.2	Very low	25.2	Very low	197 Å²	197	186 Å²	186	77%	0.773	84%	0.838	S	S	*	*	S	Bend	trans	87.2	101.6	177.7	-65.1	-83.8	0	0	0	119.1
68	E	25.8	Very low	25.1	Very low	170 Å²	170	185.2 Å²	185.2	79%	0.794	83%	0.829	S	S	*	*			trans	48.7	96.2	141	-60.6	-166.2	160.4	0	0	119
69	L	27.9	Very low	25	Very low	176 Å²	176	183.4 Å²	183.4	92%	0.921	83%	0.827	S	S	*	*				-175.7	135.6	119.6	-99.4	144.3	0	0	0	111.6
70	K	23.7	Very low	24.9	Very low	193 Å²	193	179 Å²	179	84%	0.839	81%	0.812	S	S	*	*			trans	-56.6	128.7	-177.2	-68.3	166.4	167.3	168.9	0	112.2
71	I	24.6	Very low	24.8	Very low	156 Å²	156	175.9 Å²	175.9	80%	0.8	81%	0.812	S	S	*	*				154.7	115.8	120.7	-77.4	152.5	0	0	0	112
72	R	21.9	Very low	24.7	Very low	234 Å²	234	174.3 Å²	174.3	88%	0.883	81%	0.811	S	S	*	*			trans	4.8	123	147.1	-62.5	172.6	171.9	170.5	-2.9	117.5
73	K	27.1	Very low	24.4	Very low	163 Å²	163	171.2 Å²	171.2	71%	0.709	81%	0.808	S	S	*	*				-169.1	144.6	115.7	-107.4	176	-178.1	-174.5	0	113.7	D411	K73-D411 IonicContact NZ-OD1 2.72Å; K73-D411 IonicContact NZ-OD2 3.89Å; K73-D411 PolarHBondContact NZ-OD2 2.78Å
74	R	24.8	Very low	24.2	Very low	238 Å²	238	168 Å²	168	90%	0.898	81%	0.805	S	S	*	*			trans	-77.1	149.9	-178.3	-76.4	173.9	167.7	172.7	-5.5	112.5
75	I	22.2	Very low	24.3	Very low	155 Å²	155	167.1 Å²	167.1	80%	0.795	80%	0.797	S	S	*	*			trans	-68.4	139.6	174.5	-63.4	157.2	0	0	0	111.4
76	W	22.8	Very low	24.1	Very low	235 Å²	235	163.5 Å²	163.5	89%	0.89	78%	0.779	S	S	*	*			trans	-140	152.6	147.9	-75.1	84.8	0	0	0	111
77	S	22	Very low	24.2	Very low	114 Å²	114	164.1 Å²	164.1	80%	0.797	78%	0.782	S	S	*	*			trans	-63.3	143.7	-160	36.1	0	0	0	0	117
78	R	23.2	Very low	24.1	Very low	189 Å²	189	163.3 Å²	163.3	71%	0.713	79%	0.786	S	S	*	*			trans	-102.1	131.4	172.9	-78.6	178.5	169	173	-4	110.9	V80 C362	R78-V80 HydrophobicContact CB-CG2 4.01Å; R78-C362 PolarHBondContact NH2-SG 2.72Å
79	I	21.2	Very low	24.4	Very low	155 Å²	155	160.8 Å²	160.8	80%	0.795	79%	0.786	S	S	*	*			trans	-84.3	114.1	152.8	-65.1	173.4	0	0	0	105.9
80	V	21.8	Very low	24.5	Very low	89 Å²	89	158.4 Å²	158.4	54%	0.539	78%	0.779	S	S	.	*			trans	-98.7	115.9	179.9	178.3	0	0	0	0	107.5	R78 F82	R78-V80 HydrophobicContact CB-CG2 4.01Å; V80-F82 HydrophobicContact CG1-CD2 3.56Å; V80-F82 HydrophobicContact CG1-CE2 3.74Å
81	L	21.9	Very low	24.9	Very low	165 Å²	165	153.1 Å²	153.1	86%	0.864	77%	0.772	S	S	*	*			trans	-103.4	114.9	161.2	-72.1	169.4	0	0	0	107
82	F	20.7	Very low	25.2	Very low	176 Å²	176	153.8 Å²	153.8	77%	0.772	77%	0.771	S	S	*	*			trans	-77	135	-180	-99.6	-98.7	0	0	0	110.6	V80	V80-F82 HydrophobicContact CG1-CD2 3.56Å; V80-F82 HydrophobicContact CG1-CE2 3.74Å
83	T	23.3	Very low	25.7	Very low	131 Å²	131	148.9 Å²	148.9	80%	0.804	77%	0.767	S	S	*	*			trans	-137.8	130	151.5	42.2	0	0	0	0	108.2
84	L	21.8	Very low	25.5	Very low	150 Å²	150	147.8 Å²	147.8	79%	0.785	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.8	147.3	-175.6	-74.6	154.5	0	0	0	111.3
85	P	26.8	Very low	25.6	Very low	111 Å²	111	146.6 Å²	146.6	72%	0.721	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-102	125.3	176.6	35	-23.4	0	0	0	111.9
86	D	26.5	Very low	25.7	Very low	100 Å²	100	146.4 Å²	146.4	54%	0.535	77%	0.771	S	S	.	*	P	Polyproline II helix	trans	-101.7	135.7	145.9	-55.2	-31.1	0	0	0	104.3	M276	D86-M276 HydrophobicContact CB-CE 3.76Å; D86-M276 HydrophobicContact CB-CG 4.43Å; D86-M276 HydrophobicContact CB-SD 3.73Å; D86-M276 WeakPolarHBondContact O-CE 3.31Å
87	D	29	Very low	25.7	Very low	149 Å²	149	142.3 Å²	142.3	80%	0.797	77%	0.766	S	S	*	*			cis	-156.2	161.2	28.4	-92.3	-44	0	0	0	110.1
88	E	26.5	Very low	26.1	Very low	181 Å²	181	144.4 Å²	144.4	85%	0.846	77%	0.766	S	S	*	*			trans	-41.6	128.4	160.7	-60.7	176.4	152.6	0	0	113.2
89	S	32.8	Very low	26.4	Very low	116 Å²	116	141 Å²	141	81%	0.811	76%	0.762	S	S	*	*				169.7	99.5	114.8	43.1	0	0	0	0	109.7
90	V	29.5	Very low	26.7	Very low	126 Å²	126	140.1 Å²	140.1	76%	0.764	77%	0.766	S	S	*	*			trans	-80.6	123.1	153.6	174.3	0	0	0	0	106
91	A	33.3	Very low	27	Very low	83 Å²	83	139.2 Å²	139.2	69%	0.686	77%	0.768	S	S	*	*			trans	-125.7	139.2	154.1	0	0	0	0	0	105.1
92	E	29.9	Very low	27.4	Very low	169 Å²	169	138.5 Å²	138.5	79%	0.79	76%	0.764	S	S	*	*			cis	-168.8	141.8	1.2	-107.4	167.4	171.1	0	0	102.5
93	T	32.4	Very low	28	Very low	131 Å²	131	137.4 Å²	137.4	80%	0.804	77%	0.766	S	S	*	*			trans	169.4	94	134.3	48.4	0	0	0	0	109.1
94	D	24.2	Very low	28.3	Very low	140 Å²	140	141 Å²	141	75%	0.749	77%	0.771	S	S	*	*			trans	54.2	116.1	135.7	-54.6	-19.8	0	0	0	121.2
95	F	25.4	Very low	28.8	Very low	214 Å²	214	139.2 Å²	139.2	94%	0.939	77%	0.766	S	S	*	*				-164.4	128.1	110.7	-103.2	-77	0	0	0	110.5
96	D	23.9	Very low	29	Very low	150 Å²	150	142.3 Å²	142.3	80%	0.802	78%	0.775	S	S	*	*			trans	-60.5	161.3	-179.7	-90.6	-48.3	0	0	0	115.5
97	I	24.7	Very low	29.1	Very low	150 Å²	150	141.1 Å²	141.1	77%	0.769	79%	0.786	S	S	*	*				160.7	133.1	113.2	-72.2	160.1	0	0	0	109.9
98	I	28.8	Very low	29.3	Very low	158 Å²	158	143.2 Å²	143.2	81%	0.81	79%	0.792	S	S	*	*	S	Bend	trans	88.9	112.9	167.4	-40.2	-173.5	0	0	0	115.5
99	D	29.4	Very low	29.6	Very low	116 Å²	116	139.4 Å²	139.4	62%	0.62	78%	0.782	S	S	*	*			cis	-166.6	128.8	10.1	171.6	9.3	0	0	0	110.1	A101	D99-A101 WeakPolarHBondContact OD1-CB 3.38Å; D99-A101 PolarHBondContact OD1-N 2.9Å
100	P	27.8	Very low	29.3	Very low	137 Å²	137	139.9 Å²	139.9	89%	0.89	78%	0.781	S	S	*	*			trans	-101.4	68.8	176	38.6	-29	0	0	0	112.2
101	A	27.7	Very low	29.3	Very low	70 Å²	70	145.4 Å²	145.4	58%	0.579	79%	0.788	S	S	*	*			trans	-124.8	1.5	177.8	0	0	0	0	0	116.2	D99	D99-A101 WeakPolarHBondContact OD1-CB 3.38Å; D99-A101 PolarHBondContact OD1-N 2.9Å
102	I	32	Very low	29.2	Very low	150 Å²	150	146.9 Å²	146.9	77%	0.769	79%	0.789	S	S	*	*	S	Bend	trans	-130	81.1	-176.7	-53	178.8	0	0	0	110.9
103	N	32.2	Very low	29.1	Very low	153 Å²	153	146.9 Å²	146.9	82%	0.818	79%	0.793	S	S	*	*			trans	174.3	50.9	137	-87	-22.3	0	0	0	110.6	V105	N103-V105 PolarHBondContact O-N 3.37Å
104	K	28.8	Very low	28.8	Very low	207 Å²	207	151.3 Å²	151.3	90%	0.9	80%	0.797	S	S	*	*			trans	-85.7	27.2	170.1	-146.4	179.6	-172.8	179.2	0	112.2
105	V	32.2	Very low	29.1	Very low	113 Å²	113	148.4 Å²	148.4	69%	0.685	79%	0.787	S	S	*	*	S	Bend	trans	-139.5	113.5	-176.1	-179.5	0	0	0	0	109.3	N103	N103-V105 PolarHBondContact O-N 3.37Å
106	L	31.4	Very low	29.2	Very low	175 Å²	175	145.5 Å²	145.5	92%	0.916	78%	0.78	S	S	*	*	S	Bend	trans	92.8	101.5	172.9	-59.7	156.1	0	0	0	114.7
107	G	29.4	Very low	29.3	Very low	75 Å²	75	150.1 Å²	150.1	77%	0.773	79%	0.787	S	S	*	*			trans	-85.9	160.5	-172.4	0	0	0	0	0	114.8
108	E	32.3	Very low	29.3	Very low	194 Å²	194	148.4 Å²	148.4	91%	0.907	78%	0.784	S	S	*	*				-173.8	158.2	118.8	-99	-169.8	-178.8	0	0	109.5
109	P	32.6	Very low	29.3	Very low	100 Å²	100	150.1 Å²	150.1	65%	0.649	79%	0.788	S	S	*	*			trans	-100.9	153.2	-148.5	37.5	-33.4	0	0	0	114.7
110	T	27.4	Very low	29	Very low	127 Å²	127	152.7 Å²	152.7	78%	0.779	80%	0.801	S	S	*	*			trans	56.6	110	147.7	52.5	0	0	0	0	118.6
111	R	28.6	Very low	29.1	Very low	242 Å²	242	152.1 Å²	152.1	91%	0.913	80%	0.797	S	S	*	*			trans	-163	106.8	131.7	-107.9	165.3	-166.4	-159.6	4.1	112.1
112	T	31.6	Very low	29.2	Very low	114 Å²	114	154.6 Å²	154.6	70%	0.699	81%	0.805	S	S	*	*			trans	-70.1	128.6	166.6	32.6	0	0	0	0	110.3	Y114 S115	T112-Y114 PolarHBondContact O-N 3.18Å; T112-S115 PolarHBondContact O-OG 3.1Å
113	L	27.9	Very low	28.9	Very low	168 Å²	168	152.4 Å²	152.4	88%	0.88	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	31.1	179.4	-123.1	132	0	0	0	113.2
114	Y	27.1	Very low	28.9	Very low	225 Å²	225	150.9 Å²	150.9	88%	0.882	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	10.7	-179.6	-136.9	-91	0	0	0	112.7	T112	T112-Y114 PolarHBondContact O-N 3.18Å
115	S	29.1	Very low	29.2	Very low	79 Å²	79	148.6 Å²	148.6	55%	0.552	79%	0.793	S	S	*	*	S	Bend	trans	-124.7	14.6	-175.5	60	0	0	0	0	115.9	T112	T112-S115 PolarHBondContact O-OG 3.1Å
116	L	27.3	Very low	29.3	Very low	152 Å²	152	148.6 Å²	148.6	80%	0.796	79%	0.794	S	S	*	*	S	Bend	trans	-101.7	15.3	178.4	-83.2	164.2	0	0	0	115
117	W	27.2	Very low	29.4	Very low	248 Å²	248	149.6 Å²	149.6	94%	0.939	79%	0.794	S	S	*	*	S	Bend	trans	-108.7	18.3	-180	-82.5	73.7	0	0	0	115
118	T	25.4	Very low	29.6	Very low	114 Å²	114	149.9 Å²	149.9	70%	0.699	80%	0.796	S	S	*	*	S	Bend	trans	-141.4	79.6	178.6	48.2	0	0	0	0	110.8
119	Q	27	Very low	29.6	Very low	193 Å²	193	150 Å²	150	90%	0.902	79%	0.794	S	S	*	*			trans	174	106	146.1	-94.9	163.3	30.3	0	0	109.8
120	L	24.6	Very low	29.8	Very low	171 Å²	171	156.2 Å²	156.2	90%	0.895	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.9	129.4	167.9	-85.1	145.9	0	0	0	109.4
121	P	29.8	Very low	30.1	Very low	125 Å²	125	158.7 Å²	158.7	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.9	132.2	167.6	19.3	-13.2	0	0	0	111.2
122	V	29.1	Very low	30.8	Very low	121 Å²	121	151 Å²	151	73%	0.733	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-55	127.5	177.2	178	0	0	0	0	111.6	N124	V122-N124 HydrophobicContact CG1-CB 4.42Å; V122-N124 PolarHBondContact O-N 2.65Å
123	A	26.9	Very low	31.6	Very low	104 Å²	104	151 Å²	151	86%	0.86	79%	0.789	S	S	*	*			trans	-81.8	108.3	163.1	0	0	0	0	0	108.4
124	N	31.3	Very low	32.6	Very low	122 Å²	122	147.8 Å²	147.8	65%	0.652	78%	0.78	S	S	*	*			trans	-120.6	132.6	167.1	-112.3	0.6	0	0	0	109.4	V122	V122-N124 HydrophobicContact CG1-CB 4.42Å; V122-N124 PolarHBondContact O-N 2.65Å
125	H	35.2	Very low	33.8	Very low	159 Å²	159	139.4 Å²	139.4	74%	0.736	76%	0.762	S	S	*	*			trans	79	121	172	-55	-61.8	0	0	0	115.8
126	T	34.5	Very low	34.6	Very low	113 Å²	113	141 Å²	141	69%	0.693	76%	0.761	S	S	*	*			cis	-167.1	140.4	16.3	9.1	0	0	0	0	110.8
127	E	33.6	Very low	35.4	Very low	196 Å²	196	139.8 Å²	139.8	92%	0.916	75%	0.751	S	S	*	*			trans	79	110.9	148.8	-65.1	-178.9	178.9	0	0	121.9
128	G	33.5	Very low	36.5	Very low	80 Å²	80	131 Å²	131	83%	0.825	73%	0.732	S	S	*	*			trans	160.8	65.7	163.9	0	0	0	0	0	113.9	Y130	G128-Y130 PolarHBondContact O-N 3.14Å
129	K	31.3	Very low	37.7	Very low	196 Å²	196	128.2 Å²	128.2	85%	0.852	72%	0.72	S	S	*	*			trans	-43.6	117.9	179.8	-71.9	170.4	173.3	173.7	0	114.6
130	Y	38	Very low	38.5	Very low	232 Å²	232	123.7 Å²	123.7	91%	0.91	70%	0.702	S	S	*	*			trans	-151.4	106.3	131.4	-87.2	-74.9	0	0	0	108.5	G128 V132	G128-Y130 PolarHBondContact O-N 3.14Å; Y130-V132 PolarHBondContact O-N 2.77Å
131	L	34.2	Very low	39.5	Very low	178 Å²	178	123.1 Å²	123.1	93%	0.932	69%	0.692	S	S	*	*			trans	-76.2	110	172.7	-79	153.7	0	0	0	108.1
132	V	42.8	Very low	40.5	Very low	80 Å²	80	126.3 Å²	126.3	49%	0.485	69%	0.688	S	S	.	*			trans	-100	116.3	163.6	173.5	0	0	0	0	105.7	Y130 E136	Y130-V132 PolarHBondContact O-N 2.77Å; V132-E136 HydrophobicContact CG1-CB 3.4Å; V132-E136 VanDerWaalsContact CG1-CB 3.4Å; V132-E136 HydrophobicContact CG1-CG 4.44Å; V132-E136 WeakPolarHBondContact CG1-OE2 3.41Å
133	D	47.5	Very low	41.2	Very low	115 Å²	115	129.2 Å²	129.2	62%	0.615	69%	0.687	S	S	*	*			trans	-56.2	149.2	-174.5	-165.9	-4.2	0	0	0	111	G135 E136 H137	D133-G135 PolarHBondContact O-N 3.25Å; D133-G135 VanDerWaalsContact O-N 3.07Å; D133-E136 WeakPolarHBondContact O-CA 3.1Å; D133-E136 WeakPolarHBondContact O-CB 3.5Å; D133-E136 PolarHBondContact O-N 3.16Å; D133-H137 PolarHBondContact O-N 2.98Å; D133-H137 VanDerWaalsContact O-N 3.14Å
134	S	48.6	Very low	41.8	Very low	100 Å²	100	129.2 Å²	129.2	70%	0.699	67%	0.669	S	S	*	*	H	α-helix	trans	-56.9	-28	-175.3	62.6	0	0	0	0	113.3	A138	S134-A138 PolarHBondContact O-N 3.38Å
135	G	52.8	Low	42.4	Very low	49 Å²	49	131.1 Å²	131.1	51%	0.505	67%	0.671	S	S	.	*	H	α-helix	trans	-68.8	-37.3	171.2	0	0	0	0	0	113.5	D133 A138 A139	D133-G135 PolarHBondContact O-N 3.25Å; D133-G135 VanDerWaalsContact O-N 3.07Å; G135-A138 PolarHBondContact O-N 3.16Å; G135-A139 PolarHBondContact O-N 3.28Å
136	E	45.4	Very low	43	Very low	113 Å²	113	128 Å²	128	53%	0.528	66%	0.66	S	S	.	*	H	α-helix	trans	-72.8	-30.9	176.8	-72.5	-170.4	143.1	0	0	111.7	V132 D133 A139 L140	V132-E136 HydrophobicContact CG1-CB 3.4Å; V132-E136 VanDerWaalsContact CG1-CB 3.4Å; V132-E136 HydrophobicContact CG1-CG 4.44Å; V132-E136 WeakPolarHBondContact CG1-OE2 3.41Å; D133-E136 WeakPolarHBondContact O-CA 3.1Å; D133-E136 WeakPolarHBondContact O-CB 3.5Å; D133-E136 PolarHBondContact O-N 3.16Å; E136-A139 CarbonylContact O-C 3.6Å; E136-A139 PolarHBondContact O-N 2.88Å; E136-L140 VanDerWaalsContact O-CB 3.3Å; E136-L140 WeakPolarHBondContact O-CB 3.5Å; E136-L140 PolarHBondContact O-N 3.21Å
137	H	45.9	Very low	43.1	Very low	126 Å²	126	128.7 Å²	128.7	58%	0.583	65%	0.651	S	S	*	*	H	α-helix	trans	-67.5	-37.3	175.1	-148	75.7	0	0	0	112.3	D133 K141	D133-H137 PolarHBondContact O-N 2.98Å; D133-H137 VanDerWaalsContact O-N 3.14Å; H137-K141 VanDerWaalsContact O-CB 3.27Å; H137-K141 WeakPolarHBondContact O-CB 2.89Å; H137-K141 PolarHBondContact O-N 3.13Å
138	A	49.1	Very low	43.3	Very low	64 Å²	64	125.5 Å²	125.5	53%	0.529	63%	0.631	S	S	.	*	H	α-helix	trans	-68.2	-40	172.2	0	0	0	0	0	111.7	S134 G135 K141 R142	S134-A138 PolarHBondContact O-N 3.38Å; G135-A138 PolarHBondContact O-N 3.16Å; A138-K141 PolarHBondContact O-N 3.37Å; A138-R142 WeakPolarHBondContact O-CB 3.49Å; A138-R142 PolarHBondContact O-N 3.14Å
139	A	50.5	Low	43.6	Very low	55 Å²	55	127.8 Å²	127.8	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-64	-43.9	173.9	0	0	0	0	0	111.7	G135 E136 K141 R142 Y143	G135-A139 PolarHBondContact O-N 3.28Å; E136-A139 CarbonylContact O-C 3.6Å; E136-A139 PolarHBondContact O-N 2.88Å; A139-K141 VanDerWaalsContact C-N 3.35Å; A139-K141 PolarHBondContact O-N 3.43Å; A139-R142 CarbonylContact O-C 3.6Å; A139-R142 PolarHBondContact O-N 2.87Å; A139-Y143 VanDerWaalsContact O-CB 3.3Å; A139-Y143 WeakPolarHBondContact O-CB 3.49Å; A139-Y143 PolarHBondContact O-N 2.95Å
140	L	43.5	Very low	43.9	Very low	99 Å²	99	121.9 Å²	121.9	52%	0.518	60%	0.602	S	S	.	*	H	α-helix	trans	-64.5	-38.7	176.7	-138.1	99.3	0	0	0	111.1	E136 Y143 H144	E136-L140 VanDerWaalsContact O-CB 3.3Å; E136-L140 WeakPolarHBondContact O-CB 3.5Å; E136-L140 PolarHBondContact O-N 3.21Å; L140-Y143 PolarHBondContact O-N 3.34Å; L140-H144 VanDerWaalsContact O-CB 3.28Å; L140-H144 WeakPolarHBondContact O-CB 3.48Å; L140-H144 PolarHBondContact O-N 3.43Å
141	K	45.5	Very low	43.8	Very low	158 Å²	158	113.1 Å²	113.1	69%	0.687	57%	0.569	S	S	*	*	H	α-helix	trans	-68.6	-36.3	175.8	-159.1	173.1	-172.8	175.4	0	111.6	H137 A138 A139 K145	H137-K141 VanDerWaalsContact O-CB 3.27Å; H137-K141 WeakPolarHBondContact O-CB 2.89Å; H137-K141 PolarHBondContact O-N 3.13Å; A138-K141 PolarHBondContact O-N 3.37Å; A139-K141 VanDerWaalsContact C-N 3.35Å; A139-K141 PolarHBondContact O-N 3.43Å; K141-K145 WeakPolarHBondContact O-CB 3.17Å; K141-K145 PolarHBondContact O-N 3.25Å
142	R	50.7	Low	44	Very low	193 Å²	193	108.8 Å²	108.8	73%	0.728	54%	0.54	S	S	*	.	H	α-helix	trans	-69.3	-41.5	171.8	-131.6	178.9	-157.8	172	5.8	111.5	A138 A139 K145 N146	A138-R142 WeakPolarHBondContact O-CB 3.49Å; A138-R142 PolarHBondContact O-N 3.14Å; A139-R142 CarbonylContact O-C 3.6Å; A139-R142 PolarHBondContact O-N 2.87Å; R142-K145 PolarHBondContact O-N 3.35Å; R142-N146 WeakPolarHBondContact O-CB 2.8Å; R142-N146 PolarHBondContact O-N 3.08Å
143	Y	45	Very low	43.8	Very low	181 Å²	181	108.8 Å²	108.8	71%	0.71	54%	0.537	S	S	*	.	H	α-helix	trans	-68.1	-42.2	178.1	-146.8	-86.4	0	0	0	110.9	A139 L140 N146 Y147	A139-Y143 VanDerWaalsContact O-CB 3.3Å; A139-Y143 WeakPolarHBondContact O-CB 3.49Å; A139-Y143 PolarHBondContact O-N 2.95Å; L140-Y143 PolarHBondContact O-N 3.34Å; Y143-N146 PolarHBondContact O-N 3.32Å; Y143-Y147 WeakPolarHBondContact O-CA 3.16Å; Y143-Y147 WeakPolarHBondContact O-CB 3.28Å; Y143-Y147 PolarHBondContact O-N 3.46Å
144	H	39.8	Very low	43.5	Very low	104 Å²	104	106.5 Å²	106.5	48%	0.481	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-45.1	171.5	-105.7	-130.2	0	0	0	111.4	L140 N146 Y147 Y148	L140-H144 VanDerWaalsContact O-CB 3.28Å; L140-H144 WeakPolarHBondContact O-CB 3.48Å; L140-H144 PolarHBondContact O-N 3.43Å; H144-N146 VanDerWaalsContact C-N 3.33Å; H144-N146 PolarHBondContact O-N 3.2Å; H144-Y147 PolarHBondContact O-N 2.93Å; H144-Y148 AromaticContact ND1-CE2 3.91Å; H144-Y148 WeakPolarHBondContact O-CB 3.47Å; H144-Y148 VanDerWaalsContact O-CD2 3.27Å; H144-Y148 WeakPolarHBondContact O-CD2 3.27Å; H144-Y148 PolarHBondContact O-N 3.38Å
145	K	44.3	Very low	42.8	Very low	162 Å²	162	104.4 Å²	104.4	70%	0.704	51%	0.506	S	S	*	.	H	α-helix	trans	-64.2	-39	178.9	-168.7	175.6	-178.7	-180	0	111.9	K141 R142 K149	K141-K145 WeakPolarHBondContact O-CB 3.17Å; K141-K145 PolarHBondContact O-N 3.25Å; R142-K145 PolarHBondContact O-N 3.35Å; K145-K149 VanDerWaalsContact O-CB 3.31Å; K145-K149 WeakPolarHBondContact O-CB 3.22Å; K145-K149 PolarHBondContact O-N 2.71Å; K145-K149 VanDerWaalsContact O-N 3.07Å
146	N	46.7	Very low	42	Very low	94 Å²	94	105.2 Å²	105.2	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-75.9	-35.5	175.6	-73.6	-13	0	0	0	112.5	R142 Y143 H144 K149 S150	R142-N146 WeakPolarHBondContact O-CB 2.8Å; R142-N146 PolarHBondContact O-N 3.08Å; Y143-N146 PolarHBondContact O-N 3.32Å; H144-N146 VanDerWaalsContact C-N 3.33Å; H144-N146 PolarHBondContact O-N 3.2Å; N146-K149 PolarHBondContact O-N 3.09Å; N146-S150 WeakPolarHBondContact O-CB 3.22Å; N146-S150 PolarHBondContact O-N 3.41Å; N146-S150 PolarHBondContact O-OG 3.04Å
147	Y	37.2	Very low	41.5	Very low	127 Å²	127	102.4 Å²	102.4	50%	0.498	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-44.2	174	177.8	-96.5	0	0	0	110.8	Y143 H144 K149 S150 F151	Y143-Y147 WeakPolarHBondContact O-CA 3.16Å; Y143-Y147 WeakPolarHBondContact O-CB 3.28Å; Y143-Y147 PolarHBondContact O-N 3.46Å; H144-Y147 PolarHBondContact O-N 2.93Å; Y147-K149 VanDerWaalsContact C-N 3.3Å; Y147-K149 PolarHBondContact O-N 3.17Å; Y147-S150 PolarHBondContact O-N 3.01Å; Y147-F151 WeakPolarHBondContact O-CA 3.44Å; Y147-F151 WeakPolarHBondContact O-CB 3.12Å; Y147-F151 PolarHBondContact O-N 3.41Å
148	Y	36.4	Very low	41	Very low	130 Å²	130	102.7 Å²	102.7	51%	0.51	49%	0.487	S	S	.	.	H	α-helix	trans	-65.3	-34.1	172.9	-90.6	-78.4	0	0	0	112.3	H144 R152	H144-Y148 AromaticContact ND1-CE2 3.91Å; H144-Y148 WeakPolarHBondContact O-CB 3.47Å; H144-Y148 VanDerWaalsContact O-CD2 3.27Å; H144-Y148 WeakPolarHBondContact O-CD2 3.27Å; H144-Y148 PolarHBondContact O-N 3.38Å; Y148-R152 WeakPolarHBondContact O-CB 3.49Å; Y148-R152 PolarHBondContact O-N 2.72Å
149	K	41.1	Very low	40.2	Very low	128 Å²	128	101.7 Å²	101.7	56%	0.557	47%	0.473	S	S	*	.	H	α-helix	trans	-67.8	-48.5	174	-168.2	179.2	178.8	-171.5	0	111.3	K145 N146 Y147 R152 D153	K145-K149 VanDerWaalsContact O-CB 3.31Å; K145-K149 WeakPolarHBondContact O-CB 3.22Å; K145-K149 PolarHBondContact O-N 2.71Å; K145-K149 VanDerWaalsContact O-N 3.07Å; N146-K149 PolarHBondContact O-N 3.09Å; Y147-K149 VanDerWaalsContact C-N 3.3Å; Y147-K149 PolarHBondContact O-N 3.17Å; K149-R152 PolarHBondContact O-N 3.07Å; K149-D153 VanDerWaalsContact O-CB 3.26Å; K149-D153 WeakPolarHBondContact O-CB 3.37Å; K149-D153 PolarHBondContact O-N 2.92Å
150	S	37.2	Very low	39.6	Very low	71 Å²	71	104.6 Å²	104.6	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-67.5	-35.7	175.2	-67.4	0	0	0	0	113.1	N146 Y147 D153 V154	N146-S150 WeakPolarHBondContact O-CB 3.22Å; N146-S150 PolarHBondContact O-N 3.41Å; N146-S150 PolarHBondContact O-OG 3.04Å; Y147-S150 PolarHBondContact O-N 3.01Å; S150-D153 PolarHBondContact O-N 3.25Å; S150-V154 WeakPolarHBondContact O-CB 3.15Å; S150-V154 VanDerWaalsContact O-CG2 3.22Å; S150-V154 WeakPolarHBondContact O-CG2 3.46Å; S150-V154 PolarHBondContact O-N 2.83Å
151	F	35.1	Very low	39.2	Very low	49 Å²	49	102.4 Å²	102.4	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-66.1	-43.1	175.7	178.3	-94.1	0	0	0	111.3	Y147 E155 I217	Y147-F151 WeakPolarHBondContact O-CA 3.44Å; Y147-F151 WeakPolarHBondContact O-CB 3.12Å; Y147-F151 PolarHBondContact O-N 3.41Å; F151-E155 HydrophobicContact CD2-CG 4.37Å; F151-E155 WeakPolarHBondContact O-CB 3.13Å; F151-E155 PolarHBondContact O-N 3.28Å; F151-I217 HydrophobicContact CE1-CD1 4.44Å; F151-I217 HydrophobicContact CE2-CG2 4.02Å; F151-I217 HydrophobicContact CZ-CD1 3.88Å; F151-I217 HydrophobicContact CZ-CG2 3.87Å
152	R	38.3	Very low	39	Very low	86 Å²	86	98.3 Å²	98.3	33%	0.325	45%	0.451	S	S	.	.	H	α-helix	trans	-61.4	-48.9	170.1	170.7	-160.6	169.8	155.8	-2.5	111.6	Y148 K149 L156 P334 L335	Y148-R152 WeakPolarHBondContact O-CB 3.49Å; Y148-R152 PolarHBondContact O-N 2.72Å; K149-R152 PolarHBondContact O-N 3.07Å; R152-L156 WeakPolarHBondContact O-CB 3.19Å; R152-P334 PolarHBondContact NH2-O 2.83Å; R152-L335 HydrophobicContact CB-CD2 4.48Å; R152-L335 HydrophobicContact CG-CD2 3.58Å; R152-L335 VanDerWaalsContact NE-CD2 3.26Å; R152-L335 VanDerWaalsContact NH1-CD2 3.34Å
153	D	39.6	Very low	38.4	Very low	81 Å²	81	93.2 Å²	93.2	43%	0.433	44%	0.438	S	S	.	.	H	α-helix	trans	-78.2	-19.3	-171.5	-65.2	-16.4	0	0	0	113	K149 S150 S157	K149-D153 VanDerWaalsContact O-CB 3.26Å; K149-D153 WeakPolarHBondContact O-CB 3.37Å; K149-D153 PolarHBondContact O-N 2.92Å; S150-D153 PolarHBondContact O-N 3.25Å; D153-S157 WeakPolarHBondContact O-CB 3.04Å; D153-S157 PolarHBondContact O-OG 3.37Å
154	V	40.4	Very low	37.9	Very low	67 Å²	67	88.8 Å²	88.8	41%	0.406	43%	0.433	S	S	.	.	H	α-helix	trans	-110	-32.2	-177.1	179.9	0	0	0	0	113.7	S150 S157 R158	S150-V154 WeakPolarHBondContact O-CB 3.15Å; S150-V154 VanDerWaalsContact O-CG2 3.22Å; S150-V154 WeakPolarHBondContact O-CG2 3.46Å; S150-V154 PolarHBondContact O-N 2.83Å; V154-S157 VanDerWaalsContact C-OG 3.29Å; V154-S157 WeakPolarHBondContact CA-OG 3.23Å; V154-S157 PolarHBondContact O-OG 2.69Å; V154-R158 WeakPolarHBondContact O-CD 3.28Å; V154-R158 WeakPolarHBondContact O-CG 3.13Å; V154-R158 PolarHBondContact O-NE 3.15Å; V154-R158 VanDerWaalsContact O-NE 3.16Å
155	E	34.7	Very low	37.9	Very low	55 Å²	55	88.8 Å²	88.8	26%	0.257	44%	0.436	S	S	.	.	H	α-helix	trans	-103.4	-35.3	-175.1	-61.9	-75.8	-162.2	0	0	113.3	F151 S157 R158 K221	F151-E155 HydrophobicContact CD2-CG 4.37Å; F151-E155 WeakPolarHBondContact O-CB 3.13Å; F151-E155 PolarHBondContact O-N 3.28Å; E155-S157 VanDerWaalsContact C-N 3.33Å; E155-R158 PolarHBondContact O-N 3.49Å; E155-R158 IonicContact OE1-NH1 3.39Å; E155-R158 IonicContact OE2-CZ 3.97Å; E155-R158 IonicContact OE2-NH1 3.59Å; E155-R158 PolarHBondContact OE2-NH1 3.01Å; E155-R158 VanDerWaalsContact OE2-NH1 3.15Å; E155-K221 VanDerWaalsContact CD-NZ 3.29Å; E155-K221 VanDerWaalsContact OE1-CE 3.28Å; E155-K221 WeakPolarHBondContact OE1-CE 3.19Å; E155-K221 IonicContact OE1-NZ 3.22Å; E155-K221 PolarHBondContact OE1-NZ 3.28Å
156	L	36.8	Very low	38	Very low	66 Å²	66	87.4 Å²	87.4	35%	0.346	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-76.9	-23.9	171.3	-65.7	172.9	0	0	0	112	R152 R158 L159 W168	R152-L156 WeakPolarHBondContact O-CB 3.19Å; L156-R158 PolarHBondContact O-N 2.84Å; L156-L159 HydrophobicContact CD2-CD1 4.1Å; L156-L159 PolarHBondContact O-N 3.2Å; L156-W168 HydrophobicContact CD2-CZ3 4.26Å
157	S	34.8	Very low	38	Very low	55 Å²	55	86.3 Å²	86.3	39%	0.385	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-71.5	-14.9	172.9	60.5	0	0	0	0	113.7	D153 V154 E155	D153-S157 WeakPolarHBondContact O-CB 3.04Å; D153-S157 PolarHBondContact O-OG 3.37Å; V154-S157 VanDerWaalsContact C-OG 3.29Å; V154-S157 WeakPolarHBondContact CA-OG 3.23Å; V154-S157 PolarHBondContact O-OG 2.69Å; E155-S157 VanDerWaalsContact C-N 3.33Å
158	R	34.6	Very low	38.6	Very low	131 Å²	131	81.5 Å²	81.5	49%	0.494	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-85.7	-22.2	177.3	-75.4	171.2	-178.6	-177.7	-6	113	V154 E155 L156 Q160 P171	V154-R158 WeakPolarHBondContact O-CD 3.28Å; V154-R158 WeakPolarHBondContact O-CG 3.13Å; V154-R158 PolarHBondContact O-NE 3.15Å; V154-R158 VanDerWaalsContact O-NE 3.16Å; E155-R158 PolarHBondContact O-N 3.49Å; E155-R158 IonicContact OE1-NH1 3.39Å; E155-R158 IonicContact OE2-CZ 3.97Å; E155-R158 IonicContact OE2-NH1 3.59Å; E155-R158 PolarHBondContact OE2-NH1 3.01Å; E155-R158 VanDerWaalsContact OE2-NH1 3.15Å; L156-R158 PolarHBondContact O-N 2.84Å; R158-Q160 PolarHBondContact O-N 3.44Å; R158-P171 HydrophobicContact CB-CG 4.2Å; R158-P171 VanDerWaalsContact O-CD 3.23Å; R158-P171 WeakPolarHBondContact O-CD 2.93Å; R158-P171 WeakPolarHBondContact O-CG 3.27Å
159	L	32.3	Very low	39.2	Very low	44 Å²	44	76 Å²	76	23%	0.23	38%	0.384	C	S	.	.	S	Bend	trans	-81	122.2	178.5	-65.8	158.8	0	0	0	109.7	L156 W168 H170	L156-L159 HydrophobicContact CD2-CD1 4.1Å; L156-L159 PolarHBondContact O-N 3.2Å; L159-W168 HydrophobicContact CB-CD2 4.49Å; L159-W168 HydrophobicContact CB-CE3 3.33Å; L159-W168 HydrophobicContact CB-CZ3 3.72Å; L159-W168 HydrophobicContact CD1-CE3 3.46Å; L159-W168 VanDerWaalsContact CD1-CE3 3.46Å; L159-W168 HydrophobicContact CD1-CZ3 3.74Å; L159-W168 HydrophobicContact CG-CE3 3.9Å; L159-W168 HydrophobicContact CG-CZ3 4.34Å; L159-H170 HydrophobicContact CD2-CB 4.34Å
160	Q	37.1	Very low	39.3	Very low	116 Å²	116	71.6 Å²	71.6	54%	0.542	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.6	176.3	-77.8	-176.4	-7.8	0	0	109.6	R158 I162 V169	R158-Q160 PolarHBondContact O-N 3.44Å; Q160-I162 PolarHBondContact O-N 3.21Å; Q160-V169 PolarHBondContact N-O 3.47Å; Q160-V169 PolarHBondContact O-N 3.08Å
161	L	35.4	Very low	39.4	Very low	52 Å²	52	70.9 Å²	70.9	27%	0.272	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	110.5	170.3	-156.2	100.8	0	0	0	108.2	W168	L161-W168 HydrophobicContact CD1-CD2 4.27Å; L161-W168 HydrophobicContact CD1-CZ2 3.89Å
162	I	42.6	Very low	39.8	Very low	73 Å²	73	74.3 Å²	74.3	37%	0.374	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-32	-178.7	-51.6	165.5	0	0	0	111.1	Q160 L167 V169 H176	Q160-I162 PolarHBondContact O-N 3.21Å; I162-L167 HydrophobicContact CD1-CB 4.32Å; I162-L167 PolarHBondContact N-O 3.31Å; I162-V169 HydrophobicContact CD1-CB 4.43Å; I162-V169 HydrophobicContact CD1-CG2 3.1Å; I162-V169 HydrophobicContact CG1-CB 4.43Å; I162-V169 HydrophobicContact CG1-CG2 3.48Å; I162-V169 VanDerWaalsContact CG1-CG2 3.48Å; I162-H176 VanDerWaalsContact CD1-CE1 3.42Å; I162-H176 WeakPolarHBondContact CD1-CE1 3.27Å; I162-H176 VanDerWaalsContact CD1-ND1 3.27Å; I162-H176 WeakPolarHBondContact CD1-ND1 3.3Å
163	N	37.8	Very low	40.2	Very low	85 Å²	85	73.3 Å²	73.3	46%	0.455	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	143	-177.9	-166.3	-11.4	0	0	0	110.1	D165	N163-D165 PolarHBondContact O-N 2.81Å
164	C	34.9	Very low	40.8	Very low	89 Å²	89	75.5 Å²	75.5	60%	0.601	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-17.9	-169.1	-70.7	0	0	0	0	115.8
165	D	38.8	Very low	41.2	Very low	104 Å²	104	74.6 Å²	74.6	56%	0.556	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	-22	-170.6	-69.1	-20.1	0	0	0	116.9	N163	N163-D165 PolarHBondContact O-N 2.81Å
166	K	47.1	Very low	42.2	Very low	133 Å²	133	77.4 Å²	77.4	58%	0.578	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152	-9.1	-160.7	-64.5	-175	-175	167.4	0	121.1	S178	K166-S178 WeakPolarHBondContact O-CA 3.42Å; K166-S178 PolarHBondContact O-OG 3.46Å
167	L	45.6	Very low	43.1	Very low	70 Å²	70	75.1 Å²	75.1	37%	0.366	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	122.8	-170.5	-72.2	162.1	0	0	0	113.4	I162 H176 Y177	I162-L167 HydrophobicContact CD1-CB 4.32Å; I162-L167 PolarHBondContact N-O 3.31Å; L167-H176 HydrophobicContact CD2-CB 4.08Å; L167-Y177 WeakPolarHBondContact CA-O 3.32Å
168	W	50.8	Low	44.1	Very low	27 Å²	27	74 Å²	74	10%	0.102	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130	172.9	-66.1	65.6	0	0	0	108.9	L156 L159 L161 H176 Y177 L179 I336	L156-W168 HydrophobicContact CD2-CZ3 4.26Å; L159-W168 HydrophobicContact CB-CD2 4.49Å; L159-W168 HydrophobicContact CB-CE3 3.33Å; L159-W168 HydrophobicContact CB-CZ3 3.72Å; L159-W168 HydrophobicContact CD1-CE3 3.46Å; L159-W168 VanDerWaalsContact CD1-CE3 3.46Å; L159-W168 HydrophobicContact CD1-CZ3 3.74Å; L159-W168 HydrophobicContact CG-CE3 3.9Å; L159-W168 HydrophobicContact CG-CZ3 4.34Å; L161-W168 HydrophobicContact CD1-CD2 4.27Å; L161-W168 HydrophobicContact CD1-CZ2 3.89Å; W168-H176 CarbonylContact O-C 3.57Å; W168-H176 WeakPolarHBondContact O-CA 3.19Å; W168-Y177 HydrophobicContact CB-CD2 4.48Å; W168-Y177 PolarHBondContact N-O 3Å; W168-Y177 PolarHBondContact O-N 3.46Å; W168-L179 HydrophobicContact CZ2-CD2 3.8Å; W168-L179 VanDerWaalsContact NE1-CD2 3.29Å; W168-I336 HydrophobicContact CH2-CG2 4.35Å; W168-I336 HydrophobicContact CZ2-CG2 3.98Å
169	V	47.5	Very low	45.2	Very low	13 Å²	13	69.1 Å²	69.1	8%	0.079	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.3	172	174.4	0	0	0	0	109.6	Q160 I162 L174 Q175 H176	Q160-V169 PolarHBondContact N-O 3.47Å; Q160-V169 PolarHBondContact O-N 3.08Å; I162-V169 HydrophobicContact CD1-CB 4.43Å; I162-V169 HydrophobicContact CD1-CG2 3.1Å; I162-V169 HydrophobicContact CG1-CB 4.43Å; I162-V169 HydrophobicContact CG1-CG2 3.48Å; I162-V169 VanDerWaalsContact CG1-CG2 3.48Å; V169-L174 HydrophobicContact CG1-CD2 4.44Å; V169-Q175 WeakPolarHBondContact CA-O 3.48Å; V169-H176 VanDerWaalsContact CG2-ND1 3.27Å; V169-H176 WeakPolarHBondContact CG2-ND1 3.47Å
170	H	43.8	Very low	46.6	Very low	36 Å²	36	70.6 Å²	70.6	17%	0.167	37%	0.371	C	S	.	.			trans	-73.2	118.1	166.2	-168.7	-99.5	0	0	0	109.3	L159 T172 T173 L174 Q175 Y177 D220	L159-H170 HydrophobicContact CD2-CB 4.34Å; H170-T172 PolarHBondContact O-N 3.36Å; H170-T172 VanDerWaalsContact O-N 3.16Å; H170-T173 VanDerWaalsContact CB-OG1 3.22Å; H170-T173 WeakPolarHBondContact CB-OG1 2.99Å; H170-T173 WeakPolarHBondContact ND1-CG2 3.36Å; H170-T173 PolarHBondContact ND1-N 2.88Å; H170-T173 PolarHBondContact ND1-OG1 1.99Å; H170-T173 PolarHBondContact O-N 2.93Å; H170-L174 VanDerWaalsContact O-CA 3.28Å; H170-L174 WeakPolarHBondContact O-CA 3.26Å; H170-L174 PolarHBondContact O-N 2.62Å; H170-Q175 PolarHBondContact N-O 2.86Å; H170-Q175 VanDerWaalsContact N-O 3.08Å; H170-Y177 HydrophobicContact CB-CE2 3.8Å; H170-D220 IonicContact CD2-OD2 3.65Å; H170-D220 IonicContact NE2-OD2 2.71Å
171	P	40.3	Very low	47.7	Very low	57 Å²	57	69.5 Å²	69.5	37%	0.37	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-23	-168.3	29.7	-39.2	0	0	0	113	R158	R158-P171 HydrophobicContact CB-CG 4.2Å; R158-P171 VanDerWaalsContact O-CD 3.23Å; R158-P171 WeakPolarHBondContact O-CD 2.93Å; R158-P171 WeakPolarHBondContact O-CG 3.27Å
172	T	42.1	Very low	48.9	Very low	121 Å²	121	67.5 Å²	67.5	74%	0.742	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-36.3	-178.2	-47.8	0	0	0	0	112.5	H170	H170-T172 PolarHBondContact O-N 3.36Å; H170-T172 VanDerWaalsContact O-N 3.16Å
173	T	47.8	Very low	49.7	Very low	64 Å²	64	66.1 Å²	66.1	39%	0.393	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-11.4	-176.4	59.5	0	0	0	0	112.6	H170 Q175	H170-T173 VanDerWaalsContact CB-OG1 3.22Å; H170-T173 WeakPolarHBondContact CB-OG1 2.99Å; H170-T173 WeakPolarHBondContact ND1-CG2 3.36Å; H170-T173 PolarHBondContact ND1-N 2.88Å; H170-T173 PolarHBondContact ND1-OG1 1.99Å; H170-T173 PolarHBondContact O-N 2.93Å; T173-Q175 PolarHBondContact O-N 3.37Å
174	L	50.8	Low	50.9	Low	127 Å²	127	63.8 Å²	63.8	67%	0.665	34%	0.337	S	S	*	.			trans	54.9	16.5	-173.4	-57.4	176	0	0	0	113.7	V169 H170	V169-L174 HydrophobicContact CG1-CD2 4.44Å; H170-L174 VanDerWaalsContact O-CA 3.28Å; H170-L174 WeakPolarHBondContact O-CA 3.26Å; H170-L174 PolarHBondContact O-N 2.62Å
175	Q	50.7	Low	52.2	Low	49 Å²	49	64 Å²	64	23%	0.229	33%	0.332	C	S	.	.			trans	-77.2	139.2	177.3	-74.1	-179.4	-4.8	0	0	110.5	V169 H170 T173 Y177	V169-Q175 WeakPolarHBondContact CA-O 3.48Å; H170-Q175 PolarHBondContact N-O 2.86Å; H170-Q175 VanDerWaalsContact N-O 3.08Å; T173-Q175 PolarHBondContact O-N 3.37Å; Q175-Y177 HydrophobicContact CB-CE1 3.89Å; Q175-Y177 PolarHBondContact OE1-OH 3.39Å
176	H	54.2	Low	53.1	Low	114 Å²	114	60.5 Å²	60.5	53%	0.528	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.5	179.9	-63.3	-83.4	0	0	0	110.7	I162 L167 W168 V169	I162-H176 VanDerWaalsContact CD1-CE1 3.42Å; I162-H176 WeakPolarHBondContact CD1-CE1 3.27Å; I162-H176 VanDerWaalsContact CD1-ND1 3.27Å; I162-H176 WeakPolarHBondContact CD1-ND1 3.3Å; L167-H176 HydrophobicContact CD2-CB 4.08Å; W168-H176 CarbonylContact O-C 3.57Å; W168-H176 WeakPolarHBondContact O-CA 3.19Å; V169-H176 VanDerWaalsContact CG2-ND1 3.27Å; V169-H176 WeakPolarHBondContact CG2-ND1 3.47Å
177	Y	55.4	Low	54.1	Low	18 Å²	18	57.6 Å²	57.6	7%	0.071	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.5	177.8	-50.5	-49.1	0	0	0	111.6	L167 W168 H170 Q175 I315	L167-Y177 WeakPolarHBondContact CA-O 3.32Å; W168-Y177 HydrophobicContact CB-CD2 4.48Å; W168-Y177 PolarHBondContact N-O 3Å; W168-Y177 PolarHBondContact O-N 3.46Å; H170-Y177 HydrophobicContact CB-CE2 3.8Å; Q175-Y177 HydrophobicContact CB-CE1 3.89Å; Q175-Y177 PolarHBondContact OE1-OH 3.39Å; Y177-I315 HydrophobicContact CD1-CB 3.68Å; Y177-I315 HydrophobicContact CD1-CD1 3.74Å; Y177-I315 HydrophobicContact CD1-CG1 4.07Å; Y177-I315 HydrophobicContact CD1-CG2 4.27Å; Y177-I315 HydrophobicContact CE1-CB 4.19Å; Y177-I315 HydrophobicContact CE1-CD1 3.27Å; Y177-I315 HydrophobicContact CE1-CG1 4.07Å
178	S	55.7	Low	55.2	Low	30 Å²	30	55.1 Å²	55.1	21%	0.21	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	111.8	173.6	-166.1	0	0	0	0	110.4	K166 I315 Q316 V317	K166-S178 WeakPolarHBondContact O-CA 3.42Å; K166-S178 PolarHBondContact O-OG 3.46Å; S178-I315 PolarHBondContact N-O 2.74Å; S178-I315 VanDerWaalsContact N-O 3.16Å; S178-Q316 WeakPolarHBondContact O-CA 3.42Å; S178-V317 PolarHBondContact O-N 3.14Å
179	L	58.6	Low	56.3	Low	30 Å²	30	59.4 Å²	59.4	16%	0.157	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	127.4	173.3	-176.3	67.2	0	0	0	109	W168 F181 V317	W168-L179 HydrophobicContact CZ2-CD2 3.8Å; W168-L179 VanDerWaalsContact NE1-CD2 3.29Å; L179-F181 HydrophobicContact CD1-CZ 4.5Å; L179-F181 HydrophobicContact CD2-CE2 3.56Å; L179-F181 HydrophobicContact CD2-CZ 3.7Å; L179-F181 HydrophobicContact CG-CE2 3.97Å; L179-F181 HydrophobicContact CG-CZ 4.21Å; L179-V317 HydrophobicContact CD1-CB 3.47Å; L179-V317 VanDerWaalsContact CD1-CB 3.47Å; L179-V317 HydrophobicContact CD1-CG1 3.43Å; L179-V317 VanDerWaalsContact CD1-CG1 3.43Å; L179-V317 HydrophobicContact CD1-CG2 4.48Å
180	K	61.1	Low	57.5	Low	75 Å²	75	58.9 Å²	58.9	33%	0.326	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	121.1	171.6	-66.4	-166.2	-163.3	155.1	0	110.7	V182 V317 V318 D319	K180-V182 HydrophobicContact CB-CG2 4.34Å; K180-V317 PolarHBondContact N-O 2.96Å; K180-V318 WeakPolarHBondContact O-CA 3.13Å; K180-D319 PolarHBondContact O-N 2.98Å
181	F	59.9	Low	58.6	Low	92 Å²	92	58.4 Å²	58.4	40%	0.404	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.8	164.5	-63.5	-78	0	0	0	108.6	L179 D319 V321 I336	L179-F181 HydrophobicContact CD1-CZ 4.5Å; L179-F181 HydrophobicContact CD2-CE2 3.56Å; L179-F181 HydrophobicContact CD2-CZ 3.7Å; L179-F181 HydrophobicContact CG-CE2 3.97Å; L179-F181 HydrophobicContact CG-CZ 4.21Å; F181-D319 HydrophobicContact CD1-CB 3.95Å; F181-D319 HydrophobicContact CE1-CB 4.04Å; F181-V321 HydrophobicContact CB-CG2 4.48Å; F181-V321 HydrophobicContact CD1-CG2 4.05Å; F181-I336 HydrophobicContact CE2-CD1 4.16Å; F181-I336 HydrophobicContact CZ-CD1 3.92Å
182	V	61.4	Low	59.9	Low	11 Å²	11	55.8 Å²	55.8	7%	0.067	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.1	-177.4	-169.6	0	0	0	0	108.9	K180 A186 F188 V318 D319 I320 V321	K180-V182 HydrophobicContact CB-CG2 4.34Å; V182-A186 HydrophobicContact CG1-CB 4.08Å; V182-F188 HydrophobicContact CB-CB 4.43Å; V182-F188 HydrophobicContact CB-CD1 4.23Å; V182-F188 HydrophobicContact CB-CG 4.41Å; V182-F188 HydrophobicContact CG1-CB 3.8Å; V182-F188 HydrophobicContact CG1-CD1 3.72Å; V182-F188 HydrophobicContact CG1-CG 4.03Å; V182-F188 HydrophobicContact CG2-CB 3.8Å; V182-F188 HydrophobicContact CG2-CD1 4.22Å; V182-F188 HydrophobicContact CG2-CD2 4.42Å; V182-F188 HydrophobicContact CG2-CG 3.91Å; V182-V318 HydrophobicContact CB-CG1 4.49Å; V182-V318 HydrophobicContact CG2-CG1 3.95Å; V182-D319 PolarHBondContact N-O 3.09Å; V182-D319 VanDerWaalsContact N-O 3.09Å; V182-I320 WeakPolarHBondContact O-CA 3.44Å; V182-V321 PolarHBondContact O-N 2.97Å
183	P	60.5	Low	60.8	Low	43 Å²	43	52.6 Å²	52.6	28%	0.279	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	141	167.2	-20.8	30.4	0	0	0	110.5	D185 A186 F323	P183-D185 WeakPolarHBondContact CB-OD1 3.27Å; P183-D185 PolarHBondContact O-N 3.47Å; P183-A186 HydrophobicContact CB-CB 3.87Å; P183-A186 HydrophobicContact CG-CB 3.93Å; P183-A186 PolarHBondContact O-N 2.98Å; P183-F323 HydrophobicContact CB-CD2 4.23Å; P183-F323 HydrophobicContact CG-CD2 4.27Å
184	I	62	Low	61.1	Low	37 Å²	37	50.4 Å²	50.4	19%	0.19	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-27.4	179	-167.5	168.1	0	0	0	114.2	Y273 R289 I320 V321	I184-Y273 WeakPolarHBondContact O-CB 3.43Å; I184-R289 HydrophobicContact CD1-CG 3.97Å; I184-R289 VanDerWaalsContact CD1-NH2 3.34Å; I184-I320 HydrophobicContact CB-CG2 3.68Å; I184-I320 HydrophobicContact CD1-CG2 4.44Å; I184-I320 HydrophobicContact CG1-CG2 3.8Å; I184-V321 PolarHBondContact N-O 3.34Å
185	D	61.3	Low	61	Low	93 Å²	93	48.3 Å²	48.3	50%	0.497	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	7.1	-177.1	56.7	-39.3	0	0	0	113.2	P183 P272	P183-D185 WeakPolarHBondContact CB-OD1 3.27Å; P183-D185 PolarHBondContact O-N 3.47Å; D185-P272 WeakPolarHBondContact O-CB 3.44Å
186	A	59.5	Low	61	Low	30 Å²	30	48.6 Å²	48.6	25%	0.248	26%	0.261	C	S	.	.	S	Bend	trans	-110.3	136.4	-178.2	0	0	0	0	0	112.3	V182 P183	V182-A186 HydrophobicContact CG1-CB 4.08Å; P183-A186 HydrophobicContact CB-CB 3.87Å; P183-A186 HydrophobicContact CG-CB 3.93Å; P183-A186 PolarHBondContact O-N 2.98Å
187	P	66.3	Low	60.5	Low	73 Å²	73	49.4 Å²	49.4	47%	0.474	26%	0.263	S	S	.	.			trans	-64	145.6	169.2	21.9	-25.9	0	0	0	110.8	F270	P187-F270 WeakPolarHBondContact CA-O 3.42Å; P187-F270 WeakPolarHBondContact CB-O 3.38Å
188	F	70.3	Confident	60.3	Low	17 Å²	17	56.6 Å²	56.6	8%	0.075	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	160	170.7	68.8	-82.9	0	0	0	112.7	V182 V190 F270 S292 V318 I320	V182-F188 HydrophobicContact CB-CB 4.43Å; V182-F188 HydrophobicContact CB-CD1 4.23Å; V182-F188 HydrophobicContact CB-CG 4.41Å; V182-F188 HydrophobicContact CG1-CB 3.8Å; V182-F188 HydrophobicContact CG1-CD1 3.72Å; V182-F188 HydrophobicContact CG1-CG 4.03Å; V182-F188 HydrophobicContact CG2-CB 3.8Å; V182-F188 HydrophobicContact CG2-CD1 4.22Å; V182-F188 HydrophobicContact CG2-CD2 4.42Å; V182-F188 HydrophobicContact CG2-CG 3.91Å; F188-V190 HydrophobicContact CD2-CG2 4.17Å; F188-V190 HydrophobicContact CE2-CG2 3.92Å; F188-F270 HydrophobicContact CD1-CB 3.76Å; F188-F270 HydrophobicContact CD1-CD2 4.48Å; F188-F270 HydrophobicContact CD1-CG 4.38Å; F188-F270 AromaticContact CD2-CD2 3.93Å; F188-F270 HydrophobicContact CD2-CD2 3.93Å; F188-F270 HydrophobicContact CE1-CB 3.46Å; F188-F270 VanDerWaalsContact CE1-CB 3.46Å; F188-F270 HydrophobicContact CE1-CD1 4.45Å; F188-F270 AromaticContact CE1-CD2 3.91Å; F188-F270 HydrophobicContact CE1-CD2 3.91Å; F188-F270 AromaticContact CE1-CG 3.7Å; F188-F270 HydrophobicContact CE1-CG 3.7Å; F188-F270 HydrophobicContact CE2-CB 4.29Å; F188-F270 AromaticContact CE2-CD2 3.23Å; F188-F270 HydrophobicContact CE2-CD2 3.23Å; F188-F270 AromaticContact CE2-CE2 3.65Å; F188-F270 HydrophobicContact CE2-CE2 3.65Å; F188-F270 AromaticContact CE2-CG 3.94Å; F188-F270 HydrophobicContact CE2-CG 3.94Å; F188-F270 HydrophobicContact CG-CB 4.33Å; F188-F270 HydrophobicContact CZ-CB 3.75Å; F188-F270 HydrophobicContact CZ-CD1 4.15Å; F188-F270 AromaticContact CZ-CD2 3.23Å; F188-F270 HydrophobicContact CZ-CD2 3.23Å; F188-F270 AromaticContact CZ-CE2 3.73Å; F188-F270 HydrophobicContact CZ-CE2 3.73Å; F188-F270 AromaticContact CZ-CG 3.44Å; F188-F270 HydrophobicContact CZ-CG 3.44Å; F188-F270 VanDerWaalsContact CZ-CG 3.44Å; F188-F270 HydrophobicContact CZ-CZ 4.38Å; F188-F270 PolarHBondContact N-O 2.88Å; F188-F270 VanDerWaalsContact N-O 3.14Å; F188-F270 PolarHBondContact O-N 2.8Å; F188-S292 WeakPolarHBondContact CZ-O 3.27Å; F188-V318 HydrophobicContact CD2-CG1 4.19Å; F188-V318 HydrophobicContact CD2-CG2 4.24Å; F188-V318 HydrophobicContact CE1-CG1 4.41Å; F188-V318 HydrophobicContact CE2-CB 4.31Å; F188-V318 HydrophobicContact CE2-CG1 3.74Å; F188-V318 HydrophobicContact CE2-CG2 3.94Å; F188-V318 HydrophobicContact CZ-CG1 3.85Å; F188-I320 HydrophobicContact CE1-CD1 4.16Å; F188-I320 HydrophobicContact CZ-CD1 4.48Å
189	K	73.5	Confident	60.1	Low	117 Å²	117	56 Å²	56	51%	0.509	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.8	179.3	-36	-158.2	178.1	-179.3	0	110	L268 H269 Q316	K189-L268 WeakPolarHBondContact CA-O 2.99Å; K189-H269 VanDerWaalsContact CE-NE2 3.32Å; K189-H269 WeakPolarHBondContact CE-NE2 3.44Å; K189-Q316 PolarHBondContact O-NE2 3.23Å; K189-Q316 VanDerWaalsContact O-NE2 3.12Å; K189-Q316 PolarHBondContact O-OE1 3.47Å
190	V	71.5	Confident	59.8	Low	3 Å²	3	61.3 Å²	61.3	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.5	165.6	-175.7	0	0	0	0	107.3	F188 F208 Y267 L268 F270 F296 Q316	F188-V190 HydrophobicContact CD2-CG2 4.17Å; F188-V190 HydrophobicContact CE2-CG2 3.92Å; V190-F208 HydrophobicContact CG1-CD1 4.45Å; V190-F208 HydrophobicContact CG1-CE1 4.14Å; V190-Y267 WeakPolarHBondContact O-CA 2.94Å; V190-L268 HydrophobicContact CB-CB 4.05Å; V190-L268 PolarHBondContact N-O 3.15Å; V190-L268 PolarHBondContact O-N 3.27Å; V190-F270 HydrophobicContact CG2-CE2 4.17Å; V190-F296 HydrophobicContact CG1-CB 3.56Å; V190-F296 HydrophobicContact CG1-CG 4.19Å; V190-F296 HydrophobicContact CG2-CB 4.26Å; V190-F296 HydrophobicContact CG2-CD1 4.39Å; V190-F296 HydrophobicContact CG2-CD2 4.16Å; V190-F296 HydrophobicContact CG2-CG 4.01Å; V190-Q316 HydrophobicContact CG1-CB 4.33Å
191	P	67.7	Low	59.3	Low	26 Å²	26	62.3 Å²	62.3	17%	0.169	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	135.7	175	32.1	-26.3	0	0	0	109.9	Y267	P191-Y267 HydrophobicContact CB-CD1 4.08Å; P191-Y267 HydrophobicContact CB-CE1 3.83Å
192	C	68	Low	58.9	Low	1 Å²	1	60.1 Å²	60.1	1%	0.007	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	101	159.4	171.4	0	0	0	0	107.7	F208 G265 F266 C298	C192-F208 HydrophobicContact CB-CD1 4.48Å; C192-F208 HydrophobicContact CB-CE1 3.56Å; C192-F208 HydrophobicContact CB-CE2 4.2Å; C192-F208 HydrophobicContact CB-CZ 3.39Å; C192-G265 VanDerWaalsContact O-CA 3.22Å; C192-G265 WeakPolarHBondContact O-CA 3.46Å; C192-F266 WeakPolarHBondContact CA-O 3.41Å; C192-F266 HydrophobicContact CB-CB 4.21Å; C192-F266 WeakPolarHBondContact CB-O 3.39Å; C192-F266 PolarHBondContact N-O 1.98Å; C192-F266 PolarHBondContact O-N 2.99Å; C192-F266 VanDerWaalsContact O-N 3.15Å; C192-C298 HydrophobicContact CB-CB 3.41Å; C192-C298 VanDerWaalsContact CB-CB 3.41Å; C192-C298 WeakPolarHBondContact CB-SG 3.15Å; C192-C298 WeakPolarHBondContact SG-CB 3.37Å; C192-C298 CovalentContact SG-SG 2.01Å; C192-C298 PolarHBondContact SG-SG 3.46Å
193	Q	60.6	Low	58.6	Low	54 Å²	54	67.3 Å²	67.3	25%	0.252	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.1	174.3	-69.9	-178.9	-7.2	0	0	109.1	C195 D262 V314	Q193-C195 PolarHBondContact O-N 2.96Å; Q193-D262 HydrophobicContact CG-CB 4.02Å; Q193-D262 PolarHBondContact NE2-OD2 2.84Å; Q193-V314 HydrophobicContact CB-CG2 4.11Å; Q193-V314 HydrophobicContact CG-CG2 4.46Å
194	V	53.9	Low	58.2	Low	19 Å²	19	67.1 Å²	67.1	12%	0.115	35%	0.354	C	S	.	.			trans	-93.8	81.3	175.6	-173.4	0	0	0	0	107.3	T196 R199 N206 F266	V194-T196 VanDerWaalsContact C-N 3.28Å; V194-T196 PolarHBondContact O-N 3.12Å; V194-R199 HydrophobicContact CG1-CB 3.4Å; V194-R199 VanDerWaalsContact CG1-CB 3.4Å; V194-R199 HydrophobicContact CG1-CG 4.21Å; V194-N206 WeakPolarHBondContact CG2-ND2 3.47Å; V194-F266 HydrophobicContact CG2-CD2 4.19Å; V194-F266 HydrophobicContact CG2-CE2 4.43Å
195	C	49.7	Very low	58.2	Low	82 Å²	82	75.1 Å²	75.1	55%	0.554	38%	0.382	S	S	*	.			trans	-73.4	-18.3	-170	-70	0	0	0	0	113.8	Q193	Q193-C195 PolarHBondContact O-N 2.96Å
196	T	50.7	Low	58.3	Low	55 Å²	55	71.2 Å²	71.2	34%	0.337	36%	0.361	S	S	.	.			trans	-106.5	126.2	-174.2	69.1	0	0	0	0	113.2	V194 K198 R199	V194-T196 VanDerWaalsContact C-N 3.28Å; V194-T196 PolarHBondContact O-N 3.12Å; T196-K198 PolarHBondContact O-N 3.31Å; T196-R199 WeakPolarHBondContact O-CB 3.48Å; T196-R199 PolarHBondContact O-N 3.42Å; T196-R199 WeakPolarHBondContact OG1-CG 3.48Å
197	K	43.7	Very low	58.6	Low	131 Å²	131	70.9 Å²	70.9	57%	0.57	36%	0.356	S	S	*	.	H	α-helix	trans	-55.1	-23.8	175.2	-151.3	179	-170.4	-179.5	0	113.4	S201 N525	K197-S201 PolarHBondContact O-OG 2.91Å; K197-N525 VanDerWaalsContact CE-OD1 3.31Å; K197-N525 WeakPolarHBondContact CE-OD1 3.46Å; K197-N525 PolarHBondContact NZ-OD1 3.22Å
198	K	51	Low	59.1	Low	169 Å²	169	67.4 Å²	67.4	74%	0.735	33%	0.333	S	S	*	.	H	α-helix	trans	-64.1	-44.7	173.1	-105.9	-178.3	175.9	179.5	0	111.4	T196 Y200 S201 S202	T196-K198 PolarHBondContact O-N 3.31Å; K198-Y200 PolarHBondContact O-N 2.8Å; K198-S201 PolarHBondContact O-N 3.33Å; K198-S201 VanDerWaalsContact O-N 3.14Å; K198-S201 PolarHBondContact O-OG 2.93Å; K198-S202 WeakPolarHBondContact O-CB 3.44Å; K198-S202 PolarHBondContact O-N 3.15Å; K198-S202 VanDerWaalsContact O-N 3.13Å; K198-S202 PolarHBondContact O-OG 2.93Å
199	R	52.1	Low	59.4	Low	17 Å²	17	66.7 Å²	66.7	6%	0.064	33%	0.33	C	S	.	.	H	α-helix	trans	-58.7	-45.5	-178.1	-83.9	177.3	-177	-169	-9.2	113.2	V194 T196 S201 S202 E300 E313	V194-R199 HydrophobicContact CG1-CB 3.4Å; V194-R199 VanDerWaalsContact CG1-CB 3.4Å; V194-R199 HydrophobicContact CG1-CG 4.21Å; T196-R199 WeakPolarHBondContact O-CB 3.48Å; T196-R199 PolarHBondContact O-N 3.42Å; T196-R199 WeakPolarHBondContact OG1-CG 3.48Å; R199-S201 PolarHBondContact O-N 3.19Å; R199-S202 WeakPolarHBondContact CA-OG 3.42Å; R199-S202 PolarHBondContact O-N 3.23Å; R199-S202 PolarHBondContact O-OG 3.41Å; R199-S202 VanDerWaalsContact O-OG 3.12Å; R199-E300 VanDerWaalsContact CG-CD 3.43Å; R199-E300 HydrophobicContact CG-CG 3.75Å; R199-E300 IonicContact NE-OE2 3.95Å; R199-E300 PolarHBondContact NE-OE2 3.31Å; R199-E313 VanDerWaalsContact CZ-CD 3.47Å; R199-E313 IonicContact CZ-OE1 3.05Å; R199-E313 VanDerWaalsContact CZ-OE1 3.22Å; R199-E313 IonicContact CZ-OE2 3.88Å; R199-E313 IonicContact NE-OE1 2.72Å; R199-E313 IonicContact NH1-OE1 3.56Å; R199-E313 PolarHBondContact NH1-OE1 3.38Å; R199-E313 IonicContact NH1-OE2 3.71Å; R199-E313 PolarHBondContact NH1-OE2 2.74Å; R199-E313 IonicContact NH2-OE1 3.67Å; R199-E313 PolarHBondContact NH2-OE1 3.22Å; R199-E313 IonicContact NH2-OE2 3.77Å
200	Y	50.3	Low	59.8	Low	142 Å²	142	62 Å²	62	56%	0.557	31%	0.31	S	S	*	.	H	α-helix	trans	-64.9	-28.4	-180	-147.1	-84.7	0	0	0	112.5	K198	K198-Y200 PolarHBondContact O-N 2.8Å
201	S	51	Low	60	Low	97 Å²	97	61.9 Å²	61.9	68%	0.678	31%	0.309	S	S	*	.	H	α-helix	trans	-90.9	-13.9	-178.1	67.3	0	0	0	0	114.7	K197 K198 R199	K197-S201 PolarHBondContact O-OG 2.91Å; K198-S201 PolarHBondContact O-N 3.33Å; K198-S201 VanDerWaalsContact O-N 3.14Å; K198-S201 PolarHBondContact O-OG 2.93Å; R199-S201 PolarHBondContact O-N 3.19Å
202	S	53	Low	60.2	Low	46 Å²	46	68.3 Å²	68.3	32%	0.322	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-0.1	-167.6	55.5	0	0	0	0	114.9	K198 R199 I204	K198-S202 WeakPolarHBondContact O-CB 3.44Å; K198-S202 PolarHBondContact O-N 3.15Å; K198-S202 VanDerWaalsContact O-N 3.13Å; K198-S202 PolarHBondContact O-OG 2.93Å; R199-S202 WeakPolarHBondContact CA-OG 3.42Å; R199-S202 PolarHBondContact O-N 3.23Å; R199-S202 PolarHBondContact O-OG 3.41Å; R199-S202 VanDerWaalsContact O-OG 3.12Å; S202-I204 PolarHBondContact O-N 2.06Å; S202-I204 VanDerWaalsContact O-N 3.09Å; S202-I204 WeakPolarHBondContact OG-CD1 3.16Å; S202-I204 WeakPolarHBondContact OG-CG1 3.42Å
203	N	53.2	Low	60.1	Low	162 Å²	162	72.8 Å²	72.8	87%	0.866	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	16.1	-171.1	-96.1	0.3	0	0	0	113.5	R205	N203-R205 PolarHBondContact O-N 2.96Å
204	I	54	Low	60.4	Low	38 Å²	38	77 Å²	77	20%	0.195	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-81.4	123.4	-179.4	-57.1	172.4	0	0	0	107.6	S202 E300 G301	S202-I204 PolarHBondContact O-N 2.06Å; S202-I204 VanDerWaalsContact O-N 3.09Å; S202-I204 WeakPolarHBondContact OG-CD1 3.16Å; S202-I204 WeakPolarHBondContact OG-CG1 3.42Å; I204-E300 HydrophobicContact CB-CG 4.21Å; I204-E300 WeakPolarHBondContact CD1-OE1 3.16Å; I204-E300 HydrophobicContact CG2-CB 4.2Å; I204-E300 HydrophobicContact CG2-CG 3.58Å; I204-G301 WeakPolarHBondContact CG2-O 3.45Å
205	R	60.3	Low	61.1	Low	205 Å²	205	76.4 Å²	76.4	77%	0.774	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-73	135.9	-177.2	-68.5	-176.9	179.9	-177	-0.5	109.5	N203 V207 G301	N203-R205 PolarHBondContact O-N 2.96Å; R205-V207 PolarHBondContact O-N 3.4Å; R205-G301 PolarHBondContact O-N 3.34Å
206	N	64.7	Low	61.9	Low	11 Å²	11	73.6 Å²	73.6	6%	0.059	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	126	164.9	-71.1	-56.4	0	0	0	108.3	V194 F266	V194-N206 WeakPolarHBondContact CG2-ND2 3.47Å; N206-F266 HydrophobicContact CB-CD2 3.99Å; N206-F266 HydrophobicContact CB-CE2 4.36Å; N206-F266 HydrophobicContact CB-CG 4.38Å; N206-F266 WeakPolarHBondContact ND2-CD2 3.49Å; N206-F266 WeakPolarHBondContact ND2-CE2 3.44Å
207	V	66.1	Low	62.4	Low	23 Å²	23	73 Å²	73	14%	0.139	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119	175.5	-178.8	0	0	0	0	106.7	R205 F209 P231 Y233 M299	R205-V207 PolarHBondContact O-N 3.4Å; V207-F209 HydrophobicContact CB-CD2 4.27Å; V207-F209 HydrophobicContact CB-CE2 3.6Å; V207-F209 HydrophobicContact CB-CZ 4.28Å; V207-F209 HydrophobicContact CG1-CD2 3.94Å; V207-F209 HydrophobicContact CG1-CE2 3.39Å; V207-F209 HydrophobicContact CG1-CZ 3.77Å; V207-F209 VanDerWaalsContact O-CD2 3.31Å; V207-F209 WeakPolarHBondContact O-CD2 3.38Å; V207-P231 HydrophobicContact CG1-CB 3.85Å; V207-Y233 HydrophobicContact CG1-CD2 4.38Å; V207-Y233 HydrophobicContact CG1-CE2 4.24Å; V207-M299 PolarHBondContact N-O 3.39Å; V207-M299 PolarHBondContact O-N 2.69Å; V207-M299 VanDerWaalsContact O-N 3.15Å
208	F	75.3	Confident	63.4	Low	1 Å²	1	71 Å²	71	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	133.4	166.1	-73.7	-85.4	0	0	0	107.7	V190 C192 P231 F232 M251 F266 L268	V190-F208 HydrophobicContact CG1-CD1 4.45Å; V190-F208 HydrophobicContact CG1-CE1 4.14Å; C192-F208 HydrophobicContact CB-CD1 4.48Å; C192-F208 HydrophobicContact CB-CE1 3.56Å; C192-F208 HydrophobicContact CB-CE2 4.2Å; C192-F208 HydrophobicContact CB-CZ 3.39Å; F208-P231 CarbonylContact O-C 3.6Å; F208-F232 HydrophobicContact CB-CB 3.8Å; F208-F232 HydrophobicContact CB-CG 4.43Å; F208-F232 VanDerWaalsContact O-CB 3.27Å; F208-F232 WeakPolarHBondContact O-CB 2.96Å; F208-F232 PolarHBondContact O-N 2.77Å; F208-M251 HydrophobicContact CD2-SD 4.48Å; F208-M251 HydrophobicContact CE2-SD 4.32Å; F208-F266 HydrophobicContact CE2-CB 3.94Å; F208-F266 HydrophobicContact CZ-CB 4.1Å; F208-L268 HydrophobicContact CD1-CB 4.49Å; F208-L268 HydrophobicContact CD2-CD1 4.29Å; F208-L268 HydrophobicContact CE1-CB 4.18Å; F208-L268 HydrophobicContact CE2-CD1 4.48Å; F208-L268 HydrophobicContact CZ-CB 4.2Å
209	F	77.6	Confident	64.1	Low	2 Å²	2	65.1 Å²	65.1	1%	0.009	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.7	170.4	-73.2	-101.1	0	0	0	108.5	V207 Q230 P231 F296 Y297 M299 I307	V207-F209 HydrophobicContact CB-CD2 4.27Å; V207-F209 HydrophobicContact CB-CE2 3.6Å; V207-F209 HydrophobicContact CB-CZ 4.28Å; V207-F209 HydrophobicContact CG1-CD2 3.94Å; V207-F209 HydrophobicContact CG1-CE2 3.39Å; V207-F209 HydrophobicContact CG1-CZ 3.77Å; V207-F209 VanDerWaalsContact O-CD2 3.31Å; V207-F209 WeakPolarHBondContact O-CD2 3.38Å; F209-Q230 WeakPolarHBondContact CA-O 3.41Å; F209-P231 HydrophobicContact CD1-CG 4.37Å; F209-P231 HydrophobicContact CE1-CB 4.39Å; F209-P231 HydrophobicContact CE1-CG 3.79Å; F209-P231 HydrophobicContact CZ-CG 4.29Å; F209-F296 WeakPolarHBondContact O-CA 3.35Å; F209-Y297 HydrophobicContact CB-CD1 3.83Å; F209-Y297 HydrophobicContact CB-CD2 4.19Å; F209-Y297 HydrophobicContact CB-CE1 3.23Å; F209-Y297 HydrophobicContact CB-CE2 3.69Å; F209-Y297 HydrophobicContact CB-CG 4.27Å; F209-Y297 WeakPolarHBondContact CB-OH 3.48Å; F209-Y297 HydrophobicContact CD2-CE2 4.1Å; F209-Y297 HydrophobicContact CG-CE1 4.21Å; F209-Y297 AromaticContact CG-CE2 3.93Å; F209-Y297 HydrophobicContact CG-CE2 3.93Å; F209-Y297 AromaticContact CG-CZ 3.67Å; F209-Y297 PolarHBondContact N-O 2.99Å; F209-Y297 PolarHBondContact O-N 3.34Å; F209-M299 HydrophobicContact CD2-CG 3.29Å; F209-M299 HydrophobicContact CD2-SD 3.79Å; F209-M299 HydrophobicContact CE1-SD 4.33Å; F209-M299 HydrophobicContact CE2-CB 4.49Å; F209-M299 HydrophobicContact CE2-CE 4.23Å; F209-M299 HydrophobicContact CE2-CG 3.05Å; F209-M299 HydrophobicContact CE2-SD 3.44Å; F209-M299 WeakPolarHBondContact CE2-SD 3.39Å; F209-M299 HydrophobicContact CG-CG 4.33Å; F209-M299 HydrophobicContact CG-SD 4.38Å; F209-M299 HydrophobicContact CZ-CE 4.26Å; F209-M299 HydrophobicContact CZ-CG 3.95Å; F209-M299 HydrophobicContact CZ-SD 3.74Å; F209-I307 HydrophobicContact CE1-CD1 4.03Å; F209-I307 HydrophobicContact CZ-CD1 3.79Å
210	K	82.2	Confident	64.3	Low	19 Å²	19	67.3 Å²	67.3	8%	0.083	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.6	171.9	174.4	171	158.8	-120.4	0	108.8	C229 Q230 F232 D235 S290 L291 S293 I295 F296	K210-C229 WeakPolarHBondContact O-CA 3.47Å; K210-Q230 PolarHBondContact N-O 2.87Å; K210-Q230 PolarHBondContact O-N 3.18Å; K210-F232 HydrophobicContact CB-CB 4.41Å; K210-F232 HydrophobicContact CB-CD2 3.86Å; K210-F232 HydrophobicContact CD-CD2 3.91Å; K210-F232 HydrophobicContact CD-CE2 4.11Å; K210-D235 WeakPolarHBondContact CD-OD2 3.31Å; K210-D235 IonicContact NZ-OD2 3.18Å; K210-D235 PolarHBondContact NZ-OD2 2.7Å; K210-S290 WeakPolarHBondContact CE-O 3.3Å; K210-S290 PolarHBondContact NZ-O 3.14Å; K210-L291 WeakPolarHBondContact CD-O 3.25Å; K210-L291 WeakPolarHBondContact CE-O 3.3Å; K210-L291 VanDerWaalsContact NZ-CA 3.35Å; K210-L291 PolarHBondContact NZ-O 3.4Å; K210-S293 WeakPolarHBondContact CE-O 3.47Å; K210-I295 CarbonylContact C-O 3.59Å; K210-I295 WeakPolarHBondContact CA-O 3.07Å; K210-F296 HydrophobicContact CB-CD1 4.48Å; K210-F296 HydrophobicContact CB-CE1 4.43Å; K210-F296 HydrophobicContact CD-CE1 4Å; K210-F296 HydrophobicContact CD-CZ 4.08Å; K210-F296 HydrophobicContact CG-CE1 4.42Å
211	C	75.8	Confident	64.8	Low	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.9	168.3	-58.5	0	0	0	0	109.5	F216 C229 I295 Y297	C211-F216 HydrophobicContact CB-CB 3.87Å; C211-C229 HydrophobicContact CB-CB 4.17Å; C211-C229 WeakPolarHBondContact CB-SG 3.37Å; C211-C229 WeakPolarHBondContact SG-CB 3.36Å; C211-C229 CovalentContact SG-SG 2.02Å; C211-C229 PolarHBondContact SG-SG 3.32Å; C211-I295 HydrophobicContact CB-CB 4.25Å; C211-I295 PolarHBondContact N-O 3.36Å; C211-I295 PolarHBondContact O-N 3.07Å; C211-Y297 WeakPolarHBondContact SG-CE1 3.44Å
212	K	71.4	Confident	65.3	Low	161 Å²	161	64.1 Å²	64.1	70%	0.7	32%	0.324	S	S	*	.			trans	-62.5	138.1	156.8	-67.5	-176.9	-179.5	177.5	0	108.7	K214 A215 F216	K212-K214 VanDerWaalsContact C-N 3.26Å; K212-K214 PolarHBondContact O-N 3.22Å; K212-A215 HydrophobicContact CB-CB 4.39Å; K212-A215 PolarHBondContact O-N 3.41Å; K212-F216 PolarHBondContact O-N 3Å
213	L	66.4	Low	65.7	Low	94 Å²	94	63.6 Å²	63.6	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-49.9	-47.3	-179.3	178.5	62.1	0	0	0	112.2	A215 F216 I217 I295 V317	L213-A215 PolarHBondContact O-N 3.38Å; L213-F216 PolarHBondContact O-N 3.06Å; L213-I217 HydrophobicContact CD1-CD1 4.08Å; L213-I217 HydrophobicContact CG-CD1 4.06Å; L213-I217 WeakPolarHBondContact O-CD1 3.4Å; L213-I217 VanDerWaalsContact O-CG1 3.27Å; L213-I217 WeakPolarHBondContact O-CG1 3.41Å; L213-I217 PolarHBondContact O-N 3.28Å; L213-I217 VanDerWaalsContact O-N 3.14Å; L213-I295 HydrophobicContact CD1-CD1 3.47Å; L213-I295 VanDerWaalsContact CD1-CD1 3.47Å; L213-I295 HydrophobicContact CD1-CG1 4.01Å; L213-V317 HydrophobicContact CD1-CG1 4.34Å
214	K	65.2	Low	65.8	Low	142 Å²	142	64.3 Å²	64.3	62%	0.617	32%	0.324	S	S	*	.	H	α-helix	trans	-53.7	-42.7	177.9	-177.9	178.8	176.9	-174	0	112.3	K212 I217 E218	K212-K214 VanDerWaalsContact C-N 3.26Å; K212-K214 PolarHBondContact O-N 3.22Å; K214-I217 PolarHBondContact O-N 3.13Å; K214-E218 WeakPolarHBondContact CE-OE1 3.22Å; K214-E218 WeakPolarHBondContact O-CG 2.81Å; K214-E218 PolarHBondContact O-N 3.44Å; K214-E218 VanDerWaalsContact O-N 3.07Å
215	A	68.9	Low	65.8	Low	8 Å²	8	63.6 Å²	63.6	7%	0.066	32%	0.322	C	S	.	.	H	α-helix	trans	-89.6	-25	-167.9	0	0	0	0	0	112.8	K212 L213 I217 E218 L219 S228	K212-A215 HydrophobicContact CB-CB 4.39Å; K212-A215 PolarHBondContact O-N 3.41Å; L213-A215 PolarHBondContact O-N 3.38Å; A215-I217 VanDerWaalsContact C-N 3.34Å; A215-E218 PolarHBondContact O-N 3.46Å; A215-L219 WeakPolarHBondContact O-CB 3.02Å; A215-L219 PolarHBondContact O-N 3.01Å; A215-S228 WeakPolarHBondContact CB-OG 3Å
216	F	66.9	Low	65.4	Low	23 Å²	23	62.8 Å²	62.8	10%	0.101	32%	0.324	C	S	.	.	H	α-helix	trans	-60.6	-44.6	161.1	176.1	-95.5	0	0	0	111.1	C211 K212 L213 E218 L219 D220 I295 I315	C211-F216 HydrophobicContact CB-CB 3.87Å; K212-F216 PolarHBondContact O-N 3Å; L213-F216 PolarHBondContact O-N 3.06Å; F216-E218 VanDerWaalsContact C-N 3.31Å; F216-E218 PolarHBondContact O-N 3.3Å; F216-L219 WeakPolarHBondContact O-CB 3.43Å; F216-L219 PolarHBondContact O-N 3.41Å; F216-L219 VanDerWaalsContact O-N 3.16Å; F216-D220 HydrophobicContact CE1-CB 4.5Å; F216-D220 WeakPolarHBondContact O-CB 3.4Å; F216-D220 PolarHBondContact O-N 3.1Å; F216-I295 HydrophobicContact CB-CB 4.42Å; F216-I295 HydrophobicContact CB-CD1 3.6Å; F216-I295 HydrophobicContact CB-CG1 4.38Å; F216-I295 HydrophobicContact CD1-CD1 3.22Å; F216-I295 HydrophobicContact CD2-CD1 4.21Å; F216-I295 HydrophobicContact CD2-CG2 3.95Å; F216-I295 HydrophobicContact CE1-CD1 3.95Å; F216-I295 HydrophobicContact CE2-CG2 4.29Å; F216-I295 HydrophobicContact CG-CB 4.42Å; F216-I295 HydrophobicContact CG-CD1 3.38Å; F216-I295 HydrophobicContact CG-CG1 4.41Å; F216-I295 HydrophobicContact CG-CG2 4.16Å; F216-I315 HydrophobicContact CE2-CD1 3.7Å; F216-I315 HydrophobicContact CE2-CG2 4.33Å; F216-I315 HydrophobicContact CZ-CD1 3.55Å; F216-I315 HydrophobicContact CZ-CG2 4.19Å
217	I	60.3	Low	64.9	Low	43 Å²	43	67 Å²	67	22%	0.221	36%	0.355	C	S	.	.	H	α-helix	trans	-64.2	-38.8	178.9	-63.9	165.6	0	0	0	111.1	F151 L213 K214 A215 L219 K221	F151-I217 HydrophobicContact CE1-CD1 4.44Å; F151-I217 HydrophobicContact CE2-CG2 4.02Å; F151-I217 HydrophobicContact CZ-CD1 3.88Å; F151-I217 HydrophobicContact CZ-CG2 3.87Å; L213-I217 HydrophobicContact CD1-CD1 4.08Å; L213-I217 HydrophobicContact CG-CD1 4.06Å; L213-I217 WeakPolarHBondContact O-CD1 3.4Å; L213-I217 VanDerWaalsContact O-CG1 3.27Å; L213-I217 WeakPolarHBondContact O-CG1 3.41Å; L213-I217 PolarHBondContact O-N 3.28Å; L213-I217 VanDerWaalsContact O-N 3.14Å; K214-I217 PolarHBondContact O-N 3.13Å; A215-I217 VanDerWaalsContact C-N 3.34Å; I217-L219 VanDerWaalsContact C-N 3.34Å; I217-K221 HydrophobicContact CG2-CD 4.36Å; I217-K221 VanDerWaalsContact O-CG 3.3Å; I217-K221 WeakPolarHBondContact O-CG 3.48Å; I217-K221 PolarHBondContact O-N 3.11Å
218	E	65.3	Low	64.8	Low	87 Å²	87	67.1 Å²	67.1	41%	0.407	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-40.4	173.7	-73.4	168.9	-177.8	0	0	112	K214 A215 F216 G223	K214-E218 WeakPolarHBondContact CE-OE1 3.22Å; K214-E218 WeakPolarHBondContact O-CG 2.81Å; K214-E218 PolarHBondContact O-N 3.44Å; K214-E218 VanDerWaalsContact O-N 3.07Å; A215-E218 PolarHBondContact O-N 3.46Å; F216-E218 VanDerWaalsContact C-N 3.31Å; F216-E218 PolarHBondContact O-N 3.3Å; E218-G223 VanDerWaalsContact O-CA 3.25Å; E218-G223 WeakPolarHBondContact O-CA 3.33Å; E218-G223 PolarHBondContact O-N 3.21Å
219	L	65.1	Low	64.6	Low	47 Å²	47	67.4 Å²	67.4	25%	0.246	36%	0.359	C	S	.	.	H	α-helix	trans	-65.5	-45.7	176.8	-163.7	109.7	0	0	0	112	A215 F216 I217 K221 G222 Y309	A215-L219 WeakPolarHBondContact O-CB 3.02Å; A215-L219 PolarHBondContact O-N 3.01Å; F216-L219 WeakPolarHBondContact O-CB 3.43Å; F216-L219 PolarHBondContact O-N 3.41Å; F216-L219 VanDerWaalsContact O-N 3.16Å; I217-L219 VanDerWaalsContact C-N 3.34Å; L219-K221 PolarHBondContact O-N 2.95Å; L219-G222 PolarHBondContact O-N 3.37Å; L219-Y309 HydrophobicContact CD1-CD2 4.03Å; L219-Y309 HydrophobicContact CD1-CE2 3.96Å
220	D	58.3	Low	64.5	Low	63 Å²	63	71.3 Å²	71.3	34%	0.337	38%	0.377	S	S	.	.	H	α-helix	trans	-63.7	-30.5	-179.3	-168.7	52.9	0	0	0	112.3	H170 F216 G222	H170-D220 IonicContact CD2-OD2 3.65Å; H170-D220 IonicContact NE2-OD2 2.71Å; F216-D220 HydrophobicContact CE1-CB 4.5Å; F216-D220 WeakPolarHBondContact O-CB 3.4Å; F216-D220 PolarHBondContact O-N 3.1Å; D220-G222 PolarHBondContact O-N 3.01Å; D220-G222 VanDerWaalsContact O-N 3.17Å
221	K	60.8	Low	64	Low	100 Å²	100	71.9 Å²	71.9	44%	0.435	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	8.4	173.5	-69.6	-176.5	-174.2	-156.9	0	114.4	E155 I217 L219 G223	E155-K221 VanDerWaalsContact CD-NZ 3.29Å; E155-K221 VanDerWaalsContact OE1-CE 3.28Å; E155-K221 WeakPolarHBondContact OE1-CE 3.19Å; E155-K221 IonicContact OE1-NZ 3.22Å; E155-K221 PolarHBondContact OE1-NZ 3.28Å; I217-K221 HydrophobicContact CG2-CD 4.36Å; I217-K221 VanDerWaalsContact O-CG 3.3Å; I217-K221 WeakPolarHBondContact O-CG 3.48Å; I217-K221 PolarHBondContact O-N 3.11Å; L219-K221 PolarHBondContact O-N 2.95Å; K221-G223 PolarHBondContact O-N 3.01Å
222	G	60.6	Low	64	Low	71 Å²	71	71.9 Å²	71.9	73%	0.732	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	14.2	-175.5	0	0	0	0	0	113.6	L219 D220	L219-G222 PolarHBondContact O-N 3.37Å; D220-G222 PolarHBondContact O-N 3.01Å; D220-G222 VanDerWaalsContact O-N 3.17Å
223	G	61.4	Low	63.9	Low	35 Å²	35	68 Å²	68	36%	0.361	36%	0.364	S	S	.	.			trans	-72	135.5	172.1	0	0	0	0	0	110.6	E218 K221 S225	E218-G223 VanDerWaalsContact O-CA 3.25Å; E218-G223 WeakPolarHBondContact O-CA 3.33Å; E218-G223 PolarHBondContact O-N 3.21Å; K221-G223 PolarHBondContact O-N 3.01Å; G223-S225 VanDerWaalsContact C-N 3.26Å; G223-S225 PolarHBondContact O-N 2.87Å
224	Q	56	Low	63.9	Low	177 Å²	177	68.7 Å²	68.7	83%	0.827	37%	0.365	S	S	*	.			trans	-70.7	84.6	168.2	-72	-173.6	-1.4	0	0	109.2	K226	Q224-K226 PolarHBondContact O-N 3.11Å
225	S	54.2	Low	63.9	Low	23 Å²	23	64.6 Å²	64.6	16%	0.161	35%	0.35	C	S	.	.			trans	-69.1	103.7	166.5	175.8	0	0	0	0	108.1	G223 S227 S228	G223-S225 VanDerWaalsContact C-N 3.26Å; G223-S225 PolarHBondContact O-N 2.87Å; S225-S227 PolarHBondContact O-N 2.96Å; S225-S228 PolarHBondContact OG-OG 3.44Å
226	K	51.7	Low	63.8	Low	188 Å²	188	65.4 Å²	65.4	82%	0.817	35%	0.354	S	S	*	.	S	Bend	trans	-69.2	-9.8	179.8	-82.3	-174.6	175.5	-179.9	0	114.1	Q224	Q224-K226 PolarHBondContact O-N 3.11Å
227	S	52.9	Low	63.7	Low	100 Å²	100	69.9 Å²	69.9	70%	0.699	38%	0.383	S	S	*	.	S	Bend	trans	-166.3	25.2	-165.1	65	0	0	0	0	120	S225	S225-S227 PolarHBondContact O-N 2.96Å
228	S	65.1	Low	64	Low	25 Å²	25	69.4 Å²	69.4	18%	0.175	39%	0.389	C	S	.	.			trans	-117.4	-13	-168.1	70	0	0	0	0	118.4	A215 S225	A215-S228 WeakPolarHBondContact CB-OG 3Å; S225-S228 PolarHBondContact OG-OG 3.44Å
229	C	70.5	Confident	63.9	Low	7 Å²	7	66.2 Å²	66.2	5%	0.047	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	93.7	-176.9	-64.9	0	0	0	0	107.5	K210 C211 Y297 Y309	K210-C229 WeakPolarHBondContact O-CA 3.47Å; C211-C229 HydrophobicContact CB-CB 4.17Å; C211-C229 WeakPolarHBondContact CB-SG 3.37Å; C211-C229 WeakPolarHBondContact SG-CB 3.36Å; C211-C229 CovalentContact SG-SG 2.02Å; C211-C229 PolarHBondContact SG-SG 3.32Å; C229-Y297 HydrophobicContact CB-CE1 4.44Å; C229-Y309 HydrophobicContact CB-CE1 4.15Å; C229-Y309 PolarHBondContact O-OH 3.29Å
230	Q	75.1	Confident	64	Low	85 Å²	85	67.3 Å²	67.3	40%	0.397	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	150.3	-177	-72	-173.8	-17.8	0	0	110.3	F209 K210 F232	F209-Q230 WeakPolarHBondContact CA-O 3.41Å; K210-Q230 PolarHBondContact N-O 2.87Å; K210-Q230 PolarHBondContact O-N 3.18Å; Q230-F232 PolarHBondContact O-N 3.16Å; Q230-F232 VanDerWaalsContact O-N 3.15Å
231	P	73	Confident	64.4	Low	31 Å²	31	70.8 Å²	70.8	20%	0.201	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49	123.3	162.4	-22.6	32.1	0	0	0	108.3	V207 F208 F209 Y233 E234	V207-P231 HydrophobicContact CG1-CB 3.85Å; F208-P231 CarbonylContact O-C 3.6Å; F209-P231 HydrophobicContact CD1-CG 4.37Å; F209-P231 HydrophobicContact CE1-CB 4.39Å; F209-P231 HydrophobicContact CE1-CG 3.79Å; F209-P231 HydrophobicContact CZ-CG 4.29Å; P231-Y233 PolarHBondContact O-N 3.02Å; P231-E234 HydrophobicContact CB-CG 4.26Å; P231-E234 HydrophobicContact CG-CG 4.45Å; P231-E234 WeakPolarHBondContact O-CB 3.42Å; P231-E234 PolarHBondContact O-N 3.22Å
232	F	74.8	Confident	64.6	Low	0 Å²	0	69.4 Å²	69.4	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-55.5	-30.5	-175.2	175.4	-95.3	0	0	0	111.7	F208 K210 Q230 E234 D235 T236 M249 L268 F270 L291 F296	F208-F232 HydrophobicContact CB-CB 3.8Å; F208-F232 HydrophobicContact CB-CG 4.43Å; F208-F232 VanDerWaalsContact O-CB 3.27Å; F208-F232 WeakPolarHBondContact O-CB 2.96Å; F208-F232 PolarHBondContact O-N 2.77Å; K210-F232 HydrophobicContact CB-CB 4.41Å; K210-F232 HydrophobicContact CB-CD2 3.86Å; K210-F232 HydrophobicContact CD-CD2 3.91Å; K210-F232 HydrophobicContact CD-CE2 4.11Å; Q230-F232 PolarHBondContact O-N 3.16Å; Q230-F232 VanDerWaalsContact O-N 3.15Å; F232-E234 PolarHBondContact O-N 3.23Å; F232-D235 WeakPolarHBondContact O-CB 3.49Å; F232-D235 PolarHBondContact O-N 2.68Å; F232-D235 VanDerWaalsContact O-N 3.1Å; F232-T236 HydrophobicContact CD1-CG2 3.84Å; F232-T236 HydrophobicContact CE1-CG2 3.26Å; F232-T236 HydrophobicContact CZ-CG2 3.69Å; F232-T236 WeakPolarHBondContact O-CG2 3.44Å; F232-T236 PolarHBondContact O-N 3.35Å; F232-M249 HydrophobicContact CD1-SD 4.43Å; F232-M249 HydrophobicContact CE1-CE 3.67Å; F232-M249 HydrophobicContact CE1-SD 3.18Å; F232-M249 WeakPolarHBondContact CE1-SD 3.38Å; F232-M249 HydrophobicContact CZ-CE 4.19Å; F232-M249 HydrophobicContact CZ-SD 3.34Å; F232-M249 WeakPolarHBondContact CZ-SD 3.41Å; F232-L268 HydrophobicContact CD1-CD1 4.07Å; F232-L268 HydrophobicContact CD1-CD2 3.71Å; F232-L268 HydrophobicContact CD2-CD2 4.34Å; F232-L268 HydrophobicContact CE1-CD1 3.9Å; F232-L268 HydrophobicContact CE1-CD2 3.45Å; F232-L268 VanDerWaalsContact CE1-CD2 3.45Å; F232-L268 HydrophobicContact CE1-CG 4.2Å; F232-L268 HydrophobicContact CE2-CD2 4.08Å; F232-L268 HydrophobicContact CG-CD2 4.16Å; F232-L268 HydrophobicContact CZ-CD2 3.63Å; F232-F270 HydrophobicContact CE2-CZ 4Å; F232-F270 HydrophobicContact CZ-CE1 4.07Å; F232-F270 AromaticContact CZ-CZ 3.74Å; F232-F270 HydrophobicContact CZ-CZ 3.74Å; F232-L291 HydrophobicContact CE2-CD1 4Å; F232-L291 HydrophobicContact CE2-CG 4.38Å; F232-L291 HydrophobicContact CZ-CD1 4.19Å; F232-L291 HydrophobicContact CZ-CG 4.47Å; F232-F296 HydrophobicContact CD2-CD1 4.29Å; F232-F296 AromaticContact CD2-CE1 3.72Å; F232-F296 HydrophobicContact CD2-CE1 3.72Å; F232-F296 AromaticContact CE2-CE1 3.65Å; F232-F296 HydrophobicContact CE2-CE1 3.65Å; F232-F296 HydrophobicContact CE2-CZ 4.44Å
233	Y	69.4	Low	64.7	Low	79 Å²	79	66.2 Å²	66.2	31%	0.31	37%	0.366	S	S	.	.	H	α-helix	trans	-61.3	-28.4	175.8	-52.5	-75.7	0	0	0	113.9	V207 P231 D235 T236 V237 M251	V207-Y233 HydrophobicContact CG1-CD2 4.38Å; V207-Y233 HydrophobicContact CG1-CE2 4.24Å; P231-Y233 PolarHBondContact O-N 3.02Å; Y233-D235 VanDerWaalsContact C-N 3.34Å; Y233-T236 VanDerWaalsContact CA-OG1 3.31Å; Y233-T236 WeakPolarHBondContact CA-OG1 3.19Å; Y233-T236 PolarHBondContact O-N 3.23Å; Y233-T236 PolarHBondContact O-OG1 3.45Å; Y233-V237 WeakPolarHBondContact O-CG2 3.39Å; Y233-V237 PolarHBondContact O-N 3.35Å; Y233-M251 HydrophobicContact CE1-CE 4.29Å; Y233-M251 HydrophobicContact CE1-SD 3.89Å; Y233-M251 PolarHBondContact OH-SD 3.42Å
234	E	66.7	Low	64.8	Low	109 Å²	109	73.3 Å²	73.3	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-65.6	-39.5	174.8	-66.8	179.3	178.7	0	0	110.9	P231 F232 T236	P231-E234 HydrophobicContact CB-CG 4.26Å; P231-E234 HydrophobicContact CG-CG 4.45Å; P231-E234 WeakPolarHBondContact O-CB 3.42Å; P231-E234 PolarHBondContact O-N 3.22Å; F232-E234 PolarHBondContact O-N 3.23Å; E234-T236 PolarHBondContact O-N 2.72Å
235	D	65.1	Low	65	Low	55 Å²	55	69.1 Å²	69.1	29%	0.294	38%	0.377	S	S	.	.	H	α-helix	trans	-66.1	-15.8	171.8	-80.2	-3.5	0	0	0	112.3	K210 F232 Y233 L291	K210-D235 WeakPolarHBondContact CD-OD2 3.31Å; K210-D235 IonicContact NZ-OD2 3.18Å; K210-D235 PolarHBondContact NZ-OD2 2.7Å; F232-D235 WeakPolarHBondContact O-CB 3.49Å; F232-D235 PolarHBondContact O-N 2.68Å; F232-D235 VanDerWaalsContact O-N 3.1Å; Y233-D235 VanDerWaalsContact C-N 3.34Å; D235-L291 HydrophobicContact CB-CD1 3.85Å
236	T	66.1	Low	65.1	Low	25 Å²	25	71.4 Å²	71.4	15%	0.153	39%	0.388	C	S	.	.	H	α-helix	trans	-96.4	-10.3	-176.8	68.1	0	0	0	0	116	F232 Y233 E234 G238 I239 P240 M249	F232-T236 HydrophobicContact CD1-CG2 3.84Å; F232-T236 HydrophobicContact CE1-CG2 3.26Å; F232-T236 HydrophobicContact CZ-CG2 3.69Å; F232-T236 WeakPolarHBondContact O-CG2 3.44Å; F232-T236 PolarHBondContact O-N 3.35Å; Y233-T236 VanDerWaalsContact CA-OG1 3.31Å; Y233-T236 WeakPolarHBondContact CA-OG1 3.19Å; Y233-T236 PolarHBondContact O-N 3.23Å; Y233-T236 PolarHBondContact O-OG1 3.45Å; E234-T236 PolarHBondContact O-N 2.72Å; T236-G238 PolarHBondContact O-N 3.27Å; T236-G238 VanDerWaalsContact O-N 3.08Å; T236-I239 HydrophobicContact CG2-CD1 3.6Å; T236-I239 WeakPolarHBondContact O-CB 3.33Å; T236-I239 PolarHBondContact O-N 2.79Å; T236-P240 WeakPolarHBondContact O-CD 3.1Å; T236-M249 HydrophobicContact CG2-CE 3.68Å
237	V	65.2	Low	65.5	Low	118 Å²	118	64.8 Å²	64.8	72%	0.715	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-28.8	-170.1	179.8	0	0	0	0	112.7	Y233	Y233-V237 WeakPolarHBondContact O-CG2 3.39Å; Y233-V237 PolarHBondContact O-N 3.35Å
238	G	66	Low	66	Low	33 Å²	33	60 Å²	60	34%	0.34	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-3.8	175.7	0	0	0	0	0	115.6	T236 D241 I242	T236-G238 PolarHBondContact O-N 3.27Å; T236-G238 VanDerWaalsContact O-N 3.08Å; G238-D241 PolarHBondContact O-N 2.72Å; G238-I242 WeakPolarHBondContact O-CD1 3.42Å; G238-I242 VanDerWaalsContact O-CG1 3.24Å; G238-I242 WeakPolarHBondContact O-CG1 3.1Å; G238-I242 PolarHBondContact O-N 3.44Å
239	I	64.7	Low	66.2	Low	19 Å²	19	60.7 Å²	60.7	10%	0.097	34%	0.335	C	S	.	.	H	α-helix	trans	-62.7	-46.6	-175	-67.1	174.9	0	0	0	112.4	T236 D241 I242 T243 L291	T236-I239 HydrophobicContact CG2-CD1 3.6Å; T236-I239 WeakPolarHBondContact O-CB 3.33Å; T236-I239 PolarHBondContact O-N 2.79Å; I239-D241 PolarHBondContact O-N 3.41Å; I239-I242 CarbonylContact O-C 3.56Å; I239-I242 PolarHBondContact O-N 2.95Å; I239-T243 HydrophobicContact CG2-CG2 3.57Å; I239-T243 WeakPolarHBondContact O-CB 3.35Å; I239-T243 VanDerWaalsContact O-CG2 3.32Å; I239-T243 WeakPolarHBondContact O-CG2 3.29Å; I239-T243 PolarHBondContact O-N 3.44Å; I239-T243 PolarHBondContact O-OG1 3.44Å; I239-L291 HydrophobicContact CD1-CD1 3.72Å; I239-L291 HydrophobicContact CD1-CD2 3.18Å; I239-L291 HydrophobicContact CD1-CG 4.04Å; I239-L291 HydrophobicContact CG1-CD2 4Å
240	P	65.9	Low	66	Low	71 Å²	71	64.7 Å²	64.7	46%	0.461	35%	0.353	S	S	.	.	H	α-helix	trans	-57.1	-34.2	-179.5	-25.2	35.5	0	0	0	112.6	T236 R244 A245	T236-P240 WeakPolarHBondContact O-CD 3.1Å; P240-R244 WeakPolarHBondContact O-CA 3.3Å; P240-R244 PolarHBondContact O-N 2.88Å; P240-A245 PolarHBondContact O-N 2.81Å
241	D	67.9	Low	65.4	Low	135 Å²	135	64.9 Å²	64.9	72%	0.722	36%	0.355	S	S	*	.	H	α-helix	trans	-71.3	-43.6	177.3	-60.8	-28.2	0	0	0	110.9	G238 I239 T243	G238-D241 PolarHBondContact O-N 2.72Å; I239-D241 PolarHBondContact O-N 3.41Å; D241-T243 VanDerWaalsContact C-N 3.35Å; D241-T243 PolarHBondContact O-N 3.45Å
242	I	63.8	Low	64.8	Low	71 Å²	71	66.8 Å²	66.8	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-36.8	177	-66.1	167.3	0	0	0	111.5	G238 I239 T284	G238-I242 WeakPolarHBondContact O-CD1 3.42Å; G238-I242 VanDerWaalsContact O-CG1 3.24Å; G238-I242 WeakPolarHBondContact O-CG1 3.1Å; G238-I242 PolarHBondContact O-N 3.44Å; I239-I242 CarbonylContact O-C 3.56Å; I239-I242 PolarHBondContact O-N 2.95Å; I242-T284 HydrophobicContact CG2-CG2 3.24Å
243	T	63.5	Low	63.7	Low	4 Å²	4	70.9 Å²	70.9	3%	0.025	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	6.4	-174.7	70.9	0	0	0	0	113.3	I239 D241 A245 N246 V248 F280	I239-T243 HydrophobicContact CG2-CG2 3.57Å; I239-T243 WeakPolarHBondContact O-CB 3.35Å; I239-T243 VanDerWaalsContact O-CG2 3.32Å; I239-T243 WeakPolarHBondContact O-CG2 3.29Å; I239-T243 PolarHBondContact O-N 3.44Å; I239-T243 PolarHBondContact O-OG1 3.44Å; D241-T243 VanDerWaalsContact C-N 3.35Å; D241-T243 PolarHBondContact O-N 3.45Å; T243-A245 VanDerWaalsContact C-N 3.28Å; T243-A245 PolarHBondContact O-N 2.81Å; T243-N246 WeakPolarHBondContact O-CB 3.47Å; T243-N246 PolarHBondContact O-N 3.24Å; T243-N246 PolarHBondContact O-ND2 3.11Å; T243-N246 PolarHBondContact OG1-O 3.24Å; T243-V248 VanDerWaalsContact CB-CG2 3.47Å; T243-V248 HydrophobicContact CG2-CB 4.33Å; T243-V248 HydrophobicContact CG2-CG2 3.28Å; T243-F280 HydrophobicContact CG2-CE1 4.37Å; T243-F280 HydrophobicContact CG2-CZ 4.21Å
244	R	64.2	Low	62.9	Low	185 Å²	185	70.2 Å²	70.2	70%	0.698	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	47.9	-178.5	-57.1	-178.3	-175.7	169.9	2.7	112	P240 N246	P240-R244 WeakPolarHBondContact O-CA 3.3Å; P240-R244 PolarHBondContact O-N 2.88Å; R244-N246 PolarHBondContact O-N 3.38Å; R244-N246 VanDerWaalsContact O-N 3.13Å
245	A	58.9	Low	61.6	Low	88 Å²	88	69.9 Å²	69.9	73%	0.727	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	8.7	-177.6	0	0	0	0	0	116.1	P240 T243	P240-A245 PolarHBondContact O-N 2.81Å; T243-A245 VanDerWaalsContact C-N 3.28Å; T243-A245 PolarHBondContact O-N 2.81Å
246	N	56.6	Low	60.5	Low	72 Å²	72	76.9 Å²	76.9	39%	0.385	41%	0.408	S	S	.	.			trans	-76.8	132	171.1	-69.4	-62.7	0	0	0	110.5	T243 R244 V248 Y278	T243-N246 WeakPolarHBondContact O-CB 3.47Å; T243-N246 PolarHBondContact O-N 3.24Å; T243-N246 PolarHBondContact O-ND2 3.11Å; T243-N246 PolarHBondContact OG1-O 3.24Å; R244-N246 PolarHBondContact O-N 3.38Å; R244-N246 VanDerWaalsContact O-N 3.13Å; N246-V248 VanDerWaalsContact C-N 3.27Å; N246-V248 WeakPolarHBondContact O-CG2 3.43Å; N246-V248 PolarHBondContact O-N 2.97Å; N246-Y278 HydrophobicContact CB-CD1 3.99Å; N246-Y278 HydrophobicContact CB-CE1 3.36Å; N246-Y278 WeakPolarHBondContact ND2-CE1 3.48Å
247	A	59.4	Low	59.1	Low	48 Å²	48	77.2 Å²	77.2	40%	0.397	42%	0.417	S	S	.	.			trans	-78.3	76.5	-177.6	0	0	0	0	0	111	M249 H250 F271	A247-M249 PolarHBondContact O-N 3.01Å; A247-H250 WeakPolarHBondContact CB-NE2 3.41Å; A247-F271 WeakPolarHBondContact O-CD2 3.48Å
248	V	64.5	Low	57.7	Low	1 Å²	1	77.6 Å²	77.6	1%	0.006	42%	0.415	C	S	.	.	S	Bend	trans	-68.8	-12.1	173.7	-148.6	0	0	0	0	111.3	T243 N246 F271 F288	T243-V248 VanDerWaalsContact CB-CG2 3.47Å; T243-V248 HydrophobicContact CG2-CB 4.33Å; T243-V248 HydrophobicContact CG2-CG2 3.28Å; N246-V248 VanDerWaalsContact C-N 3.27Å; N246-V248 WeakPolarHBondContact O-CG2 3.43Å; N246-V248 PolarHBondContact O-N 2.97Å; V248-F271 PolarHBondContact O-N 3.22Å; V248-F288 HydrophobicContact CB-CE2 3.72Å; V248-F288 HydrophobicContact CB-CZ 3.94Å; V248-F288 HydrophobicContact CG1-CD2 4.45Å; V248-F288 HydrophobicContact CG1-CE1 4.15Å; V248-F288 HydrophobicContact CG1-CE2 3.45Å; V248-F288 VanDerWaalsContact CG1-CE2 3.45Å; V248-F288 HydrophobicContact CG1-CZ 3.26Å; V248-F288 HydrophobicContact CG2-CE2 4.4Å
249	M	69.2	Low	56.3	Low	39 Å²	39	82.5 Å²	82.5	19%	0.192	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	138.4	173.9	-177.6	-165.6	62.1	0	0	110.9	F232 T236 A247 L268 H269 F270	F232-M249 HydrophobicContact CD1-SD 4.43Å; F232-M249 HydrophobicContact CE1-CE 3.67Å; F232-M249 HydrophobicContact CE1-SD 3.18Å; F232-M249 WeakPolarHBondContact CE1-SD 3.38Å; F232-M249 HydrophobicContact CZ-CE 4.19Å; F232-M249 HydrophobicContact CZ-SD 3.34Å; F232-M249 WeakPolarHBondContact CZ-SD 3.41Å; T236-M249 HydrophobicContact CG2-CE 3.68Å; A247-M249 PolarHBondContact O-N 3.01Å; M249-L268 HydrophobicContact CG-CD1 4.37Å; M249-L268 HydrophobicContact CG-CG 4.17Å; M249-L268 HydrophobicContact SD-CD1 3.76Å; M249-L268 HydrophobicContact SD-CD2 3.95Å; M249-L268 HydrophobicContact SD-CG 3.77Å; M249-H269 CarbonylContact C-O 3.56Å; M249-H269 WeakPolarHBondContact CA-O 3.23Å; M249-H269 WeakPolarHBondContact CG-O 3.43Å; M249-F270 HydrophobicContact CB-CD1 4.39Å; M249-F270 HydrophobicContact CG-CD1 4.24Å; M249-F270 HydrophobicContact CG-CE1 4.21Å; M249-F270 HydrophobicContact SD-CE1 3.93Å; M249-F270 HydrophobicContact SD-CZ 4.1Å
250	H	66.5	Low	55	Low	90 Å²	90	84.6 Å²	84.6	42%	0.417	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.6	170.3	-86.4	-88.5	0	0	0	110.4	A247 V252 H269 F271	A247-H250 WeakPolarHBondContact CB-NE2 3.41Å; H250-V252 HydrophobicContact CB-CG2 4.03Å; H250-H269 HydrophobicContact CB-CB 4.46Å; H250-H269 PolarHBondContact N-O 3.26Å; H250-H269 WeakPolarHBondContact O-CB 3.23Å; H250-H269 PolarHBondContact O-N 2.93Å; H250-F271 HydrophobicContact CB-CE2 3.98Å; H250-F271 AromaticContact CD2-CE2 3.44Å; H250-F271 VanDerWaalsContact CD2-CE2 3.44Å; H250-F271 WeakPolarHBondContact CD2-CE2 3.4Å; H250-F271 AromaticContact CD2-CZ 3.94Å
251	M	62.2	Low	54	Low	90 Å²	90	90 Å²	90	44%	0.443	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.7	160.2	-171.4	174.2	67.6	0	0	108.3	F208 Y233 F266 Y267 L268	F208-M251 HydrophobicContact CD2-SD 4.48Å; F208-M251 HydrophobicContact CE2-SD 4.32Å; Y233-M251 HydrophobicContact CE1-CE 4.29Å; Y233-M251 HydrophobicContact CE1-SD 3.89Å; Y233-M251 PolarHBondContact OH-SD 3.42Å; M251-F266 HydrophobicContact SD-CD1 4.48Å; M251-Y267 CarbonylContact C-O 3.58Å; M251-Y267 WeakPolarHBondContact CA-O 3.43Å; M251-L268 HydrophobicContact CB-CD1 4.47Å
252	V	59.8	Low	52.8	Low	70 Å²	70	85.7 Å²	85.7	42%	0.424	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.5	179.6	-174.6	0	0	0	0	108.2	H250 Q254 Y267	H250-V252 HydrophobicContact CB-CG2 4.03Å; V252-Q254 PolarHBondContact O-N 2.85Å; V252-Y267 PolarHBondContact N-O 2.93Å; V252-Y267 PolarHBondContact O-N 3.07Å
253	E	52.6	Low	51.6	Low	87 Å²	87	85.4 Å²	85.4	41%	0.407	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	111.3	166.2	-172.6	174.8	-175.9	0	0	108.1	M255 F266	E253-M255 VanDerWaalsContact C-N 3.35Å; E253-M255 HydrophobicContact CG-CE 4.4Å; E253-M255 HydrophobicContact CG-CG 3.74Å; E253-M255 PolarHBondContact O-N 2.86Å; E253-M255 VanDerWaalsContact O-N 3.17Å; E253-M255 WeakPolarHBondContact OE1-CE 3.14Å; E253-M255 WeakPolarHBondContact OE2-CE 3.48Å; E253-F266 HydrophobicContact CB-CD1 3.9Å; E253-F266 HydrophobicContact CB-CE1 3.7Å; E253-F266 HydrophobicContact CB-CZ 4.39Å; E253-F266 HydrophobicContact CG-CD1 3.97Å; E253-F266 HydrophobicContact CG-CE1 3.47Å; E253-F266 VanDerWaalsContact CG-CE1 3.47Å; E253-F266 HydrophobicContact CG-CE2 4.27Å; E253-F266 HydrophobicContact CG-CZ 3.65Å; E253-F266 VanDerWaalsContact OE1-CZ 3.28Å; E253-F266 WeakPolarHBondContact OE1-CZ 3.19Å
254	Q	53	Low	50.8	Low	64 Å²	64	86.5 Å²	86.5	30%	0.299	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	82.6	175.5	-156.3	172.2	0.4	0	0	108	V252 Y256 G265 Y267	V252-Q254 PolarHBondContact O-N 2.85Å; Q254-Y256 PolarHBondContact O-N 2.87Å; Q254-G265 PolarHBondContact N-O 2.85Å; Q254-Y267 HydrophobicContact CB-CD2 4.09Å; Q254-Y267 HydrophobicContact CB-CE2 3.63Å
255	M	39.3	Very low	50.6	Low	103 Å²	103	78 Å²	78	51%	0.507	43%	0.426	S	S	.	.			trans	-62	-25.5	-171.6	-80.2	-159	165.5	0	0	114	E253	E253-M255 VanDerWaalsContact C-N 3.35Å; E253-M255 HydrophobicContact CG-CE 4.4Å; E253-M255 HydrophobicContact CG-CG 3.74Å; E253-M255 PolarHBondContact O-N 2.86Å; E253-M255 VanDerWaalsContact O-N 3.17Å; E253-M255 WeakPolarHBondContact OE1-CE 3.14Å; E253-M255 WeakPolarHBondContact OE2-CE 3.48Å
256	Y	41.1	Very low	50.8	Low	201 Å²	201	75.6 Å²	75.6	79%	0.788	40%	0.399	S	S	*	.	S	Bend	trans	-154.4	112.2	179.7	-64.4	-81.1	0	0	0	109.5	Q254	Q254-Y256 PolarHBondContact O-N 2.87Å
257	G	36.4	Very low	51.4	Low	33 Å²	33	73.3 Å²	73.3	34%	0.34	39%	0.385	S	S	.	.			trans	-150.6	110.6	177.1	0	0	0	0	0	111.9	Q259	G257-Q259 PolarHBondContact O-N 2.94Å
258	D	36	Very low	51.9	Low	126 Å²	126	71 Å²	71	67%	0.674	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	9.5	169.4	-64.7	-27.5	0	0	0	113.8	L543	D258-L543 WeakPolarHBondContact OD2-CD1 3.45Å
259	Q	36.1	Very low	52.1	Low	135 Å²	135	72.6 Å²	72.6	63%	0.631	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-1.1	-173.8	-76.2	-167	-22.1	0	0	114.3	G257	G257-Q259 PolarHBondContact O-N 2.94Å
260	L	39.1	Very low	52.2	Low	64 Å²	64	70.9 Å²	70.9	34%	0.335	37%	0.365	S	S	.	.			trans	-145.6	118.7	-163.8	-72.8	177.9	0	0	0	113	D262 Y267	L260-D262 VanDerWaalsContact CA-OD1 3.3Å; L260-D262 WeakPolarHBondContact CA-OD1 3.43Å; L260-D262 HydrophobicContact CB-CB 3.66Å; L260-D262 VanDerWaalsContact CB-CG 3.49Å; L260-D262 WeakPolarHBondContact CB-OD1 3.46Å; L260-D262 HydrophobicContact CD1-CB 4.17Å; L260-D262 HydrophobicContact CD2-CB 4.44Å; L260-D262 VanDerWaalsContact CD2-CG 3.42Å; L260-D262 WeakPolarHBondContact CD2-OD1 3.35Å; L260-D262 WeakPolarHBondContact CD2-OD2 3.39Å; L260-D262 HydrophobicContact CG-CB 4.27Å; L260-D262 PolarHBondContact O-N 2.83Å; L260-Y267 WeakPolarHBondContact CD1-OH 3.38Å
261	Y	43.6	Very low	52.1	Low	184 Å²	184	70.1 Å²	70.1	72%	0.722	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	4.5	155.7	-103.2	-103.2	0	0	0	112.4	I518	Y261-I518 HydrophobicContact CE1-CG2 3.81Å; Y261-I518 WeakPolarHBondContact OH-CG2 3.47Å
262	D	42.2	Very low	51.8	Low	45 Å²	45	68.2 Å²	68.2	24%	0.241	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-6.1	-170.5	-43.8	40.2	0	0	0	114.6	Q193 L260	Q193-D262 HydrophobicContact CG-CB 4.02Å; Q193-D262 PolarHBondContact NE2-OD2 2.84Å; L260-D262 VanDerWaalsContact CA-OD1 3.3Å; L260-D262 WeakPolarHBondContact CA-OD1 3.43Å; L260-D262 HydrophobicContact CB-CB 3.66Å; L260-D262 VanDerWaalsContact CB-CG 3.49Å; L260-D262 WeakPolarHBondContact CB-OD1 3.46Å; L260-D262 HydrophobicContact CD1-CB 4.17Å; L260-D262 HydrophobicContact CD2-CB 4.44Å; L260-D262 VanDerWaalsContact CD2-CG 3.42Å; L260-D262 WeakPolarHBondContact CD2-OD1 3.35Å; L260-D262 WeakPolarHBondContact CD2-OD2 3.39Å; L260-D262 HydrophobicContact CG-CB 4.27Å; L260-D262 PolarHBondContact O-N 2.83Å
263	G	40.5	Very low	51.9	Low	65 Å²	65	65.8 Å²	65.8	67%	0.67	34%	0.339	S	S	*	.			trans	87.4	8	170.9	0	0	0	0	0	117.9
264	G	45.3	Very low	52.3	Low	27 Å²	27	65.2 Å²	65.2	28%	0.278	34%	0.339	S	S	.	.	S	Bend	trans	74	141.6	-170.9	0	0	0	0	0	111
265	G	60.1	Low	52.5	Low	7 Å²	7	66.4 Å²	66.4	7%	0.072	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	170.3	-167.9	0	0	0	0	0	114.7	C192 Q254 Y267	C192-G265 VanDerWaalsContact O-CA 3.22Å; C192-G265 WeakPolarHBondContact O-CA 3.46Å; Q254-G265 PolarHBondContact N-O 2.85Å; G265-Y267 WeakPolarHBondContact O-CE2 3.08Å
266	F	63.2	Low	53.4	Low	36 Å²	36	66.1 Å²	66.1	16%	0.158	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	138.2	172.9	-67.8	-101.3	0	0	0	108.2	C192 V194 N206 F208 M251 E253	C192-F266 WeakPolarHBondContact CA-O 3.41Å; C192-F266 HydrophobicContact CB-CB 4.21Å; C192-F266 WeakPolarHBondContact CB-O 3.39Å; C192-F266 PolarHBondContact N-O 1.98Å; C192-F266 PolarHBondContact O-N 2.99Å; C192-F266 VanDerWaalsContact O-N 3.15Å; V194-F266 HydrophobicContact CG2-CD2 4.19Å; V194-F266 HydrophobicContact CG2-CE2 4.43Å; N206-F266 HydrophobicContact CB-CD2 3.99Å; N206-F266 HydrophobicContact CB-CE2 4.36Å; N206-F266 HydrophobicContact CB-CG 4.38Å; N206-F266 WeakPolarHBondContact ND2-CD2 3.49Å; N206-F266 WeakPolarHBondContact ND2-CE2 3.44Å; F208-F266 HydrophobicContact CE2-CB 3.94Å; F208-F266 HydrophobicContact CZ-CB 4.1Å; M251-F266 HydrophobicContact SD-CD1 4.48Å; E253-F266 HydrophobicContact CB-CD1 3.9Å; E253-F266 HydrophobicContact CB-CE1 3.7Å; E253-F266 HydrophobicContact CB-CZ 4.39Å; E253-F266 HydrophobicContact CG-CD1 3.97Å; E253-F266 HydrophobicContact CG-CE1 3.47Å; E253-F266 VanDerWaalsContact CG-CE1 3.47Å; E253-F266 HydrophobicContact CG-CE2 4.27Å; E253-F266 HydrophobicContact CG-CZ 3.65Å; E253-F266 VanDerWaalsContact OE1-CZ 3.28Å; E253-F266 WeakPolarHBondContact OE1-CZ 3.19Å
267	Y	69.5	Low	54.1	Low	24 Å²	24	59.5 Å²	59.5	9%	0.094	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.4	174.4	-58.4	-87.1	0	0	0	109.7	V190 P191 M251 V252 Q254 L260 G265	V190-Y267 WeakPolarHBondContact O-CA 2.94Å; P191-Y267 HydrophobicContact CB-CD1 4.08Å; P191-Y267 HydrophobicContact CB-CE1 3.83Å; M251-Y267 CarbonylContact C-O 3.58Å; M251-Y267 WeakPolarHBondContact CA-O 3.43Å; V252-Y267 PolarHBondContact N-O 2.93Å; V252-Y267 PolarHBondContact O-N 3.07Å; Q254-Y267 HydrophobicContact CB-CD2 4.09Å; Q254-Y267 HydrophobicContact CB-CE2 3.63Å; L260-Y267 WeakPolarHBondContact CD1-OH 3.38Å; G265-Y267 WeakPolarHBondContact O-CE2 3.08Å
268	L	69.6	Low	55.3	Low	1 Å²	1	60.5 Å²	60.5	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	111.9	159.9	-149.6	74.1	0	0	0	107.5	K189 V190 F208 F232 M249 M251 F270 F296	K189-L268 WeakPolarHBondContact CA-O 2.99Å; V190-L268 HydrophobicContact CB-CB 4.05Å; V190-L268 PolarHBondContact N-O 3.15Å; V190-L268 PolarHBondContact O-N 3.27Å; F208-L268 HydrophobicContact CD1-CB 4.49Å; F208-L268 HydrophobicContact CD2-CD1 4.29Å; F208-L268 HydrophobicContact CE1-CB 4.18Å; F208-L268 HydrophobicContact CE2-CD1 4.48Å; F208-L268 HydrophobicContact CZ-CB 4.2Å; F232-L268 HydrophobicContact CD1-CD1 4.07Å; F232-L268 HydrophobicContact CD1-CD2 3.71Å; F232-L268 HydrophobicContact CD2-CD2 4.34Å; F232-L268 HydrophobicContact CE1-CD1 3.9Å; F232-L268 HydrophobicContact CE1-CD2 3.45Å; F232-L268 VanDerWaalsContact CE1-CD2 3.45Å; F232-L268 HydrophobicContact CE1-CG 4.2Å; F232-L268 HydrophobicContact CE2-CD2 4.08Å; F232-L268 HydrophobicContact CG-CD2 4.16Å; F232-L268 HydrophobicContact CZ-CD2 3.63Å; M249-L268 HydrophobicContact CG-CD1 4.37Å; M249-L268 HydrophobicContact CG-CG 4.17Å; M249-L268 HydrophobicContact SD-CD1 3.76Å; M249-L268 HydrophobicContact SD-CD2 3.95Å; M249-L268 HydrophobicContact SD-CG 3.77Å; M251-L268 HydrophobicContact CB-CD1 4.47Å; L268-F270 HydrophobicContact CB-CE2 4.32Å; L268-F270 HydrophobicContact CD2-CD2 4.46Å; L268-F270 HydrophobicContact CD2-CE2 3.37Å; L268-F270 HydrophobicContact CD2-CZ 3.42Å; L268-F270 VanDerWaalsContact CD2-CZ 3.42Å; L268-F270 HydrophobicContact CG-CE2 3.89Å; L268-F270 HydrophobicContact CG-CZ 4.18Å; L268-F296 HydrophobicContact CD2-CD1 4.27Å; L268-F296 HydrophobicContact CD2-CE1 4.12Å
269	H	69.4	Low	56.9	Low	34 Å²	34	60.7 Å²	60.7	16%	0.157	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.6	178.2	-158.4	-111.5	0	0	0	109.3	K189 M249 H250 F271	K189-H269 VanDerWaalsContact CE-NE2 3.32Å; K189-H269 WeakPolarHBondContact CE-NE2 3.44Å; M249-H269 CarbonylContact C-O 3.56Å; M249-H269 WeakPolarHBondContact CA-O 3.23Å; M249-H269 WeakPolarHBondContact CG-O 3.43Å; H250-H269 HydrophobicContact CB-CB 4.46Å; H250-H269 PolarHBondContact N-O 3.26Å; H250-H269 WeakPolarHBondContact O-CB 3.23Å; H250-H269 PolarHBondContact O-N 2.93Å; H269-F271 HydrophobicContact CB-CE2 4.34Å; H269-F271 AromaticContact CE1-CE1 3.75Å; H269-F271 AromaticContact CE1-CZ 3.83Å; H269-F271 AromaticContact ND1-CD2 3.9Å; H269-F271 AromaticContact ND1-CE1 3.49Å; H269-F271 WeakPolarHBondContact ND1-CE1 3.4Å; H269-F271 AromaticContact ND1-CE2 3.32Å; H269-F271 VanDerWaalsContact ND1-CE2 3.32Å; H269-F271 WeakPolarHBondContact ND1-CE2 3.42Å; H269-F271 AromaticContact ND1-CZ 3.12Å; H269-F271 WeakPolarHBondContact ND1-CZ 3.15Å
270	F	70.5	Confident	58.5	Low	2 Å²	2	55.3 Å²	55.3	1%	0.009	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.7	171.3	-68.9	-90.5	0	0	0	109	P187 F188 V190 F232 M249 L268 F296	P187-F270 WeakPolarHBondContact CA-O 3.42Å; P187-F270 WeakPolarHBondContact CB-O 3.38Å; F188-F270 HydrophobicContact CD1-CB 3.76Å; F188-F270 HydrophobicContact CD1-CD2 4.48Å; F188-F270 HydrophobicContact CD1-CG 4.38Å; F188-F270 AromaticContact CD2-CD2 3.93Å; F188-F270 HydrophobicContact CD2-CD2 3.93Å; F188-F270 HydrophobicContact CE1-CB 3.46Å; F188-F270 VanDerWaalsContact CE1-CB 3.46Å; F188-F270 HydrophobicContact CE1-CD1 4.45Å; F188-F270 AromaticContact CE1-CD2 3.91Å; F188-F270 HydrophobicContact CE1-CD2 3.91Å; F188-F270 AromaticContact CE1-CG 3.7Å; F188-F270 HydrophobicContact CE1-CG 3.7Å; F188-F270 HydrophobicContact CE2-CB 4.29Å; F188-F270 AromaticContact CE2-CD2 3.23Å; F188-F270 HydrophobicContact CE2-CD2 3.23Å; F188-F270 AromaticContact CE2-CE2 3.65Å; F188-F270 HydrophobicContact CE2-CE2 3.65Å; F188-F270 AromaticContact CE2-CG 3.94Å; F188-F270 HydrophobicContact CE2-CG 3.94Å; F188-F270 HydrophobicContact CG-CB 4.33Å; F188-F270 HydrophobicContact CZ-CB 3.75Å; F188-F270 HydrophobicContact CZ-CD1 4.15Å; F188-F270 AromaticContact CZ-CD2 3.23Å; F188-F270 HydrophobicContact CZ-CD2 3.23Å; F188-F270 AromaticContact CZ-CE2 3.73Å; F188-F270 HydrophobicContact CZ-CE2 3.73Å; F188-F270 AromaticContact CZ-CG 3.44Å; F188-F270 HydrophobicContact CZ-CG 3.44Å; F188-F270 VanDerWaalsContact CZ-CG 3.44Å; F188-F270 HydrophobicContact CZ-CZ 4.38Å; F188-F270 PolarHBondContact N-O 2.88Å; F188-F270 VanDerWaalsContact N-O 3.14Å; F188-F270 PolarHBondContact O-N 2.8Å; V190-F270 HydrophobicContact CG2-CE2 4.17Å; F232-F270 HydrophobicContact CE2-CZ 4Å; F232-F270 HydrophobicContact CZ-CE1 4.07Å; F232-F270 AromaticContact CZ-CZ 3.74Å; F232-F270 HydrophobicContact CZ-CZ 3.74Å; M249-F270 HydrophobicContact CB-CD1 4.39Å; M249-F270 HydrophobicContact CG-CD1 4.24Å; M249-F270 HydrophobicContact CG-CE1 4.21Å; M249-F270 HydrophobicContact SD-CE1 3.93Å; M249-F270 HydrophobicContact SD-CZ 4.1Å; L268-F270 HydrophobicContact CB-CE2 4.32Å; L268-F270 HydrophobicContact CD2-CD2 4.46Å; L268-F270 HydrophobicContact CD2-CE2 3.37Å; L268-F270 HydrophobicContact CD2-CZ 3.42Å; L268-F270 VanDerWaalsContact CD2-CZ 3.42Å; L268-F270 HydrophobicContact CG-CE2 3.89Å; L268-F270 HydrophobicContact CG-CZ 4.18Å; F270-F296 HydrophobicContact CE2-CE1 4.1Å; F270-F296 HydrophobicContact CE2-CZ 4.1Å; F270-F296 AromaticContact CZ-CE1 3.83Å; F270-F296 HydrophobicContact CZ-CE1 3.83Å; F270-F296 AromaticContact CZ-CZ 3.87Å; F270-F296 HydrophobicContact CZ-CZ 3.87Å
271	F	64.2	Low	60.3	Low	75 Å²	75	56 Å²	56	33%	0.329	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-87.6	150.6	177	-70.7	-88.6	0	0	0	110.5	A247 V248 H250 H269	A247-F271 WeakPolarHBondContact O-CD2 3.48Å; V248-F271 PolarHBondContact O-N 3.22Å; H250-F271 HydrophobicContact CB-CE2 3.98Å; H250-F271 AromaticContact CD2-CE2 3.44Å; H250-F271 VanDerWaalsContact CD2-CE2 3.44Å; H250-F271 WeakPolarHBondContact CD2-CE2 3.4Å; H250-F271 AromaticContact CD2-CZ 3.94Å; H269-F271 HydrophobicContact CB-CE2 4.34Å; H269-F271 AromaticContact CE1-CE1 3.75Å; H269-F271 AromaticContact CE1-CZ 3.83Å; H269-F271 AromaticContact ND1-CD2 3.9Å; H269-F271 AromaticContact ND1-CE1 3.49Å; H269-F271 WeakPolarHBondContact ND1-CE1 3.4Å; H269-F271 AromaticContact ND1-CE2 3.32Å; H269-F271 VanDerWaalsContact ND1-CE2 3.32Å; H269-F271 WeakPolarHBondContact ND1-CE2 3.42Å; H269-F271 AromaticContact ND1-CZ 3.12Å; H269-F271 WeakPolarHBondContact ND1-CZ 3.15Å
272	P	56.7	Low	61.9	Low	49 Å²	49	54.4 Å²	54.4	32%	0.318	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-61.6	143.1	-178.1	27.2	-35	0	0	0	110.8	D185 N274	D185-P272 WeakPolarHBondContact O-CB 3.44Å; P272-N274 PolarHBondContact O-N 2.86Å
273	Y	61	Low	63.4	Low	19 Å²	19	58 Å²	58	8%	0.075	32%	0.324	C	S	.	.			trans	-66	98	175.7	-152.2	-104.8	0	0	0	109.5	I184 E275 F280 R285 F288	I184-Y273 WeakPolarHBondContact O-CB 3.43Å; Y273-E275 HydrophobicContact CD1-CG 3.37Å; Y273-E275 HydrophobicContact CE1-CG 3.58Å; Y273-E275 PolarHBondContact O-N 2.88Å; Y273-F280 HydrophobicContact CD2-CD2 4.39Å; Y273-F280 HydrophobicContact CD2-CE2 4.22Å; Y273-F280 AromaticContact CE1-CD2 3.78Å; Y273-F280 HydrophobicContact CE1-CD2 3.78Å; Y273-F280 AromaticContact CE2-CD2 3.53Å; Y273-F280 HydrophobicContact CE2-CD2 3.53Å; Y273-F280 AromaticContact CE2-CE2 3.58Å; Y273-F280 HydrophobicContact CE2-CE2 3.58Å; Y273-F280 HydrophobicContact CE2-CG 4.46Å; Y273-F280 AromaticContact CZ-CD2 3.15Å; Y273-F280 AromaticContact CZ-CE2 3.74Å; Y273-F280 AromaticContact CZ-CG 3.9Å; Y273-F280 WeakPolarHBondContact OH-CB 3.38Å; Y273-F280 WeakPolarHBondContact OH-CD2 3.43Å; Y273-F280 WeakPolarHBondContact OH-CG 3.43Å; Y273-R285 HydrophobicContact CE1-CG 3.4Å; Y273-R285 VanDerWaalsContact CZ-CG 3.43Å; Y273-R285 VanDerWaalsContact OH-CA 3.29Å; Y273-R285 WeakPolarHBondContact OH-CA 3.28Å; Y273-R285 WeakPolarHBondContact OH-CG 3.5Å; Y273-F288 AromaticContact CD2-CD1 3.46Å; Y273-F288 HydrophobicContact CD2-CD1 3.46Å; Y273-F288 VanDerWaalsContact CD2-CD1 3.46Å; Y273-F288 AromaticContact CD2-CE1 3.88Å; Y273-F288 HydrophobicContact CD2-CE1 3.88Å; Y273-F288 HydrophobicContact CD2-CG 4.04Å; Y273-F288 HydrophobicContact CE2-CB 3.76Å; Y273-F288 AromaticContact CE2-CD1 3.58Å; Y273-F288 HydrophobicContact CE2-CD1 3.58Å; Y273-F288 HydrophobicContact CE2-CE1 4.36Å; Y273-F288 AromaticContact CE2-CG 3.68Å; Y273-F288 HydrophobicContact CE2-CG 3.68Å
274	N	61	Low	64.8	Low	76 Å²	76	56 Å²	56	41%	0.406	30%	0.299	S	S	.	.			trans	-89.5	86.5	171.6	-169.2	-17.2	0	0	0	108.8	P272 M276 A277 Y278	P272-N274 PolarHBondContact O-N 2.86Å; N274-M276 PolarHBondContact O-N 3.24Å; N274-A277 HydrophobicContact CB-CB 3.87Å; N274-A277 VanDerWaalsContact CG-CB 3.45Å; N274-A277 PolarHBondContact O-N 2.66Å; N274-A277 VanDerWaalsContact O-N 3.1Å; N274-A277 PolarHBondContact OD1-N 3.31Å; N274-Y278 HydrophobicContact CB-CD2 4.25Å; N274-Y278 HydrophobicContact CB-CE2 4.05Å; N274-Y278 VanDerWaalsContact O-CD2 3.23Å; N274-Y278 WeakPolarHBondContact O-CD2 2.99Å; N274-Y278 PolarHBondContact O-N 3.32Å
275	E	57.4	Low	66.2	Low	89 Å²	89	58.1 Å²	58.1	42%	0.416	30%	0.299	S	S	.	.	H	α-helix	trans	-50.7	-43.7	-176.7	-69.7	-165.2	147.1	0	0	112.1	Y273 N279 R285	Y273-E275 HydrophobicContact CD1-CG 3.37Å; Y273-E275 HydrophobicContact CE1-CG 3.58Å; Y273-E275 PolarHBondContact O-N 2.88Å; E275-N279 PolarHBondContact O-N 3.47Å; E275-N279 VanDerWaalsContact O-N 3.08Å; E275-R285 VanDerWaalsContact OE1-CD 3.25Å; E275-R285 WeakPolarHBondContact OE1-CD 3.27Å; E275-R285 IonicContact OE1-CZ 3.15Å; E275-R285 IonicContact OE1-NE 2.69Å; E275-R285 IonicContact OE1-NH1 3.65Å; E275-R285 PolarHBondContact OE1-NH1 2.97Å; E275-R285 IonicContact OE2-NH1 2.93Å
276	M	57.6	Low	66.9	Low	96 Å²	96	60.4 Å²	60.4	47%	0.473	32%	0.317	S	S	.	.	H	α-helix	trans	-70.1	-36.6	-178.8	-68.2	177.3	-153	0	0	112.9	D86 N274 Y278	D86-M276 HydrophobicContact CB-CE 3.76Å; D86-M276 HydrophobicContact CB-CG 4.43Å; D86-M276 HydrophobicContact CB-SD 3.73Å; D86-M276 WeakPolarHBondContact O-CE 3.31Å; N274-M276 PolarHBondContact O-N 3.24Å; M276-Y278 VanDerWaalsContact C-N 3.33Å; M276-Y278 PolarHBondContact O-N 3.01Å
277	A	56.9	Low	67.2	Low	62 Å²	62	62.8 Å²	62.8	51%	0.512	33%	0.331	S	S	.	.	H	α-helix	trans	-72.5	-28.6	-176.7	0	0	0	0	0	113	N274	N274-A277 HydrophobicContact CB-CB 3.87Å; N274-A277 VanDerWaalsContact CG-CB 3.45Å; N274-A277 PolarHBondContact O-N 2.66Å; N274-A277 VanDerWaalsContact O-N 3.1Å; N274-A277 PolarHBondContact OD1-N 3.31Å
278	Y	61.6	Low	67.3	Low	54 Å²	54	62.5 Å²	62.5	21%	0.212	33%	0.33	C	S	.	.	H	α-helix	trans	-111.3	-11.4	-171.2	-59.1	-57.1	0	0	0	114.5	N246 N274 M276 F280	N246-Y278 HydrophobicContact CB-CD1 3.99Å; N246-Y278 HydrophobicContact CB-CE1 3.36Å; N246-Y278 WeakPolarHBondContact ND2-CE1 3.48Å; N274-Y278 HydrophobicContact CB-CD2 4.25Å; N274-Y278 HydrophobicContact CB-CE2 4.05Å; N274-Y278 VanDerWaalsContact O-CD2 3.23Å; N274-Y278 WeakPolarHBondContact O-CD2 2.99Å; N274-Y278 PolarHBondContact O-N 3.32Å; M276-Y278 VanDerWaalsContact C-N 3.33Å; M276-Y278 PolarHBondContact O-N 3.01Å; Y278-F280 VanDerWaalsContact C-N 3.26Å; Y278-F280 HydrophobicContact CD2-CD2 4.47Å; Y278-F280 AromaticContact CD2-CE2 3.65Å; Y278-F280 HydrophobicContact CD2-CE2 3.65Å; Y278-F280 HydrophobicContact CD2-CZ 4.05Å; Y278-F280 HydrophobicContact CG-CD2 4.4Å; Y278-F280 HydrophobicContact CG-CE1 4.48Å; Y278-F280 AromaticContact CG-CE2 3.69Å; Y278-F280 HydrophobicContact CG-CE2 3.69Å; Y278-F280 AromaticContact CG-CZ 3.74Å; Y278-F280 HydrophobicContact CG-CZ 3.74Å; Y278-F280 PolarHBondContact O-N 2.95Å
279	N	69	Low	67.5	Low	130 Å²	130	67.5 Å²	67.5	70%	0.695	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	46.4	174.5	-139.8	5.9	0	0	0	112.6	E275	E275-N279 PolarHBondContact O-N 3.47Å; E275-N279 VanDerWaalsContact O-N 3.08Å
280	F	69.6	Low	67.7	Low	22 Å²	22	69.1 Å²	69.1	10%	0.096	37%	0.365	C	S	.	.			trans	-73.5	137.4	-174	-69.6	-50.7	0	0	0	112.2	T243 Y273 Y278 T284 R285	T243-F280 HydrophobicContact CG2-CE1 4.37Å; T243-F280 HydrophobicContact CG2-CZ 4.21Å; Y273-F280 HydrophobicContact CD2-CD2 4.39Å; Y273-F280 HydrophobicContact CD2-CE2 4.22Å; Y273-F280 AromaticContact CE1-CD2 3.78Å; Y273-F280 HydrophobicContact CE1-CD2 3.78Å; Y273-F280 AromaticContact CE2-CD2 3.53Å; Y273-F280 HydrophobicContact CE2-CD2 3.53Å; Y273-F280 AromaticContact CE2-CE2 3.58Å; Y273-F280 HydrophobicContact CE2-CE2 3.58Å; Y273-F280 HydrophobicContact CE2-CG 4.46Å; Y273-F280 AromaticContact CZ-CD2 3.15Å; Y273-F280 AromaticContact CZ-CE2 3.74Å; Y273-F280 AromaticContact CZ-CG 3.9Å; Y273-F280 WeakPolarHBondContact OH-CB 3.38Å; Y273-F280 WeakPolarHBondContact OH-CD2 3.43Å; Y273-F280 WeakPolarHBondContact OH-CG 3.43Å; Y278-F280 VanDerWaalsContact C-N 3.26Å; Y278-F280 HydrophobicContact CD2-CD2 4.47Å; Y278-F280 AromaticContact CD2-CE2 3.65Å; Y278-F280 HydrophobicContact CD2-CE2 3.65Å; Y278-F280 HydrophobicContact CD2-CZ 4.05Å; Y278-F280 HydrophobicContact CG-CD2 4.4Å; Y278-F280 HydrophobicContact CG-CE1 4.48Å; Y278-F280 AromaticContact CG-CE2 3.69Å; Y278-F280 HydrophobicContact CG-CE2 3.69Å; Y278-F280 AromaticContact CG-CZ 3.74Å; Y278-F280 HydrophobicContact CG-CZ 3.74Å; Y278-F280 PolarHBondContact O-N 2.95Å; F280-T284 HydrophobicContact CB-CG2 3.99Å; F280-T284 HydrophobicContact CD1-CG2 3.28Å; F280-T284 HydrophobicContact CE1-CG2 3.84Å; F280-T284 HydrophobicContact CG-CG2 3.84Å; F280-R285 HydrophobicContact CB-CG 4.49Å
281	T	78	Confident	67.8	Low	78 Å²	78	69.6 Å²	69.6	48%	0.479	37%	0.367	S	S	.	.			trans	-66.9	163.6	171.3	66.6	0	0	0	0	111	D283 T284 R285	T281-D283 PolarHBondContact O-N 3.48Å; T281-T284 PolarHBondContact O-N 3.24Å; T281-T284 PolarHBondContact OG1-N 3.46Å; T281-T284 VanDerWaalsContact OG1-N 3.15Å; T281-T284 PolarHBondContact OG1-OG1 3.4Å; T281-R285 PolarHBondContact O-N 3.12Å
282	E	76.3	Confident	68.2	Low	151 Å²	151	66.2 Å²	66.2	71%	0.706	35%	0.353	S	S	*	.	H	α-helix	trans	-58.7	-36.7	173.6	-75.7	-152.5	146.8	0	0	112.5	R285 A286	E282-R285 VanDerWaalsContact O-CB 3.26Å; E282-R285 WeakPolarHBondContact O-CB 3.3Å; E282-R285 PolarHBondContact O-N 2.97Å; E282-A286 PolarHBondContact O-N 3.38Å
283	D	73.1	Confident	69	Low	120 Å²	120	65.5 Å²	65.5	64%	0.642	35%	0.349	S	S	*	.	H	α-helix	trans	-64.3	-45.5	175.7	-59.1	-37.5	0	0	0	110.7	T281 R285 A286 D287	T281-D283 PolarHBondContact O-N 3.48Å; D283-R285 PolarHBondContact O-N 3.34Å; D283-A286 WeakPolarHBondContact O-CB 3.23Å; D283-A286 PolarHBondContact O-N 3.25Å; D283-D287 WeakPolarHBondContact O-CB 3.43Å; D283-D287 VanDerWaalsContact O-CG 3.31Å; D283-D287 PolarHBondContact O-N 3.13Å
284	T	71.8	Confident	69.7	Low	25 Å²	25	65.1 Å²	65.1	15%	0.153	35%	0.35	C	S	.	.	H	α-helix	trans	-62.1	-33.5	176.3	-52.3	0	0	0	0	111.8	I242 F280 T281 F288	I242-T284 HydrophobicContact CG2-CG2 3.24Å; F280-T284 HydrophobicContact CB-CG2 3.99Å; F280-T284 HydrophobicContact CD1-CG2 3.28Å; F280-T284 HydrophobicContact CE1-CG2 3.84Å; F280-T284 HydrophobicContact CG-CG2 3.84Å; T281-T284 PolarHBondContact O-N 3.24Å; T281-T284 PolarHBondContact OG1-N 3.46Å; T281-T284 VanDerWaalsContact OG1-N 3.15Å; T281-T284 PolarHBondContact OG1-OG1 3.4Å; T284-F288 WeakPolarHBondContact O-CB 3.4Å; T284-F288 PolarHBondContact O-N 2.91Å
285	R	73.6	Confident	70.2	Confident	71 Å²	71	61.6 Å²	61.6	27%	0.268	33%	0.332	S	S	.	.	H	α-helix	trans	-64.8	-46.7	171.7	-90.4	-174.3	-86.5	-173.9	2.5	112.4	Y273 E275 F280 T281 E282 D283 D287 R289	Y273-R285 HydrophobicContact CE1-CG 3.4Å; Y273-R285 VanDerWaalsContact CZ-CG 3.43Å; Y273-R285 VanDerWaalsContact OH-CA 3.29Å; Y273-R285 WeakPolarHBondContact OH-CA 3.28Å; Y273-R285 WeakPolarHBondContact OH-CG 3.5Å; E275-R285 VanDerWaalsContact OE1-CD 3.25Å; E275-R285 WeakPolarHBondContact OE1-CD 3.27Å; E275-R285 IonicContact OE1-CZ 3.15Å; E275-R285 IonicContact OE1-NE 2.69Å; E275-R285 IonicContact OE1-NH1 3.65Å; E275-R285 PolarHBondContact OE1-NH1 2.97Å; E275-R285 IonicContact OE2-NH1 2.93Å; F280-R285 HydrophobicContact CB-CG 4.49Å; T281-R285 PolarHBondContact O-N 3.12Å; E282-R285 VanDerWaalsContact O-CB 3.26Å; E282-R285 WeakPolarHBondContact O-CB 3.3Å; E282-R285 PolarHBondContact O-N 2.97Å; D283-R285 PolarHBondContact O-N 3.34Å; R285-D287 VanDerWaalsContact C-N 3.34Å; R285-R289 WeakPolarHBondContact O-CB 3.45Å; R285-R289 VanDerWaalsContact O-CG 3.3Å; R285-R289 WeakPolarHBondContact O-CG 3.3Å; R285-R289 PolarHBondContact O-N 3.15Å
286	A	74.2	Confident	71.1	Confident	55 Å²	55	57.3 Å²	57.3	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-44	178.4	0	0	0	0	0	110.8	E282 D283 R289 S290	E282-A286 PolarHBondContact O-N 3.38Å; D283-A286 WeakPolarHBondContact O-CB 3.23Å; D283-A286 PolarHBondContact O-N 3.25Å; A286-R289 PolarHBondContact O-N 3Å; A286-S290 WeakPolarHBondContact O-CB 3.18Å; A286-S290 PolarHBondContact O-N 3.28Å
287	D	71.2	Confident	71.9	Confident	85 Å²	85	53.3 Å²	53.3	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-48.3	177.4	-70.8	-19.3	0	0	0	111.1	D283 R285 R289 S290 L291	D283-D287 WeakPolarHBondContact O-CB 3.43Å; D283-D287 VanDerWaalsContact O-CG 3.31Å; D283-D287 PolarHBondContact O-N 3.13Å; R285-D287 VanDerWaalsContact C-N 3.34Å; D287-R289 PolarHBondContact O-N 3.45Å; D287-S290 CarbonylContact O-C 3.55Å; D287-S290 PolarHBondContact O-N 3.36Å; D287-S290 VanDerWaalsContact O-N 3.16Å; D287-S290 PolarHBondContact O-OG 3.31Å; D287-L291 WeakPolarHBondContact O-CB 3.44Å; D287-L291 PolarHBondContact O-N 2.93Å
288	F	70.6	Confident	72.6	Confident	18 Å²	18	50.5 Å²	50.5	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-38.3	178.5	-163.5	-92.6	0	0	0	112.5	V248 Y273 T284 L291 S292	V248-F288 HydrophobicContact CB-CE2 3.72Å; V248-F288 HydrophobicContact CB-CZ 3.94Å; V248-F288 HydrophobicContact CG1-CD2 4.45Å; V248-F288 HydrophobicContact CG1-CE1 4.15Å; V248-F288 HydrophobicContact CG1-CE2 3.45Å; V248-F288 VanDerWaalsContact CG1-CE2 3.45Å; V248-F288 HydrophobicContact CG1-CZ 3.26Å; V248-F288 HydrophobicContact CG2-CE2 4.4Å; Y273-F288 AromaticContact CD2-CD1 3.46Å; Y273-F288 HydrophobicContact CD2-CD1 3.46Å; Y273-F288 VanDerWaalsContact CD2-CD1 3.46Å; Y273-F288 AromaticContact CD2-CE1 3.88Å; Y273-F288 HydrophobicContact CD2-CE1 3.88Å; Y273-F288 HydrophobicContact CD2-CG 4.04Å; Y273-F288 HydrophobicContact CE2-CB 3.76Å; Y273-F288 AromaticContact CE2-CD1 3.58Å; Y273-F288 HydrophobicContact CE2-CD1 3.58Å; Y273-F288 HydrophobicContact CE2-CE1 4.36Å; Y273-F288 AromaticContact CE2-CG 3.68Å; Y273-F288 HydrophobicContact CE2-CG 3.68Å; T284-F288 WeakPolarHBondContact O-CB 3.4Å; T284-F288 PolarHBondContact O-N 2.91Å; F288-L291 HydrophobicContact CD2-CD2 4.1Å; F288-L291 HydrophobicContact CE2-CD2 4.04Å; F288-L291 WeakPolarHBondContact O-CB 3.22Å; F288-L291 PolarHBondContact O-N 3.46Å; F288-S292 WeakPolarHBondContact O-CB 3.46Å; F288-S292 PolarHBondContact O-N 2.79Å; F288-S292 PolarHBondContact O-OG 3.07Å
289	R	73	Confident	73	Confident	106 Å²	106	48.3 Å²	48.3	40%	0.4	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-43.5	172.1	-75.9	175.1	-171.2	174	1.5	111.4	I184 R285 A286 D287 L291 S292 S293	I184-R289 HydrophobicContact CD1-CG 3.97Å; I184-R289 VanDerWaalsContact CD1-NH2 3.34Å; R285-R289 WeakPolarHBondContact O-CB 3.45Å; R285-R289 VanDerWaalsContact O-CG 3.3Å; R285-R289 WeakPolarHBondContact O-CG 3.3Å; R285-R289 PolarHBondContact O-N 3.15Å; A286-R289 PolarHBondContact O-N 3Å; D287-R289 PolarHBondContact O-N 3.45Å; R289-L291 PolarHBondContact O-N 3.14Å; R289-S292 PolarHBondContact O-N 3.43Å; R289-S293 VanDerWaalsContact O-CB 3.27Å; R289-S293 WeakPolarHBondContact O-CB 3.33Å; R289-S293 PolarHBondContact O-N 2.84Å; R289-S293 PolarHBondContact O-OG 3.03Å
290	S	73.6	Confident	72.8	Confident	69 Å²	69	45.1 Å²	45.1	48%	0.483	24%	0.241	S	C	.	.	H	α-helix	trans	-65.3	-31.1	177.2	98.1	0	0	0	0	111.8	K210 A286 D287	K210-S290 WeakPolarHBondContact CE-O 3.3Å; K210-S290 PolarHBondContact NZ-O 3.14Å; A286-S290 WeakPolarHBondContact O-CB 3.18Å; A286-S290 PolarHBondContact O-N 3.28Å; D287-S290 CarbonylContact O-C 3.55Å; D287-S290 PolarHBondContact O-N 3.36Å; D287-S290 VanDerWaalsContact O-N 3.16Å; D287-S290 PolarHBondContact O-OG 3.31Å
291	L	73.8	Confident	72.2	Confident	12 Å²	12	44.8 Å²	44.8	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-69.5	-47.5	176.9	179.4	78.6	0	0	0	111.7	K210 F232 D235 I239 D287 F288 R289	K210-L291 WeakPolarHBondContact CD-O 3.25Å; K210-L291 WeakPolarHBondContact CE-O 3.3Å; K210-L291 VanDerWaalsContact NZ-CA 3.35Å; K210-L291 PolarHBondContact NZ-O 3.4Å; F232-L291 HydrophobicContact CE2-CD1 4Å; F232-L291 HydrophobicContact CE2-CG 4.38Å; F232-L291 HydrophobicContact CZ-CD1 4.19Å; F232-L291 HydrophobicContact CZ-CG 4.47Å; D235-L291 HydrophobicContact CB-CD1 3.85Å; I239-L291 HydrophobicContact CD1-CD1 3.72Å; I239-L291 HydrophobicContact CD1-CD2 3.18Å; I239-L291 HydrophobicContact CD1-CG 4.04Å; I239-L291 HydrophobicContact CG1-CD2 4Å; D287-L291 WeakPolarHBondContact O-CB 3.44Å; D287-L291 PolarHBondContact O-N 2.93Å; F288-L291 HydrophobicContact CD2-CD2 4.1Å; F288-L291 HydrophobicContact CE2-CD2 4.04Å; F288-L291 WeakPolarHBondContact O-CB 3.22Å; F288-L291 PolarHBondContact O-N 3.46Å; R289-L291 PolarHBondContact O-N 3.14Å
292	S	72.3	Confident	71.1	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-90.4	-13.5	-170.5	52.3	0	0	0	0	113.4	F188 F288 R289 I320	F188-S292 WeakPolarHBondContact CZ-O 3.27Å; F288-S292 WeakPolarHBondContact O-CB 3.46Å; F288-S292 PolarHBondContact O-N 2.79Å; F288-S292 PolarHBondContact O-OG 3.07Å; R289-S292 PolarHBondContact O-N 3.43Å; S292-I320 VanDerWaalsContact C-CD1 3.43Å; S292-I320 WeakPolarHBondContact O-CD1 3.35Å; S292-I320 WeakPolarHBondContact OG-CD1 3.1Å
293	S	72.8	Confident	69.6	Low	35 Å²	35	46.7 Å²	46.7	25%	0.245	26%	0.259	C	S	.	.	S	Bend	trans	-95.8	145	167.8	63.8	0	0	0	0	111.6	K210 R289 V318	K210-S293 WeakPolarHBondContact CE-O 3.47Å; R289-S293 VanDerWaalsContact O-CB 3.27Å; R289-S293 WeakPolarHBondContact O-CB 3.33Å; R289-S293 PolarHBondContact O-N 2.84Å; R289-S293 PolarHBondContact O-OG 3.03Å; S293-V318 WeakPolarHBondContact CA-O 3.05Å
294	G	76.4	Confident	68.5	Low	10 Å²	10	45.1 Å²	45.1	10%	0.103	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	144.3	-173.1	178.9	0	0	0	0	0	113	V318	G294-V318 PolarHBondContact N-O 3.39Å; G294-V318 PolarHBondContact O-N 3.01Å
295	I	71.8	Confident	67.4	Low	2 Å²	2	49.7 Å²	49.7	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	114.6	172.5	-63.7	-167.1	0	0	0	107.8	K210 C211 L213 F216 I315 V317	K210-I295 CarbonylContact C-O 3.59Å; K210-I295 WeakPolarHBondContact CA-O 3.07Å; C211-I295 HydrophobicContact CB-CB 4.25Å; C211-I295 PolarHBondContact N-O 3.36Å; C211-I295 PolarHBondContact O-N 3.07Å; L213-I295 HydrophobicContact CD1-CD1 3.47Å; L213-I295 VanDerWaalsContact CD1-CD1 3.47Å; L213-I295 HydrophobicContact CD1-CG1 4.01Å; F216-I295 HydrophobicContact CB-CB 4.42Å; F216-I295 HydrophobicContact CB-CD1 3.6Å; F216-I295 HydrophobicContact CB-CG1 4.38Å; F216-I295 HydrophobicContact CD1-CD1 3.22Å; F216-I295 HydrophobicContact CD2-CD1 4.21Å; F216-I295 HydrophobicContact CD2-CG2 3.95Å; F216-I295 HydrophobicContact CE1-CD1 3.95Å; F216-I295 HydrophobicContact CE2-CG2 4.29Å; F216-I295 HydrophobicContact CG-CB 4.42Å; F216-I295 HydrophobicContact CG-CD1 3.38Å; F216-I295 HydrophobicContact CG-CG1 4.41Å; F216-I295 HydrophobicContact CG-CG2 4.16Å; I295-I315 HydrophobicContact CG2-CG2 3.38Å; I295-V317 HydrophobicContact CD1-CG1 4.42Å; I295-V317 HydrophobicContact CD1-CG2 3.82Å; I295-V317 HydrophobicContact CG1-CB 4.32Å; I295-V317 HydrophobicContact CG1-CG1 4.04Å; I295-V317 HydrophobicContact CG1-CG2 3.86Å
296	F	76.5	Confident	66.2	Low	0 Å²	0	49.9 Å²	49.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129	173.7	-61.8	-92.9	0	0	0	108.7	V190 F209 K210 F232 L268 F270 Q316 V318	V190-F296 HydrophobicContact CG1-CB 3.56Å; V190-F296 HydrophobicContact CG1-CG 4.19Å; V190-F296 HydrophobicContact CG2-CB 4.26Å; V190-F296 HydrophobicContact CG2-CD1 4.39Å; V190-F296 HydrophobicContact CG2-CD2 4.16Å; V190-F296 HydrophobicContact CG2-CG 4.01Å; F209-F296 WeakPolarHBondContact O-CA 3.35Å; K210-F296 HydrophobicContact CB-CD1 4.48Å; K210-F296 HydrophobicContact CB-CE1 4.43Å; K210-F296 HydrophobicContact CD-CE1 4Å; K210-F296 HydrophobicContact CD-CZ 4.08Å; K210-F296 HydrophobicContact CG-CE1 4.42Å; F232-F296 HydrophobicContact CD2-CD1 4.29Å; F232-F296 AromaticContact CD2-CE1 3.72Å; F232-F296 HydrophobicContact CD2-CE1 3.72Å; F232-F296 AromaticContact CE2-CE1 3.65Å; F232-F296 HydrophobicContact CE2-CE1 3.65Å; F232-F296 HydrophobicContact CE2-CZ 4.44Å; L268-F296 HydrophobicContact CD2-CD1 4.27Å; L268-F296 HydrophobicContact CD2-CE1 4.12Å; F270-F296 HydrophobicContact CE2-CE1 4.1Å; F270-F296 HydrophobicContact CE2-CZ 4.1Å; F270-F296 AromaticContact CZ-CE1 3.83Å; F270-F296 HydrophobicContact CZ-CE1 3.83Å; F270-F296 AromaticContact CZ-CZ 3.87Å; F270-F296 HydrophobicContact CZ-CZ 3.87Å; F296-Q316 PolarHBondContact N-O 3.43Å; F296-Q316 PolarHBondContact O-N 3.49Å; F296-V318 HydrophobicContact CD2-CB 4.18Å; F296-V318 HydrophobicContact CD2-CG2 3.91Å; F296-V318 HydrophobicContact CE2-CB 4Å; F296-V318 HydrophobicContact CE2-CG2 4.12Å
297	Y	73.8	Confident	65	Low	11 Å²	11	50.5 Å²	50.5	4%	0.043	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	157.8	168.8	68	-78	0	0	0	109.9	F209 C211 C229 M299 Y309 A312 V314	F209-Y297 HydrophobicContact CB-CD1 3.83Å; F209-Y297 HydrophobicContact CB-CD2 4.19Å; F209-Y297 HydrophobicContact CB-CE1 3.23Å; F209-Y297 HydrophobicContact CB-CE2 3.69Å; F209-Y297 HydrophobicContact CB-CG 4.27Å; F209-Y297 WeakPolarHBondContact CB-OH 3.48Å; F209-Y297 HydrophobicContact CD2-CE2 4.1Å; F209-Y297 HydrophobicContact CG-CE1 4.21Å; F209-Y297 AromaticContact CG-CE2 3.93Å; F209-Y297 HydrophobicContact CG-CE2 3.93Å; F209-Y297 AromaticContact CG-CZ 3.67Å; F209-Y297 PolarHBondContact N-O 2.99Å; F209-Y297 PolarHBondContact O-N 3.34Å; C211-Y297 WeakPolarHBondContact SG-CE1 3.44Å; C229-Y297 HydrophobicContact CB-CE1 4.44Å; Y297-M299 HydrophobicContact CD2-CG 4.42Å; Y297-M299 HydrophobicContact CE2-CB 4.5Å; Y297-M299 HydrophobicContact CE2-CG 4.01Å; Y297-M299 HydrophobicContact CE2-SD 3.78Å; Y297-Y309 WeakPolarHBondContact OH-CD1 3.08Å; Y297-Y309 WeakPolarHBondContact OH-CE1 3.05Å; Y297-A312 HydrophobicContact CD2-CB 3.65Å; Y297-A312 HydrophobicContact CE2-CB 4.49Å; Y297-A312 HydrophobicContact CG-CB 3.99Å; Y297-V314 VanDerWaalsContact CA-O 3.23Å; Y297-V314 WeakPolarHBondContact CA-O 3.32Å; Y297-V314 VanDerWaalsContact CB-O 3.28Å; Y297-V314 WeakPolarHBondContact CB-O 3.47Å
298	C	71.8	Confident	63.8	Low	4 Å²	4	52.7 Å²	52.7	3%	0.027	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.7	179.9	-163.7	0	0	0	0	110	C192	C192-C298 HydrophobicContact CB-CB 3.41Å; C192-C298 VanDerWaalsContact CB-CB 3.41Å; C192-C298 WeakPolarHBondContact CB-SG 3.15Å; C192-C298 WeakPolarHBondContact SG-CB 3.37Å; C192-C298 CovalentContact SG-SG 2.01Å; C192-C298 PolarHBondContact SG-SG 3.46Å
299	M	70.5	Confident	63	Low	7 Å²	7	56 Å²	56	3%	0.034	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	165.8	174.8	62.2	171.1	-79.9	0	0	111.6	V207 F209 Y297 G301 I307 Y309	V207-M299 PolarHBondContact N-O 3.39Å; V207-M299 PolarHBondContact O-N 2.69Å; V207-M299 VanDerWaalsContact O-N 3.15Å; F209-M299 HydrophobicContact CD2-CG 3.29Å; F209-M299 HydrophobicContact CD2-SD 3.79Å; F209-M299 HydrophobicContact CE1-SD 4.33Å; F209-M299 HydrophobicContact CE2-CB 4.49Å; F209-M299 HydrophobicContact CE2-CE 4.23Å; F209-M299 HydrophobicContact CE2-CG 3.05Å; F209-M299 HydrophobicContact CE2-SD 3.44Å; F209-M299 WeakPolarHBondContact CE2-SD 3.39Å; F209-M299 HydrophobicContact CG-CG 4.33Å; F209-M299 HydrophobicContact CG-SD 4.38Å; F209-M299 HydrophobicContact CZ-CE 4.26Å; F209-M299 HydrophobicContact CZ-CG 3.95Å; F209-M299 HydrophobicContact CZ-SD 3.74Å; Y297-M299 HydrophobicContact CD2-CG 4.42Å; Y297-M299 HydrophobicContact CE2-CB 4.5Å; Y297-M299 HydrophobicContact CE2-CG 4.01Å; Y297-M299 HydrophobicContact CE2-SD 3.78Å; M299-G301 PolarHBondContact O-N 3.32Å; M299-I307 HydrophobicContact CE-CG2 3.31Å; M299-I307 HydrophobicContact SD-CG2 4.1Å; M299-Y309 HydrophobicContact SD-CD1 4.33Å
300	E	63.5	Low	61.9	Low	63 Å²	63	55 Å²	55	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	115.2	171.5	-108.2	178.4	131.4	0	0	109.5	R199 I204	R199-E300 VanDerWaalsContact CG-CD 3.43Å; R199-E300 HydrophobicContact CG-CG 3.75Å; R199-E300 IonicContact NE-OE2 3.95Å; R199-E300 PolarHBondContact NE-OE2 3.31Å; I204-E300 HydrophobicContact CB-CG 4.21Å; I204-E300 WeakPolarHBondContact CD1-OE1 3.16Å; I204-E300 HydrophobicContact CG2-CB 4.2Å; I204-E300 HydrophobicContact CG2-CG 3.58Å
301	G	58.8	Low	60.9	Low	15 Å²	15	58 Å²	58	16%	0.155	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-92.7	117.6	168.8	0	0	0	0	0	110.4	I204 R205 M299	I204-G301 WeakPolarHBondContact CG2-O 3.45Å; R205-G301 PolarHBondContact O-N 3.34Å; M299-G301 PolarHBondContact O-N 3.32Å
302	R	53.2	Low	60	Low	159 Å²	159	58.3 Å²	58.3	60%	0.6	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-92.7	121.2	156.6	-85.6	-174.9	175.9	-176.2	-0.6	108.3	G304 E305	R302-G304 PolarHBondContact O-N 2.94Å; R302-E305 WeakPolarHBondContact CD-OE2 3.49Å; R302-E305 IonicContact NH1-OE2 2.81Å
303	A	46.2	Very low	59.1	Low	111 Å²	111	61.6 Å²	61.6	92%	0.917	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	121.7	173.3	0	0	0	0	0	109.6
304	G	49.6	Very low	58.3	Low	87 Å²	87	61.3 Å²	61.3	90%	0.897	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	-1.2	168.5	0	0	0	0	0	117.9	R302	R302-G304 PolarHBondContact O-N 2.94Å
305	E	49.3	Very low	57.5	Low	120 Å²	120	61.1 Å²	61.1	56%	0.561	37%	0.37	S	S	*	.	S	Bend	trans	-102.8	126.1	174.2	-75.9	178.2	159.1	0	0	110.1	R302 I307	R302-E305 WeakPolarHBondContact CD-OE2 3.49Å; R302-E305 IonicContact NH1-OE2 2.81Å; E305-I307 WeakPolarHBondContact O-CG1 3.2Å; E305-I307 PolarHBondContact O-N 3.05Å
306	G	47.5	Very low	57.2	Low	76 Å²	76	61.1 Å²	61.1	78%	0.784	37%	0.37	S	S	*	.			trans	-51.7	108.7	175.8	0	0	0	0	0	110	T308	G306-T308 PolarHBondContact O-N 3.05Å
307	I	48.8	Very low	56.5	Low	67 Å²	67	62.2 Å²	62.2	34%	0.344	38%	0.377	S	S	.	.			trans	-71.2	94.9	-167.1	-57.2	176.1	0	0	0	108.8	F209 M299 E305 Y309	F209-I307 HydrophobicContact CE1-CD1 4.03Å; F209-I307 HydrophobicContact CZ-CD1 3.79Å; M299-I307 HydrophobicContact CE-CG2 3.31Å; M299-I307 HydrophobicContact SD-CG2 4.1Å; E305-I307 WeakPolarHBondContact O-CG1 3.2Å; E305-I307 PolarHBondContact O-N 3.05Å; I307-Y309 HydrophobicContact CG2-CD1 4.17Å; I307-Y309 HydrophobicContact CG2-CE1 4.42Å; I307-Y309 HydrophobicContact CG2-CG 4.47Å; I307-Y309 PolarHBondContact O-N 2.82Å; I307-Y309 VanDerWaalsContact O-N 3.15Å
308	T	47.2	Very low	56	Low	131 Å²	131	61.8 Å²	61.8	80%	0.804	38%	0.375	S	S	*	.			trans	-70.4	99.8	154.7	42.3	0	0	0	0	106.7	G306 P310	G306-T308 PolarHBondContact O-N 3.05Å; T308-P310 WeakPolarHBondContact O-CD 3.34Å
309	Y	52.1	Low	55.7	Low	88 Å²	88	65 Å²	65	35%	0.345	39%	0.392	S	S	.	.			trans	-48.3	103.5	-176.7	-64.2	-82.9	0	0	0	111.5	L219 C229 Y297 M299 I307	L219-Y309 HydrophobicContact CD1-CD2 4.03Å; L219-Y309 HydrophobicContact CD1-CE2 3.96Å; C229-Y309 HydrophobicContact CB-CE1 4.15Å; C229-Y309 PolarHBondContact O-OH 3.29Å; Y297-Y309 WeakPolarHBondContact OH-CD1 3.08Å; Y297-Y309 WeakPolarHBondContact OH-CE1 3.05Å; M299-Y309 HydrophobicContact SD-CD1 4.33Å; I307-Y309 HydrophobicContact CG2-CD1 4.17Å; I307-Y309 HydrophobicContact CG2-CE1 4.42Å; I307-Y309 HydrophobicContact CG2-CG 4.47Å; I307-Y309 PolarHBondContact O-N 2.82Å; I307-Y309 VanDerWaalsContact O-N 3.15Å
310	P	49.7	Very low	55.3	Low	84 Å²	84	65.9 Å²	65.9	55%	0.545	40%	0.397	S	S	.	.			trans	-74.4	153.1	167.7	7.1	10.5	0	0	0	109	T308 A312	T308-P310 WeakPolarHBondContact O-CD 3.34Å; P310-A312 PolarHBondContact O-N 3.05Å; P310-A312 VanDerWaalsContact O-N 3.11Å
311	D	52.9	Low	55	Low	132 Å²	132	64 Å²	64	71%	0.706	39%	0.39	S	S	*	.			trans	-41.5	115	-179.2	-66	-44.6	0	0	0	112.3	E313	D311-E313 PolarHBondContact O-N 2.73Å
312	A	54.5	Low	54.4	Low	20 Å²	20	65.2 Å²	65.2	17%	0.165	40%	0.395	C	S	.	.			trans	-59	121.9	178.2	0	0	0	0	0	110.3	Y297 P310 V314 I315	Y297-A312 HydrophobicContact CD2-CB 3.65Å; Y297-A312 HydrophobicContact CE2-CB 4.49Å; Y297-A312 HydrophobicContact CG-CB 3.99Å; P310-A312 PolarHBondContact O-N 3.05Å; P310-A312 VanDerWaalsContact O-N 3.11Å; A312-V314 VanDerWaalsContact C-N 3.34Å; A312-V314 PolarHBondContact O-N 3.48Å; A312-I315 HydrophobicContact CB-CD1 3.78Å; A312-I315 HydrophobicContact CB-CG1 3.57Å
313	E	54	Low	53.8	Low	71 Å²	71	63.2 Å²	63.2	33%	0.332	39%	0.391	S	S	.	.	S	Bend	trans	-68.7	-34.1	-175	-72.5	-176.9	-176.9	0	0	112.3	R199 D311	R199-E313 VanDerWaalsContact CZ-CD 3.47Å; R199-E313 IonicContact CZ-OE1 3.05Å; R199-E313 VanDerWaalsContact CZ-OE1 3.22Å; R199-E313 IonicContact CZ-OE2 3.88Å; R199-E313 IonicContact NE-OE1 2.72Å; R199-E313 IonicContact NH1-OE1 3.56Å; R199-E313 PolarHBondContact NH1-OE1 3.38Å; R199-E313 IonicContact NH1-OE2 3.71Å; R199-E313 PolarHBondContact NH1-OE2 2.74Å; R199-E313 IonicContact NH2-OE1 3.67Å; R199-E313 PolarHBondContact NH2-OE1 3.22Å; R199-E313 IonicContact NH2-OE2 3.77Å; D311-E313 PolarHBondContact O-N 2.73Å
314	V	56	Low	53.9	Low	29 Å²	29	68.8 Å²	68.8	18%	0.176	39%	0.389	C	S	.	.			trans	-140.7	122.6	176.6	-179.3	0	0	0	0	108.2	Q193 Y297 A312	Q193-V314 HydrophobicContact CB-CG2 4.11Å; Q193-V314 HydrophobicContact CG-CG2 4.46Å; Y297-V314 VanDerWaalsContact CA-O 3.23Å; Y297-V314 WeakPolarHBondContact CA-O 3.32Å; Y297-V314 VanDerWaalsContact CB-O 3.28Å; Y297-V314 WeakPolarHBondContact CB-O 3.47Å; A312-V314 VanDerWaalsContact C-N 3.34Å; A312-V314 PolarHBondContact O-N 3.48Å
315	I	59.5	Low	53.6	Low	7 Å²	7	70.7 Å²	70.7	4%	0.036	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.8	173.5	-54.8	178.3	0	0	0	107.2	Y177 S178 F216 I295 A312 V317	Y177-I315 HydrophobicContact CD1-CB 3.68Å; Y177-I315 HydrophobicContact CD1-CD1 3.74Å; Y177-I315 HydrophobicContact CD1-CG1 4.07Å; Y177-I315 HydrophobicContact CD1-CG2 4.27Å; Y177-I315 HydrophobicContact CE1-CB 4.19Å; Y177-I315 HydrophobicContact CE1-CD1 3.27Å; Y177-I315 HydrophobicContact CE1-CG1 4.07Å; S178-I315 PolarHBondContact N-O 2.74Å; S178-I315 VanDerWaalsContact N-O 3.16Å; F216-I315 HydrophobicContact CE2-CD1 3.7Å; F216-I315 HydrophobicContact CE2-CG2 4.33Å; F216-I315 HydrophobicContact CZ-CD1 3.55Å; F216-I315 HydrophobicContact CZ-CG2 4.19Å; I295-I315 HydrophobicContact CG2-CG2 3.38Å; A312-I315 HydrophobicContact CB-CD1 3.78Å; A312-I315 HydrophobicContact CB-CG1 3.57Å; I315-V317 HydrophobicContact CG2-CG2 4.32Å
316	Q	65.5	Low	53.3	Low	2 Å²	2	66.7 Å²	66.7	1%	0.009	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.3	171.2	-166.5	173.6	-37.7	0	0	109.4	S178 K189 V190 F296 V318	S178-Q316 WeakPolarHBondContact O-CA 3.42Å; K189-Q316 PolarHBondContact O-NE2 3.23Å; K189-Q316 VanDerWaalsContact O-NE2 3.12Å; K189-Q316 PolarHBondContact O-OE1 3.47Å; V190-Q316 HydrophobicContact CG1-CB 4.33Å; F296-Q316 PolarHBondContact N-O 3.43Å; F296-Q316 PolarHBondContact O-N 3.49Å; Q316-V318 HydrophobicContact CG-CG2 4.12Å
317	V	62.6	Low	53	Low	22 Å²	22	71.1 Å²	71.1	13%	0.133	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	120.1	175.2	-176.3	0	0	0	0	107.5	S178 L179 K180 L213 I295 I315	S178-V317 PolarHBondContact O-N 3.14Å; L179-V317 HydrophobicContact CD1-CB 3.47Å; L179-V317 VanDerWaalsContact CD1-CB 3.47Å; L179-V317 HydrophobicContact CD1-CG1 3.43Å; L179-V317 VanDerWaalsContact CD1-CG1 3.43Å; L179-V317 HydrophobicContact CD1-CG2 4.48Å; K180-V317 PolarHBondContact N-O 2.96Å; L213-V317 HydrophobicContact CD1-CG1 4.34Å; I295-V317 HydrophobicContact CD1-CG1 4.42Å; I295-V317 HydrophobicContact CD1-CG2 3.82Å; I295-V317 HydrophobicContact CG1-CB 4.32Å; I295-V317 HydrophobicContact CG1-CG1 4.04Å; I295-V317 HydrophobicContact CG1-CG2 3.86Å; I315-V317 HydrophobicContact CG2-CG2 4.32Å
318	V	63.7	Low	52.8	Low	3 Å²	3	73.3 Å²	73.3	2%	0.018	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	119.7	179.2	-177.6	0	0	0	0	109.2	K180 V182 F188 S293 G294 F296 Q316 I320	K180-V318 WeakPolarHBondContact O-CA 3.13Å; V182-V318 HydrophobicContact CB-CG1 4.49Å; V182-V318 HydrophobicContact CG2-CG1 3.95Å; F188-V318 HydrophobicContact CD2-CG1 4.19Å; F188-V318 HydrophobicContact CD2-CG2 4.24Å; F188-V318 HydrophobicContact CE1-CG1 4.41Å; F188-V318 HydrophobicContact CE2-CB 4.31Å; F188-V318 HydrophobicContact CE2-CG1 3.74Å; F188-V318 HydrophobicContact CE2-CG2 3.94Å; F188-V318 HydrophobicContact CZ-CG1 3.85Å; S293-V318 WeakPolarHBondContact CA-O 3.05Å; G294-V318 PolarHBondContact N-O 3.39Å; G294-V318 PolarHBondContact O-N 3.01Å; F296-V318 HydrophobicContact CD2-CB 4.18Å; F296-V318 HydrophobicContact CD2-CG2 3.91Å; F296-V318 HydrophobicContact CE2-CB 4Å; F296-V318 HydrophobicContact CE2-CG2 4.12Å; Q316-V318 HydrophobicContact CG-CG2 4.12Å; V318-I320 HydrophobicContact CG1-CG1 4.24Å
319	D	65.1	Low	52.7	Low	71 Å²	71	72.5 Å²	72.5	38%	0.38	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.9	171.1	-170.2	11.7	0	0	0	109.7	K180 F181 V182	K180-D319 PolarHBondContact O-N 2.98Å; F181-D319 HydrophobicContact CD1-CB 3.95Å; F181-D319 HydrophobicContact CE1-CB 4.04Å; V182-D319 PolarHBondContact N-O 3.09Å; V182-D319 VanDerWaalsContact N-O 3.09Å
320	I	62.6	Low	52.4	Low	26 Å²	26	72.7 Å²	72.7	13%	0.133	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	108.4	-174.7	-66.5	175.5	0	0	0	108.7	V182 I184 F188 S292 V318	V182-I320 WeakPolarHBondContact O-CA 3.44Å; I184-I320 HydrophobicContact CB-CG2 3.68Å; I184-I320 HydrophobicContact CD1-CG2 4.44Å; I184-I320 HydrophobicContact CG1-CG2 3.8Å; F188-I320 HydrophobicContact CE1-CD1 4.16Å; F188-I320 HydrophobicContact CZ-CD1 4.48Å; S292-I320 VanDerWaalsContact C-CD1 3.43Å; S292-I320 WeakPolarHBondContact O-CD1 3.35Å; S292-I320 WeakPolarHBondContact OG-CD1 3.1Å; V318-I320 HydrophobicContact CG1-CG1 4.24Å
321	V	55.1	Low	52.2	Low	24 Å²	24	75 Å²	75	15%	0.145	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.4	-176.3	-133.3	0	0	0	0	108.7	F181 V182 I184 F323 K325	F181-V321 HydrophobicContact CB-CG2 4.48Å; F181-V321 HydrophobicContact CD1-CG2 4.05Å; V182-V321 PolarHBondContact O-N 2.97Å; I184-V321 PolarHBondContact N-O 3.34Å; V321-F323 PolarHBondContact O-N 3.42Å; V321-K325 HydrophobicContact CG1-CB 4.29Å
322	S	46.7	Very low	51.6	Low	39 Å²	39	73 Å²	73	27%	0.273	35%	0.351	S	S	.	.			trans	-58.2	134.8	169.3	167.1	0	0	0	0	109.3	R324 K325 A326	S322-R324 PolarHBondContact O-N 3.19Å; S322-R324 VanDerWaalsContact O-N 3.14Å; S322-R324 PolarHBondContact OG-N 2.94Å; S322-K325 CarbonylContact O-C 3.54Å; S322-K325 WeakPolarHBondContact O-CA 3.5Å; S322-K325 WeakPolarHBondContact O-CB 3.35Å; S322-K325 PolarHBondContact O-N 3.39Å; S322-A326 PolarHBondContact O-N 2.8Å
323	F	41.6	Very low	51	Low	117 Å²	117	77.6 Å²	77.6	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-59.1	-29.4	-179.2	-152.2	-95.1	0	0	0	113	P183 V321 K325 A326 K327	P183-F323 HydrophobicContact CB-CD2 4.23Å; P183-F323 HydrophobicContact CG-CD2 4.27Å; V321-F323 PolarHBondContact O-N 3.42Å; F323-K325 VanDerWaalsContact C-N 3.33Å; F323-A326 PolarHBondContact O-N 3.16Å; F323-K327 PolarHBondContact O-N 3.22Å
324	R	47.3	Very low	50.2	Low	229 Å²	229	77.8 Å²	77.8	86%	0.864	38%	0.375	S	S	*	.	H	α-helix	trans	-62.5	-38.6	170.5	-76.9	-174.4	-179.3	174.8	1.2	112	S322	S322-R324 PolarHBondContact O-N 3.19Å; S322-R324 VanDerWaalsContact O-N 3.14Å; S322-R324 PolarHBondContact OG-N 2.94Å
325	K	44.5	Very low	49.4	Very low	127 Å²	127	79.2 Å²	79.2	55%	0.552	38%	0.381	S	S	*	.	H	α-helix	trans	-78.9	-32.4	174.5	-66.2	-175.3	177.5	-178.1	0	112.3	V321 S322 F323 K327 Q328	V321-K325 HydrophobicContact CG1-CB 4.29Å; S322-K325 CarbonylContact O-C 3.54Å; S322-K325 WeakPolarHBondContact O-CA 3.5Å; S322-K325 WeakPolarHBondContact O-CB 3.35Å; S322-K325 PolarHBondContact O-N 3.39Å; F323-K325 VanDerWaalsContact C-N 3.33Å; K325-K327 VanDerWaalsContact C-N 3.3Å; K325-K327 PolarHBondContact O-N 2.97Å; K325-Q328 WeakPolarHBondContact O-CB 3.35Å; K325-Q328 PolarHBondContact O-N 2.96Å; K325-Q328 VanDerWaalsContact O-N 3.09Å
326	A	41.8	Very low	48.4	Very low	35 Å²	35	80.3 Å²	80.3	29%	0.289	39%	0.387	S	S	.	.	H	α-helix	trans	-67	-28.6	176.6	0	0	0	0	0	112.6	S322 F323 Q328 Y329	S322-A326 PolarHBondContact O-N 2.8Å; F323-A326 PolarHBondContact O-N 3.16Å; A326-Q328 PolarHBondContact O-N 3.23Å; A326-Y329 WeakPolarHBondContact O-CA 3.37Å; A326-Y329 VanDerWaalsContact O-CB 3.27Å; A326-Y329 WeakPolarHBondContact O-CB 3.39Å; A326-Y329 PolarHBondContact O-N 3.42Å
327	K	42.4	Very low	46.8	Very low	170 Å²	170	83.5 Å²	83.5	74%	0.739	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.4	170.3	-83.7	-173.3	174.5	-176.3	0	113.6	F323 K325 Y329	F323-K327 PolarHBondContact O-N 3.22Å; K325-K327 VanDerWaalsContact C-N 3.3Å; K325-K327 PolarHBondContact O-N 2.97Å; K327-Y329 PolarHBondContact O-N 2.92Å
328	Q	44.7	Very low	45.3	Very low	112 Å²	112	87.5 Å²	87.5	52%	0.523	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	31.5	168	-64.6	179.3	-20.5	0	0	111.9	K325 A326 S330 M331	K325-Q328 WeakPolarHBondContact O-CB 3.35Å; K325-Q328 PolarHBondContact O-N 2.96Å; K325-Q328 VanDerWaalsContact O-N 3.09Å; A326-Q328 PolarHBondContact O-N 3.23Å; Q328-S330 PolarHBondContact O-N 2.89Å; Q328-M331 VanDerWaalsContact O-CB 3.27Å; Q328-M331 WeakPolarHBondContact O-CB 3.36Å; Q328-M331 PolarHBondContact O-N 2.94Å
329	Y	43.4	Very low	43.6	Very low	115 Å²	115	92.8 Å²	92.8	45%	0.451	46%	0.46	S	S	.	.	H	α-helix	trans	-50.3	-31.6	178	-172.3	-105.9	0	0	0	112.9	A326 K327 M331 Y332 K333	A326-Y329 WeakPolarHBondContact O-CA 3.37Å; A326-Y329 VanDerWaalsContact O-CB 3.27Å; A326-Y329 WeakPolarHBondContact O-CB 3.39Å; A326-Y329 PolarHBondContact O-N 3.42Å; K327-Y329 PolarHBondContact O-N 2.92Å; Y329-M331 PolarHBondContact O-N 2.77Å; Y329-M331 VanDerWaalsContact O-N 3.16Å; Y329-Y332 PolarHBondContact O-N 3.47Å; Y329-K333 WeakPolarHBondContact O-CB 3.46Å; Y329-K333 PolarHBondContact O-N 3.48Å
330	S	47.7	Very low	41.7	Very low	91 Å²	91	97 Å²	97	64%	0.636	48%	0.482	S	S	*	.	H	α-helix	trans	-56.1	-27.2	173.8	54.6	0	0	0	0	114.1	Q328 P334	Q328-S330 PolarHBondContact O-N 2.89Å; S330-P334 WeakPolarHBondContact O-CD 3.36Å
331	M	44.6	Very low	40.1	Very low	132 Å²	132	103.6 Å²	103.6	65%	0.65	52%	0.518	S	S	*	.	H	α-helix	trans	-78	-28	177.9	-147.1	-179.1	-167.1	0	0	112.3	Q328 Y329	Q328-M331 VanDerWaalsContact O-CB 3.27Å; Q328-M331 WeakPolarHBondContact O-CB 3.36Å; Q328-M331 PolarHBondContact O-N 2.94Å; Y329-M331 PolarHBondContact O-N 2.77Å; Y329-M331 VanDerWaalsContact O-N 3.16Å
332	Y	39.9	Very low	38.8	Very low	91 Å²	91	107.2 Å²	107.2	36%	0.357	54%	0.544	S	S	.	.	H	α-helix	trans	-92.5	-26.8	177.1	-63.3	-83	0	0	0	113	Y329 L335 I336	Y329-Y332 PolarHBondContact O-N 3.47Å; Y332-L335 HydrophobicContact CD1-CD1 4.2Å; Y332-L335 VanDerWaalsContact O-CB 3.32Å; Y332-L335 WeakPolarHBondContact O-CB 3.46Å; Y332-L335 PolarHBondContact O-N 2.71Å; Y332-I336 WeakPolarHBondContact O-CG1 3.37Å; Y332-I336 PolarHBondContact O-N 2.76Å
333	K	41.7	Very low	37.8	Very low	117 Å²	117	111.9 Å²	111.9	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-47.5	-45.8	175.4	-170.5	179.5	-178.2	-179.7	0	114.3	Y329 L335 I336 H337	Y329-K333 WeakPolarHBondContact O-CB 3.46Å; Y329-K333 PolarHBondContact O-N 3.48Å; K333-L335 VanDerWaalsContact C-N 3.32Å; K333-L335 PolarHBondContact O-N 2.75Å; K333-I336 PolarHBondContact O-N 2.75Å; K333-H337 PolarHBondContact O-CD2 2.94Å; K333-H337 VanDerWaalsContact O-CD2 3.3Å; K333-H337 PolarHBondContact O-N 3.46Å
334	P	38.8	Very low	36.9	Very low	75 Å²	75	112.3 Å²	112.3	49%	0.487	59%	0.587	S	S	.	*	H	α-helix	trans	-79.6	-7.1	178	30.5	-35.6	0	0	0	114.7	R152 S330	R152-P334 PolarHBondContact NH2-O 2.83Å; S330-P334 WeakPolarHBondContact O-CD 3.36Å
335	L	38.7	Very low	35.9	Very low	58 Å²	58	104.4 Å²	104.4	30%	0.304	58%	0.577	S	S	.	*	H	α-helix	trans	-84	-16.5	170.3	-72.7	159.1	0	0	0	111.7	R152 Y332 K333	R152-L335 HydrophobicContact CB-CD2 4.48Å; R152-L335 HydrophobicContact CG-CD2 3.58Å; R152-L335 VanDerWaalsContact NE-CD2 3.26Å; R152-L335 VanDerWaalsContact NH1-CD2 3.34Å; Y332-L335 HydrophobicContact CD1-CD1 4.2Å; Y332-L335 VanDerWaalsContact O-CB 3.32Å; Y332-L335 WeakPolarHBondContact O-CB 3.46Å; Y332-L335 PolarHBondContact O-N 2.71Å; K333-L335 VanDerWaalsContact C-N 3.32Å; K333-L335 PolarHBondContact O-N 2.75Å
336	I	38.9	Very low	34.9	Very low	30 Å²	30	107 Å²	107	15%	0.154	60%	0.595	C	S	.	*	H	α-helix	trans	-114.6	-23.4	-166.6	-66.4	168.6	0	0	0	112.4	W168 F181 Y332 K333	W168-I336 HydrophobicContact CH2-CG2 4.35Å; W168-I336 HydrophobicContact CZ2-CG2 3.98Å; F181-I336 HydrophobicContact CE2-CD1 4.16Å; F181-I336 HydrophobicContact CZ-CD1 3.92Å; Y332-I336 WeakPolarHBondContact O-CG1 3.37Å; Y332-I336 PolarHBondContact O-N 2.76Å; K333-I336 PolarHBondContact O-N 2.75Å
337	H	31.1	Very low	34.3	Very low	70 Å²	70	108 Å²	108	32%	0.324	60%	0.6	S	S	.	*			trans	-118.2	109.7	-173.7	-65.4	-66.1	0	0	0	113.3	K333	K333-H337 PolarHBondContact O-CD2 2.94Å; K333-H337 VanDerWaalsContact O-CD2 3.3Å; K333-H337 PolarHBondContact O-N 3.46Å
338	V	31.4	Very low	33.6	Very low	106 Å²	106	107.2 Å²	107.2	64%	0.642	60%	0.603	S	S	*	*			trans	-114.1	120.4	150.9	-178.6	0	0	0	0	106.7
339	P	28.9	Very low	33.1	Very low	114 Å²	114	104.1 Å²	104.1	74%	0.74	59%	0.59	S	S	*	*			trans	-91.1	128.3	-175.2	33	-28.4	0	0	0	110.6
340	L	24.9	Very low	32.8	Very low	160 Å²	160	102.3 Å²	102.3	84%	0.838	59%	0.587	S	S	*	*			trans	-142	138.7	162.4	-81	177.8	0	0	0	113.4	S342	L340-S342 PolarHBondContact O-N 3.39Å
341	N	27.3	Very low	32.3	Very low	164 Å²	164	101.1 Å²	101.1	88%	0.877	57%	0.572	S	S	*	*			trans	-54.6	111.2	178.5	-66.2	-33.9	0	0	0	112.7
342	S	29.1	Very low	32.1	Very low	100 Å²	100	101.5 Å²	101.5	70%	0.699	57%	0.567	S	S	*	*			trans	-156.6	140	148.9	79.3	0	0	0	0	112	L340	L340-S342 PolarHBondContact O-N 3.39Å
343	T	24.8	Very low	32	Very low	136 Å²	136	100.5 Å²	100.5	83%	0.834	57%	0.566	S	S	*	*			trans	-88.6	109.7	-179.3	45.4	0	0	0	0	109.5
344	C	24.3	Very low	31.8	Very low	127 Å²	127	99.4 Å²	99.4	86%	0.858	56%	0.564	S	S	*	*			trans	168.4	119.9	140.3	-98.9	0	0	0	0	110.9
345	G	24.7	Very low	31.9	Very low	63 Å²	63	99 Å²	99	65%	0.649	56%	0.557	S	S	*	*			trans	171.6	97.1	169.3	0	0	0	0	0	110.1
346	I	24.7	Very low	32.2	Very low	180 Å²	180	103.3 Å²	103.3	92%	0.923	57%	0.57	S	S	*	*			trans	-90.1	106.4	174.2	-61.2	170.3	0	0	0	106.9
347	S	28.1	Very low	32.6	Very low	57 Å²	57	104.5 Å²	104.5	40%	0.399	58%	0.575	S	S	.	*			trans	-104.8	138.5	170.4	58.6	0	0	0	0	110.7
348	L	29	Very low	33.3	Very low	154 Å²	154	109.7 Å²	109.7	81%	0.806	60%	0.596	S	S	*	*			trans	-58.4	135.1	175.7	-72.1	160.7	0	0	0	110.9
349	N	34.2	Very low	34.2	Very low	46 Å²	46	109.5 Å²	109.5	25%	0.246	59%	0.589	C	S	.	*			trans	-117.3	76	-141.7	-120.5	-7.5	0	0	0	111.2	I381	N349-I381 HydrophobicContact CB-CB 3.75Å; N349-I381 HydrophobicContact CB-CG2 4.42Å; N349-I381 VanDerWaalsContact CG-CB 3.47Å; N349-I381 WeakPolarHBondContact ND2-CG2 2.91Å; N349-I381 PolarHBondContact O-N 3.33Å; N349-I381 WeakPolarHBondContact OD1-CD1 3Å
350	L	36.3	Very low	35.1	Very low	77 Å²	77	105 Å²	105	40%	0.403	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126	115.5	167.9	-71	171.8	0	0	0	109	Y352 V378	L350-Y352 HydrophobicContact CB-CE2 4.46Å; L350-V378 HydrophobicContact CD2-CG1 4.17Å
351	Q	38	Very low	36.2	Very low	67 Å²	67	101.6 Å²	101.6	31%	0.313	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123.7	174.8	-156.8	178.9	18.6	0	0	108.8	H353 R379 I381	Q351-H353 WeakPolarHBondContact CG-NE2 3.45Å; Q351-H353 PolarHBondContact NE2-CE1 2.87Å; Q351-H353 VanDerWaalsContact NE2-CE1 3.33Å; Q351-H353 PolarHBondContact NE2-NE2 3.26Å; Q351-H353 PolarHBondContact OE1-NE2 3.3Å; Q351-H353 VanDerWaalsContact OE1-NE2 3.07Å; Q351-R379 PolarHBondContact N-O 2.57Å; Q351-R379 PolarHBondContact O-N 3.47Å; Q351-R379 VanDerWaalsContact O-N 3.15Å; Q351-I381 HydrophobicContact CB-CD1 4.39Å
352	Y	39.7	Very low	36.8	Very low	139 Å²	139	95.5 Å²	95.5	55%	0.545	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.9	174.2	-61.5	-89.4	0	0	0	108.7	L350 V378	L350-Y352 HydrophobicContact CB-CE2 4.46Å; Y352-V378 HydrophobicContact CD1-CG2 3.86Å; Y352-V378 HydrophobicContact CE1-CG1 4.27Å; Y352-V378 HydrophobicContact CE1-CG2 3.96Å
353	H	37.6	Very low	37.5	Very low	71 Å²	71	95.2 Å²	95.2	33%	0.329	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.7	170.4	-64.9	-82.8	0	0	0	109.6	Q351 T377	Q351-H353 WeakPolarHBondContact CG-NE2 3.45Å; Q351-H353 PolarHBondContact NE2-CE1 2.87Å; Q351-H353 VanDerWaalsContact NE2-CE1 3.33Å; Q351-H353 PolarHBondContact NE2-NE2 3.26Å; Q351-H353 PolarHBondContact OE1-NE2 3.3Å; Q351-H353 VanDerWaalsContact OE1-NE2 3.07Å; H353-T377 WeakPolarHBondContact CB-OG1 3.45Å; H353-T377 PolarHBondContact N-O 2.85Å; H353-T377 PolarHBondContact O-N 3.25Å; H353-T377 PolarHBondContact O-OG1 3.07Å
354	I	37.6	Very low	38.2	Very low	93 Å²	93	98.1 Å²	98.1	48%	0.477	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	108.3	171.4	-53.2	-178.4	0	0	0	107.5	W356 I375 V376	I354-W356 HydrophobicContact CG2-CD2 4.14Å; I354-W356 HydrophobicContact CG2-CH2 4.48Å; I354-W356 HydrophobicContact CG2-CZ2 3.89Å; I354-I375 WeakPolarHBondContact CA-O 3.31Å; I354-V376 HydrophobicContact CG1-CG2 4.27Å
355	I	41.5	Very low	39	Very low	66 Å²	66	95.9 Å²	95.9	34%	0.338	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	107.3	176.8	-55.9	177.3	0	0	0	107.7	I375 L400	I355-I375 PolarHBondContact N-O 3.2Å; I355-I375 PolarHBondContact O-N 3Å; I355-L400 HydrophobicContact CD1-CD2 3.76Å
356	W	45	Very low	39.9	Very low	150 Å²	150	99.6 Å²	99.6	57%	0.568	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.7	177.5	-61.2	99.3	0	0	0	111.1	I354 K372 L373	I354-W356 HydrophobicContact CG2-CD2 4.14Å; I354-W356 HydrophobicContact CG2-CH2 4.48Å; I354-W356 HydrophobicContact CG2-CZ2 3.89Å; W356-K372 HydrophobicContact CB-CD 4.15Å; W356-K372 HydrophobicContact CE3-CD 4.18Å; W356-K372 HydrophobicContact CE3-CG 4.36Å; W356-L373 CarbonylContact C-O 3.56Å
357	Q	46.5	Very low	40.8	Very low	55 Å²	55	97 Å²	97	26%	0.257	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-69.3	165.6	170.2	-66.9	-172.6	-24	0	0	111.6	K372 L373	Q357-K372 WeakPolarHBondContact O-CE 3.14Å; Q357-K372 WeakPolarHBondContact O-CG 2.98Å; Q357-L373 HydrophobicContact CB-CB 4.37Å; Q357-L373 WeakPolarHBondContact CB-O 3.09Å; Q357-L373 HydrophobicContact CG-CB 4.4Å; Q357-L373 PolarHBondContact N-O 3.25Å
358	K	46.1	Very low	41.7	Very low	178 Å²	178	101.2 Å²	101.2	77%	0.774	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-64.6	153.3	170.4	-70.6	-178.1	-179.6	176.7	0	109.6	E360	K358-E360 PolarHBondContact O-N 3.33Å
359	M	49.4	Very low	42.3	Very low	102 Å²	102	101.3 Å²	101.3	50%	0.502	51%	0.513	S	S	.	.			trans	-60.8	115.8	175.8	-75.9	-72.9	-110.1	0	0	109.8	R370 Y371 K372	M359-R370 HydrophobicContact CB-CB 4.06Å; M359-R370 HydrophobicContact CB-CG 4.35Å; M359-R370 HydrophobicContact CE-CB 4.04Å; M359-R370 HydrophobicContact SD-CB 4.22Å; M359-Y371 CarbonylContact C-O 3.57Å; M359-Y371 WeakPolarHBondContact CA-O 2.95Å; M359-K372 HydrophobicContact SD-CB 3.77Å; M359-K372 HydrophobicContact SD-CG 4.23Å
360	E	48.1	Very low	43	Very low	20 Å²	20	106.8 Å²	106.8	9%	0.093	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.7	178.5	-69.8	-171.8	156.8	0	0	110.8	K358 R370 Y371 Q403 R410	K358-E360 PolarHBondContact O-N 3.33Å; E360-R370 CarbonylContact O-C 3.47Å; E360-R370 VanDerWaalsContact O-CA 3.23Å; E360-R370 WeakPolarHBondContact O-CA 3.02Å; E360-Y371 HydrophobicContact CB-CD1 4.31Å; E360-Y371 HydrophobicContact CB-CE1 3.78Å; E360-Y371 HydrophobicContact CB-CE2 4.01Å; E360-Y371 PolarHBondContact N-O 3.15Å; E360-Y371 WeakPolarHBondContact O-CD1 3.36Å; E360-Y371 VanDerWaalsContact O-CE1 3.3Å; E360-Y371 WeakPolarHBondContact O-CE1 3.28Å; E360-Y371 PolarHBondContact O-N 3.23Å; E360-Y371 WeakPolarHBondContact OE2-CE2 3Å; E360-Y371 VanDerWaalsContact OE2-CZ 3.3Å; E360-Y371 PolarHBondContact OE2-OH 2.98Å; E360-Q403 PolarHBondContact OE1-NE2 3.42Å; E360-R410 VanDerWaalsContact CD-NH2 3.26Å; E360-R410 IonicContact OE1-NH2 3.31Å; E360-R410 PolarHBondContact OE1-NH2 2.83Å; E360-R410 IonicContact OE2-CZ 3.36Å; E360-R410 IonicContact OE2-NH1 3.7Å; E360-R410 IonicContact OE2-NH2 3.85Å; E360-R410 PolarHBondContact OE2-NH2 2.87Å
361	P	49.4	Very low	43.5	Very low	89 Å²	89	106.2 Å²	106.2	58%	0.578	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	131.3	174.7	28	-31.8	0	0	0	110.9
362	C	39.8	Very low	43.7	Very low	36 Å²	36	108.4 Å²	108.4	24%	0.243	53%	0.532	C	S	.	.			trans	-88.5	107.8	175.9	-149.4	0	0	0	0	109.6	R78 K369 Y371	R78-C362 PolarHBondContact NH2-SG 2.72Å; C362-K369 WeakPolarHBondContact CB-O 3.41Å; C362-K369 PolarHBondContact N-O 2.77Å; C362-Y371 HydrophobicContact CB-CD1 3.62Å; C362-Y371 HydrophobicContact CB-CE1 3.84Å
363	C	42.2	Very low	43.8	Very low	93 Å²	93	105.5 Å²	105.5	63%	0.628	53%	0.526	S	S	*	.	S	Bend	trans	68.4	144.6	170.5	-51.1	0	0	0	0	115.6	S365	C363-S365 PolarHBondContact O-N 3.06Å
364	L	40.5	Very low	43.9	Very low	197 Å²	197	103.6 Å²	103.6	100%	1.031	53%	0.526	S	S	*	.	S	Bend	trans	-68.1	26.3	-176.3	-80	155.8	0	0	0	115.3
365	S	39.8	Very low	44.1	Very low	80 Å²	80	101.8 Å²	101.8	56%	0.559	52%	0.516	S	S	*	.	S	Bend	trans	-104.5	138.8	174.3	75.5	0	0	0	0	110.8	C363 N367	C363-S365 PolarHBondContact O-N 3.06Å; S365-N367 PolarHBondContact O-N 2.6Å
366	T	44.8	Very low	44.1	Very low	142 Å²	142	101.8 Å²	101.8	87%	0.871	52%	0.519	S	S	*	.	S	Bend	trans	-46	-8	-171.4	41.2	0	0	0	0	118.7
367	N	42.8	Very low	43.9	Very low	125 Å²	125	97.3 Å²	97.3	67%	0.668	51%	0.509	S	S	*	.	S	Bend	trans	-96.8	101.7	173.5	-75.6	-17.6	0	0	0	110.4	S365 K369	S365-N367 PolarHBondContact O-N 2.6Å; N367-K369 PolarHBondContact O-N 2.89Å
368	Q	47.7	Very low	43.5	Very low	146 Å²	146	96.9 Å²	96.9	68%	0.682	51%	0.509	S	S	*	.			trans	-58.9	63.6	-176.3	-65.6	-173	-6.9	0	0	114.7	R370	Q368-R370 PolarHBondContact O-N 3.2Å
369	K	41.5	Very low	43.3	Very low	155 Å²	155	94.2 Å²	94.2	67%	0.674	49%	0.494	S	S	*	.			trans	-78	108.2	170.8	-70	-170.1	177.8	-174.1	0	109	C362 N367	C362-K369 WeakPolarHBondContact CB-O 3.41Å; C362-K369 PolarHBondContact N-O 2.77Å; N367-K369 PolarHBondContact O-N 2.89Å
370	R	48.6	Very low	42.7	Very low	161 Å²	161	96.3 Å²	96.3	61%	0.608	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	136.2	174.4	-79.2	175.7	156.4	170.7	-0.7	110.9	M359 E360 Q368	M359-R370 HydrophobicContact CB-CB 4.06Å; M359-R370 HydrophobicContact CB-CG 4.35Å; M359-R370 HydrophobicContact CE-CB 4.04Å; M359-R370 HydrophobicContact SD-CB 4.22Å; E360-R370 CarbonylContact O-C 3.47Å; E360-R370 VanDerWaalsContact O-CA 3.23Å; E360-R370 WeakPolarHBondContact O-CA 3.02Å; Q368-R370 PolarHBondContact O-N 3.2Å
371	Y	45.9	Very low	42.3	Very low	66 Å²	66	96.6 Å²	96.6	26%	0.259	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	151.4	173.8	62.2	-80.2	0	0	0	110.6	M359 E360 C362 L373 R410	M359-Y371 CarbonylContact C-O 3.57Å; M359-Y371 WeakPolarHBondContact CA-O 2.95Å; E360-Y371 HydrophobicContact CB-CD1 4.31Å; E360-Y371 HydrophobicContact CB-CE1 3.78Å; E360-Y371 HydrophobicContact CB-CE2 4.01Å; E360-Y371 PolarHBondContact N-O 3.15Å; E360-Y371 WeakPolarHBondContact O-CD1 3.36Å; E360-Y371 VanDerWaalsContact O-CE1 3.3Å; E360-Y371 WeakPolarHBondContact O-CE1 3.28Å; E360-Y371 PolarHBondContact O-N 3.23Å; E360-Y371 WeakPolarHBondContact OE2-CE2 3Å; E360-Y371 VanDerWaalsContact OE2-CZ 3.3Å; E360-Y371 PolarHBondContact OE2-OH 2.98Å; C362-Y371 HydrophobicContact CB-CD1 3.62Å; C362-Y371 HydrophobicContact CB-CE1 3.84Å; Y371-L373 HydrophobicContact CD2-CD1 4.14Å; Y371-L373 HydrophobicContact CD2-CG 4.01Å; Y371-L373 HydrophobicContact CE2-CD1 3.66Å; Y371-L373 HydrophobicContact CE2-CG 4.06Å; Y371-R410 PolarHBondContact OH-NH1 2.89Å
372	K	44.1	Very low	41.7	Very low	112 Å²	112	95.8 Å²	95.8	49%	0.487	49%	0.494	S	S	.	.			trans	-119.3	118.2	176.7	-151.5	-175.2	-168.3	-163.3	0	109.3	W356 Q357 M359	W356-K372 HydrophobicContact CB-CD 4.15Å; W356-K372 HydrophobicContact CE3-CD 4.18Å; W356-K372 HydrophobicContact CE3-CG 4.36Å; Q357-K372 WeakPolarHBondContact O-CE 3.14Å; Q357-K372 WeakPolarHBondContact O-CG 2.98Å; M359-K372 HydrophobicContact SD-CB 3.77Å; M359-K372 HydrophobicContact SD-CG 4.23Å
373	L	41.2	Very low	41.5	Very low	78 Å²	78	99.2 Å²	99.2	41%	0.408	52%	0.515	S	S	.	.			trans	-89.9	136.2	174.1	-75.6	159.7	0	0	0	109.5	W356 Q357 Y371	W356-L373 CarbonylContact C-O 3.56Å; Q357-L373 HydrophobicContact CB-CB 4.37Å; Q357-L373 WeakPolarHBondContact CB-O 3.09Å; Q357-L373 HydrophobicContact CG-CB 4.4Å; Q357-L373 PolarHBondContact N-O 3.25Å; Y371-L373 HydrophobicContact CD2-CD1 4.14Å; Y371-L373 HydrophobicContact CD2-CG 4.01Å; Y371-L373 HydrophobicContact CE2-CD1 3.66Å; Y371-L373 HydrophobicContact CE2-CG 4.06Å
374	G	39.3	Very low	41.1	Very low	32 Å²	32	100.1 Å²	100.1	33%	0.33	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.5	170.2	0	0	0	0	0	109.6
375	I	42.1	Very low	40.9	Very low	55 Å²	55	96.3 Å²	96.3	28%	0.282	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	116.8	171.7	-58.6	176.2	0	0	0	107.4	I354 I355 T377	I354-I375 WeakPolarHBondContact CA-O 3.31Å; I355-I375 PolarHBondContact N-O 3.2Å; I355-I375 PolarHBondContact O-N 3Å; I375-T377 HydrophobicContact CG2-CG2 3.97Å; I375-T377 PolarHBondContact O-N 3.28Å
376	V	41.1	Very low	40.5	Very low	66 Å²	66	97.6 Å²	97.6	40%	0.4	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	111	172.2	-173.4	0	0	0	0	108	I354 V378	I354-V376 HydrophobicContact CG1-CG2 4.27Å; V376-V378 HydrophobicContact CG1-CG2 4.28Å
377	T	40.2	Very low	40	Very low	56 Å²	56	95.3 Å²	95.3	34%	0.344	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.8	171.5	59.7	0	0	0	0	109.1	H353 I375	H353-T377 WeakPolarHBondContact CB-OG1 3.45Å; H353-T377 PolarHBondContact N-O 2.85Å; H353-T377 PolarHBondContact O-N 3.25Å; H353-T377 PolarHBondContact O-OG1 3.07Å; I375-T377 HydrophobicContact CG2-CG2 3.97Å; I375-T377 PolarHBondContact O-N 3.28Å
378	V	38.2	Very low	39.3	Very low	45 Å²	45	97.2 Å²	97.2	27%	0.273	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	112.3	175.3	-174.5	0	0	0	0	107	L350 Y352 V376	L350-V378 HydrophobicContact CD2-CG1 4.17Å; Y352-V378 HydrophobicContact CD1-CG2 3.86Å; Y352-V378 HydrophobicContact CE1-CG1 4.27Å; Y352-V378 HydrophobicContact CE1-CG2 3.96Å; V376-V378 HydrophobicContact CG1-CG2 4.28Å
379	R	42	Very low	38.4	Very low	122 Å²	122	101.9 Å²	101.9	46%	0.46	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	122.1	174.1	-173.6	177.2	178.7	-175.9	0.2	109.7	Q351 I381	Q351-R379 PolarHBondContact N-O 2.57Å; Q351-R379 PolarHBondContact O-N 3.47Å; Q351-R379 VanDerWaalsContact O-N 3.15Å; R379-I381 HydrophobicContact CG-CG1 4.39Å
380	K	37.1	Very low	37.9	Very low	147 Å²	147	98.5 Å²	98.5	64%	0.639	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	117.6	161.6	-172.8	178.4	-178.1	180	0	107.6
381	I	40.8	Very low	37.3	Very low	26 Å²	26	94.6 Å²	94.6	13%	0.133	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-91.4	122.7	175.8	-57.3	165.6	0	0	0	107.2	N349 Q351 R379 P383 I387	N349-I381 HydrophobicContact CB-CB 3.75Å; N349-I381 HydrophobicContact CB-CG2 4.42Å; N349-I381 VanDerWaalsContact CG-CB 3.47Å; N349-I381 WeakPolarHBondContact ND2-CG2 2.91Å; N349-I381 PolarHBondContact O-N 3.33Å; N349-I381 WeakPolarHBondContact OD1-CD1 3Å; Q351-I381 HydrophobicContact CB-CD1 4.39Å; R379-I381 HydrophobicContact CG-CG1 4.39Å; I381-P383 WeakPolarHBondContact O-CD 3.27Å; I381-I387 HydrophobicContact CD1-CD1 4.3Å; I381-I387 HydrophobicContact CG2-CD1 4.09Å; I381-I387 HydrophobicContact CG2-CG1 4.08Å
382	D	37	Very low	36.8	Very low	72 Å²	72	95.4 Å²	95.4	39%	0.385	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-62.9	118.1	176.5	-172.9	-20	0	0	0	109.4	T384 K385	D382-T384 PolarHBondContact O-N 3.45Å; D382-T384 VanDerWaalsContact O-N 3.15Å; D382-T384 WeakPolarHBondContact OD1-CB 3.22Å; D382-T384 PolarHBondContact OD1-N 2.9Å; D382-T384 PolarHBondContact OD1-OG1 2.98Å; D382-T384 PolarHBondContact OD2-OG1 2.95Å; D382-K385 HydrophobicContact CB-CG 4.41Å; D382-K385 PolarHBondContact O-N 3.18Å
383	P	35.1	Very low	36.4	Very low	108 Å²	108	95 Å²	95	70%	0.701	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.5	-178.3	28.7	-35.4	0	0	0	113.1	I381	I381-P383 WeakPolarHBondContact O-CD 3.27Å
384	T	34	Very low	36.1	Very low	112 Å²	112	96.8 Å²	96.8	69%	0.687	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-20.2	177.8	67	0	0	0	0	113.3	D382	D382-T384 PolarHBondContact O-N 3.45Å; D382-T384 VanDerWaalsContact O-N 3.15Å; D382-T384 WeakPolarHBondContact OD1-CB 3.22Å; D382-T384 PolarHBondContact OD1-N 2.9Å; D382-T384 PolarHBondContact OD1-OG1 2.98Å; D382-T384 PolarHBondContact OD2-OG1 2.95Å
385	K	35	Very low	36	Very low	117 Å²	117	99.2 Å²	99.2	51%	0.509	54%	0.54	S	S	.	.	S	Bend	trans	-95.9	101.4	174.7	-60.6	-164.6	-179.7	-164.6	0	107.5	D382 I387 D462	D382-K385 HydrophobicContact CB-CG 4.41Å; D382-K385 PolarHBondContact O-N 3.18Å; K385-I387 PolarHBondContact O-N 3.12Å; K385-D462 IonicContact NZ-OD2 3.85Å; K385-D462 PolarHBondContact NZ-OD2 3.17Å
386	T	31.6	Very low	35.6	Very low	106 Å²	106	106.1 Å²	106.1	65%	0.65	57%	0.571	S	S	*	*			trans	-53.4	124.9	169.9	40	0	0	0	0	108.3	F388	T386-F388 CarbonylContact O-C 3.49Å; T386-F388 PolarHBondContact O-N 3.34Å; T386-F388 PolarHBondContact OG1-O 3.09Å
387	I	33.8	Very low	35.1	Very low	95 Å²	95	107 Å²	107	49%	0.487	58%	0.58	S	S	.	*	S	Bend	trans	-56.5	-14.4	174.4	-62.5	171.7	0	0	0	111.3	I381 K385 W389	I381-I387 HydrophobicContact CD1-CD1 4.3Å; I381-I387 HydrophobicContact CG2-CD1 4.09Å; I381-I387 HydrophobicContact CG2-CG1 4.08Å; K385-I387 PolarHBondContact O-N 3.12Å; I387-W389 PolarHBondContact O-N 3.04Å
388	F	29.8	Very low	34.9	Very low	164 Å²	164	106.3 Å²	106.3	72%	0.719	58%	0.578	S	S	*	*	S	Bend	trans	-88	106.1	172.3	-61.1	-77.8	0	0	0	109.9	T386	T386-F388 CarbonylContact O-C 3.49Å; T386-F388 PolarHBondContact O-N 3.34Å; T386-F388 PolarHBondContact OG1-O 3.09Å
389	W	27.8	Very low	34.7	Very low	245 Å²	245	109.1 Å²	109.1	93%	0.928	60%	0.595	S	S	*	*	S	Bend	trans	92.5	102.5	167.7	-63	40.1	0	0	0	115.1	I387	I387-W389 PolarHBondContact O-N 3.04Å
390	G	31.9	Very low	34.3	Very low	84 Å²	84	107.2 Å²	107.2	87%	0.866	59%	0.593	S	S	*	*	S	Bend	trans	125.1	-17	164.9	0	0	0	0	0	116.7
391	T	35	Very low	34.1	Very low	79 Å²	79	103.2 Å²	103.2	49%	0.485	58%	0.582	S	S	.	*			trans	-93.6	109.6	175.6	18.6	0	0	0	0	110.5
392	A	34.8	Very low	33.9	Very low	83 Å²	83	105.4 Å²	105.4	69%	0.686	60%	0.597	S	S	*	*			trans	-56.6	139	175.9	0	0	0	0	0	110.5
393	P	36.4	Very low	33.9	Very low	104 Å²	104	107.3 Å²	107.3	68%	0.675	60%	0.603	S	S	*	*			trans	-55.7	146.4	168.7	23.7	-31.5	0	0	0	109.3	N395	P393-N395 PolarHBondContact O-N 3.13Å
394	I	35.7	Very low	34.3	Very low	115 Å²	115	109.8 Å²	109.8	59%	0.59	61%	0.606	S	S	*	*			trans	-66.5	88.5	167.1	-60.9	177	0	0	0	106	S398	I394-S398 WeakPolarHBondContact CA-OG 3.39Å; I394-S398 WeakPolarHBondContact CG2-OG 3.5Å
395	N	36.9	Very low	34.7	Very low	82 Å²	82	110.7 Å²	110.7	44%	0.439	60%	0.6	S	S	.	*			trans	-83.5	165.5	170	70.2	8.7	0	0	0	108.4	P393 S397 S398	P393-N395 PolarHBondContact O-N 3.13Å; N395-S397 PolarHBondContact ND2-OG 3.05Å; N395-S397 PolarHBondContact O-N 3.3Å; N395-S397 VanDerWaalsContact OD1-C 3.24Å; N395-S397 WeakPolarHBondContact OD1-CA 3.47Å; N395-S397 WeakPolarHBondContact OD1-CB 3.13Å; N395-S397 PolarHBondContact OD1-N 3.41Å; N395-S397 PolarHBondContact OD1-OG 3.26Å; N395-S398 PolarHBondContact N-OG 3.26Å; N395-S398 WeakPolarHBondContact O-CB 3.34Å; N395-S398 PolarHBondContact O-N 3.49Å; N395-S398 PolarHBondContact O-OG 2.87Å; N395-S398 PolarHBondContact OD1-N 2.93Å
396	E	32.6	Very low	35	Very low	200 Å²	200	108.2 Å²	108.2	94%	0.935	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-17.6	177.6	-72.7	-178.9	150.3	0	0	113.5
397	S	32.3	Very low	35.3	Very low	85 Å²	85	108.5 Å²	108.5	59%	0.594	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-10.8	174.1	60.4	0	0	0	0	115.4	N395 V399	N395-S397 PolarHBondContact ND2-OG 3.05Å; N395-S397 PolarHBondContact O-N 3.3Å; N395-S397 VanDerWaalsContact OD1-C 3.24Å; N395-S397 WeakPolarHBondContact OD1-CA 3.47Å; N395-S397 WeakPolarHBondContact OD1-CB 3.13Å; N395-S397 PolarHBondContact OD1-N 3.41Å; N395-S397 PolarHBondContact OD1-OG 3.26Å; S397-V399 PolarHBondContact O-N 3.24Å
398	S	34.8	Very low	35.8	Very low	41 Å²	41	107.4 Å²	107.4	29%	0.287	60%	0.599	S	S	.	*	S	Bend	trans	-70.5	107.1	170	59.1	0	0	0	0	105.1	I394 N395 L400	I394-S398 WeakPolarHBondContact CA-OG 3.39Å; I394-S398 WeakPolarHBondContact CG2-OG 3.5Å; N395-S398 PolarHBondContact N-OG 3.26Å; N395-S398 WeakPolarHBondContact O-CB 3.34Å; N395-S398 PolarHBondContact O-N 3.49Å; N395-S398 PolarHBondContact O-OG 2.87Å; N395-S398 PolarHBondContact OD1-N 2.93Å; S398-L400 PolarHBondContact O-N 2.02Å
399	V	33.5	Very low	36.2	Very low	105 Å²	105	106.7 Å²	106.7	64%	0.636	60%	0.596	S	S	*	*			trans	-56.1	80.1	-158.3	-175.3	0	0	0	0	111	S397	S397-V399 PolarHBondContact O-N 3.24Å
400	L	33.5	Very low	36.8	Very low	82 Å²	82	101.2 Å²	101.2	43%	0.429	58%	0.575	S	S	.	*			trans	-55.8	122.9	158	-79.1	165.1	0	0	0	103.4	I355 S398 T402	I355-L400 HydrophobicContact CD1-CD2 3.76Å; S398-L400 PolarHBondContact O-N 2.02Å; L400-T402 PolarHBondContact O-N 2.82Å
401	P	34.7	Very low	37.2	Very low	62 Å²	62	102.1 Å²	102.1	40%	0.403	56%	0.56	S	S	.	*			trans	-63.1	110.5	179.3	4.1	4.8	0	0	0	106	K405 F406	P401-K405 HydrophobicContact CB-CB 3.87Å; P401-K405 HydrophobicContact CB-CD 3.97Å; P401-F406 HydrophobicContact CB-CD2 3.91Å; P401-F406 HydrophobicContact CB-CE2 3.25Å; P401-F406 HydrophobicContact CB-CZ 3.66Å; P401-F406 HydrophobicContact CG-CD2 4.47Å; P401-F406 HydrophobicContact CG-CE2 3.38Å; P401-F406 HydrophobicContact CG-CZ 3.53Å
402	T	35.9	Very low	37.2	Very low	73 Å²	73	100.3 Å²	100.3	45%	0.448	55%	0.553	S	S	.	*			trans	-58.1	159.3	-178	43	0	0	0	0	108.6	L400 E404 K405	L400-T402 PolarHBondContact O-N 2.82Å; T402-E404 PolarHBondContact O-N 3.07Å; T402-K405 WeakPolarHBondContact O-CA 3.12Å; T402-K405 WeakPolarHBondContact O-CB 3.3Å; T402-K405 PolarHBondContact O-N 3.05Å
403	Q	38	Very low	37.2	Very low	111 Å²	111	98.8 Å²	98.8	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-49.1	-36.3	176.9	-165.9	163.6	-5.2	0	0	111.6	E360 K405 F406 D407	E360-Q403 PolarHBondContact OE1-NE2 3.42Å; Q403-K405 VanDerWaalsContact C-N 3.35Å; Q403-K405 PolarHBondContact O-N 3.15Å; Q403-F406 CarbonylContact O-C 3.53Å; Q403-F406 PolarHBondContact O-N 3.43Å; Q403-D407 PolarHBondContact O-N 2.01Å
404	E	42.3	Very low	37.2	Very low	160 Å²	160	96 Å²	96	75%	0.748	52%	0.522	S	S	*	.	H	α-helix	trans	-59.7	-32.9	172	-68.4	173.5	152.2	0	0	114.9	T402 F406	T402-E404 PolarHBondContact O-N 3.07Å; E404-F406 PolarHBondContact O-N 3.14Å
405	K	41.8	Very low	37.1	Very low	131 Å²	131	94.3 Å²	94.3	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-74.5	-13.7	176.1	-77.8	-174.6	174.1	-175.6	0	113.2	P401 T402 Q403	P401-K405 HydrophobicContact CB-CB 3.87Å; P401-K405 HydrophobicContact CB-CD 3.97Å; T402-K405 WeakPolarHBondContact O-CA 3.12Å; T402-K405 WeakPolarHBondContact O-CB 3.3Å; T402-K405 PolarHBondContact O-N 3.05Å; Q403-K405 VanDerWaalsContact C-N 3.35Å; Q403-K405 PolarHBondContact O-N 3.15Å
406	F	42.6	Very low	37	Very low	66 Å²	66	94.4 Å²	94.4	29%	0.289	51%	0.514	S	S	.	.	H	α-helix	trans	-116.3	-4.1	179.5	-70.2	-64.8	0	0	0	114.2	P401 Q403 E404 G408 K409	P401-F406 HydrophobicContact CB-CD2 3.91Å; P401-F406 HydrophobicContact CB-CE2 3.25Å; P401-F406 HydrophobicContact CB-CZ 3.66Å; P401-F406 HydrophobicContact CG-CD2 4.47Å; P401-F406 HydrophobicContact CG-CE2 3.38Å; P401-F406 HydrophobicContact CG-CZ 3.53Å; Q403-F406 CarbonylContact O-C 3.53Å; Q403-F406 PolarHBondContact O-N 3.43Å; E404-F406 PolarHBondContact O-N 3.14Å; F406-G408 PolarHBondContact O-N 2.94Å; F406-K409 PolarHBondContact O-N 3.21Å
407	D	36.7	Very low	37.1	Very low	112 Å²	112	88.7 Å²	88.7	60%	0.599	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	113.3	173.2	-83.3	-25.5	0	0	0	109.7	Q403	Q403-D407 PolarHBondContact O-N 2.01Å
408	G	44	Very low	37.2	Very low	72 Å²	72	88.6 Å²	88.6	74%	0.742	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.9	-9.5	-176.6	0	0	0	0	0	116.1	F406	F406-G408 PolarHBondContact O-N 2.94Å
409	K	39.3	Very low	37.1	Very low	148 Å²	148	88.1 Å²	88.1	64%	0.643	48%	0.484	S	S	*	.			trans	-126.1	32.6	-176.9	-65.5	-170.4	-179	179.4	0	115	F406 D411 A412	F406-K409 PolarHBondContact O-N 3.21Å; K409-D411 PolarHBondContact O-N 3.15Å; K409-D411 VanDerWaalsContact O-N 3.15Å; K409-A412 HydrophobicContact CB-CB 4.27Å; K409-A412 VanDerWaalsContact O-CB 3.22Å; K409-A412 WeakPolarHBondContact O-CB 2.79Å; K409-A412 PolarHBondContact O-N 2.76Å
410	R	41.1	Very low	37.3	Very low	131 Å²	131	86.2 Å²	86.2	49%	0.494	47%	0.467	S	S	.	.	H	α-helix	trans	-54.9	-30.5	174.2	-83.3	-173.4	-176.7	-160.3	-4.7	114.1	E360 Y371 A412 L413	E360-R410 VanDerWaalsContact CD-NH2 3.26Å; E360-R410 IonicContact OE1-NH2 3.31Å; E360-R410 PolarHBondContact OE1-NH2 2.83Å; E360-R410 IonicContact OE2-CZ 3.36Å; E360-R410 IonicContact OE2-NH1 3.7Å; E360-R410 IonicContact OE2-NH2 3.85Å; E360-R410 PolarHBondContact OE2-NH2 2.87Å; Y371-R410 PolarHBondContact OH-NH1 2.89Å; R410-A412 PolarHBondContact O-N 2.91Å; R410-L413 PolarHBondContact O-N 2.91Å
411	D	39.1	Very low	37.5	Very low	103 Å²	103	84.5 Å²	84.5	55%	0.551	46%	0.462	S	S	*	.	H	α-helix	trans	-61.8	-25.5	175.1	-54.3	-14.1	0	0	0	112	K73 K409 L415	K73-D411 IonicContact NZ-OD1 2.72Å; K73-D411 IonicContact NZ-OD2 3.89Å; K73-D411 PolarHBondContact NZ-OD2 2.78Å; K409-D411 PolarHBondContact O-N 3.15Å; K409-D411 VanDerWaalsContact O-N 3.15Å; D411-L415 PolarHBondContact O-N 3.46Å
412	A	35.2	Very low	37.6	Very low	40 Å²	40	83.9 Å²	83.9	33%	0.331	46%	0.455	S	S	.	.	H	α-helix	trans	-76.1	-29.2	178.1	0	0	0	0	0	113.2	K409 R410 L415 I416	K409-A412 HydrophobicContact CB-CB 4.27Å; K409-A412 VanDerWaalsContact O-CB 3.22Å; K409-A412 WeakPolarHBondContact O-CB 2.79Å; K409-A412 PolarHBondContact O-N 2.76Å; R410-A412 PolarHBondContact O-N 2.91Å; A412-L415 WeakPolarHBondContact O-CB 3.16Å; A412-L415 PolarHBondContact O-N 3.17Å; A412-I416 WeakPolarHBondContact O-CG1 3.05Å; A412-I416 PolarHBondContact O-N 3.08Å; A412-I416 VanDerWaalsContact O-N 3.17Å
413	L	34.9	Very low	37.6	Very low	52 Å²	52	85 Å²	85	27%	0.272	46%	0.464	S	S	.	.	H	α-helix	trans	-69.7	-41.1	176.1	-94.2	152.9	0	0	0	111.4	R410 L415 I416 D417	R410-L413 PolarHBondContact O-N 2.91Å; L413-L415 PolarHBondContact O-N 3.04Å; L413-I416 PolarHBondContact O-N 2.93Å; L413-D417 PolarHBondContact O-N 2.82Å
414	G	36.8	Very low	37.6	Very low	44 Å²	44	85 Å²	85	45%	0.454	47%	0.467	S	S	.	.	H	α-helix	trans	-62.5	-31.1	170.7	0	0	0	0	0	112.8	V418	G414-V418 VanDerWaalsContact O-CG2 3.26Å; G414-V418 WeakPolarHBondContact O-CG2 3.04Å; G414-V418 PolarHBondContact O-N 3.34Å
415	L	34	Very low	37.4	Very low	80 Å²	80	80.2 Å²	80.2	42%	0.419	44%	0.444	S	S	.	.	H	α-helix	trans	-71.4	-30.9	178	-121.9	127.8	0	0	0	113.3	D411 A412 L413 A419 L449	D411-L415 PolarHBondContact O-N 3.46Å; A412-L415 WeakPolarHBondContact O-CB 3.16Å; A412-L415 PolarHBondContact O-N 3.17Å; L413-L415 PolarHBondContact O-N 3.04Å; L415-A419 WeakPolarHBondContact O-CB 3.39Å; L415-A419 PolarHBondContact O-N 2.76Å; L415-L449 HydrophobicContact CD1-CD1 4.25Å; L415-L449 HydrophobicContact CD2-CD1 4.07Å
416	I	34.4	Very low	37.3	Very low	84 Å²	84	79.6 Å²	79.6	43%	0.431	44%	0.439	S	S	.	.	H	α-helix	trans	-73.1	-44	179.2	-69.6	166.7	0	0	0	111	A412 L413 V418 A419 F420	A412-I416 WeakPolarHBondContact O-CG1 3.05Å; A412-I416 PolarHBondContact O-N 3.08Å; A412-I416 VanDerWaalsContact O-N 3.17Å; L413-I416 PolarHBondContact O-N 2.93Å; I416-V418 VanDerWaalsContact C-N 3.32Å; I416-V418 PolarHBondContact O-N 3.48Å; I416-A419 PolarHBondContact O-N 3.06Å; I416-F420 HydrophobicContact CG2-CD2 3.71Å; I416-F420 HydrophobicContact CG2-CE2 3.31Å; I416-F420 HydrophobicContact CG2-CZ 4.34Å; I416-F420 WeakPolarHBondContact O-CD2 3.47Å; I416-F420 PolarHBondContact O-N 2.78Å
417	D	33.9	Very low	37	Very low	81 Å²	81	81.8 Å²	81.8	43%	0.433	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-39.4	175.1	-91.3	-17.2	0	0	0	111.7	L413 S421	L413-D417 PolarHBondContact O-N 2.82Å; D417-S421 PolarHBondContact O-N 2.81Å
418	V	35.1	Very low	37	Very low	82 Å²	82	84.3 Å²	84.3	50%	0.497	45%	0.452	S	S	.	.	H	α-helix	trans	-68	-40.3	174.2	175.3	0	0	0	0	110.9	G414 I416 F420 S421 L422	G414-V418 VanDerWaalsContact O-CG2 3.26Å; G414-V418 WeakPolarHBondContact O-CG2 3.04Å; G414-V418 PolarHBondContact O-N 3.34Å; I416-V418 VanDerWaalsContact C-N 3.32Å; I416-V418 PolarHBondContact O-N 3.48Å; V418-F420 VanDerWaalsContact C-N 3.35Å; V418-F420 PolarHBondContact O-N 2.88Å; V418-S421 PolarHBondContact O-N 3.04Å; V418-S421 PolarHBondContact O-OG 2.85Å; V418-L422 PolarHBondContact O-N 3.38Å
419	A	33.1	Very low	36.4	Very low	31 Å²	31	83.6 Å²	83.6	26%	0.256	45%	0.445	S	S	.	.	H	α-helix	trans	-59.7	-43.1	177.4	0	0	0	0	0	112	L415 I416 S421 L422 F425	L415-A419 WeakPolarHBondContact O-CB 3.39Å; L415-A419 PolarHBondContact O-N 2.76Å; I416-A419 PolarHBondContact O-N 3.06Å; A419-S421 PolarHBondContact O-N 2.95Å; A419-L422 HydrophobicContact CB-CD1 4.38Å; A419-L422 VanDerWaalsContact O-CB 3.28Å; A419-L422 WeakPolarHBondContact O-CB 3.39Å; A419-L422 WeakPolarHBondContact O-CG 3.36Å; A419-L422 PolarHBondContact O-N 3.31Å; A419-L422 VanDerWaalsContact O-N 3.08Å; A419-F425 HydrophobicContact CB-CE2 4.49Å; A419-F425 WeakPolarHBondContact O-CD2 3.37Å; A419-F425 WeakPolarHBondContact O-CE2 3.44Å
420	F	36.1	Very low	36.1	Very low	65 Å²	65	78.2 Å²	78.2	29%	0.285	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.2	177	-69.2	-58.1	0	0	0	114.9	I416 V418 F425 I430 V432	I416-F420 HydrophobicContact CG2-CD2 3.71Å; I416-F420 HydrophobicContact CG2-CE2 3.31Å; I416-F420 HydrophobicContact CG2-CZ 4.34Å; I416-F420 WeakPolarHBondContact O-CD2 3.47Å; I416-F420 PolarHBondContact O-N 2.78Å; V418-F420 VanDerWaalsContact C-N 3.35Å; V418-F420 PolarHBondContact O-N 2.88Å; F420-F425 HydrophobicContact CD1-CD1 4.34Å; F420-F425 HydrophobicContact CD1-CE1 4.31Å; F420-F425 HydrophobicContact CE1-CE1 4.34Å; F420-I430 HydrophobicContact CD1-CG2 4.29Å; F420-V432 HydrophobicContact CB-CB 4.18Å; F420-V432 HydrophobicContact CB-CG2 3.48Å; F420-V432 VanDerWaalsContact CB-CG2 3.48Å; F420-V432 HydrophobicContact CG-CG2 4.25Å
421	S	37.8	Very low	35.9	Very low	46 Å²	46	79.1 Å²	79.1	32%	0.322	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-3.7	170.9	72.5	0	0	0	0	113.6	D417 V418 A419	D417-S421 PolarHBondContact O-N 2.81Å; V418-S421 PolarHBondContact O-N 3.04Å; V418-S421 PolarHBondContact O-OG 2.85Å; A419-S421 PolarHBondContact O-N 2.95Å
422	L	37.9	Very low	35.6	Very low	49 Å²	49	76 Å²	76	26%	0.257	41%	0.411	S	S	.	.	S	Bend	trans	-72.3	146.5	-177.8	-65.4	170.3	0	0	0	112.9	V418 A419 L424 F425 F442	V418-L422 PolarHBondContact O-N 3.38Å; A419-L422 HydrophobicContact CB-CD1 4.38Å; A419-L422 VanDerWaalsContact O-CB 3.28Å; A419-L422 WeakPolarHBondContact O-CB 3.39Å; A419-L422 WeakPolarHBondContact O-CG 3.36Å; A419-L422 PolarHBondContact O-N 3.31Å; A419-L422 VanDerWaalsContact O-N 3.08Å; L422-L424 PolarHBondContact O-N 3.36Å; L422-L424 VanDerWaalsContact O-N 3.08Å; L422-F425 HydrophobicContact CB-CD2 4.23Å; L422-F425 PolarHBondContact O-N 3.3Å; L422-F442 HydrophobicContact CD1-CE2 3.99Å; L422-F442 HydrophobicContact CD1-CZ 4.19Å; L422-F442 HydrophobicContact CD2-CE2 4.25Å
423	P	36.6	Very low	35.1	Very low	96 Å²	96	80 Å²	80	62%	0.623	44%	0.436	S	S	*	.	H	α-helix	trans	-56.1	-24.8	177.3	-25.3	33.7	0	0	0	115.2	F425 Y426 E427	P423-F425 VanDerWaalsContact C-N 3.27Å; P423-F425 PolarHBondContact O-N 3.15Å; P423-Y426 VanDerWaalsContact O-CB 3.25Å; P423-Y426 WeakPolarHBondContact O-CB 3.41Å; P423-Y426 PolarHBondContact O-N 2.84Å; P423-Y426 VanDerWaalsContact O-N 3.16Å; P423-E427 PolarHBondContact O-N 3.16Å
424	L	37.6	Very low	34.8	Very low	112 Å²	112	80.6 Å²	80.6	59%	0.586	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-32.2	176.3	-160.6	81.8	0	0	0	111.8	L422 E427 Y428	L422-L424 PolarHBondContact O-N 3.36Å; L422-L424 VanDerWaalsContact O-N 3.08Å; L424-E427 PolarHBondContact O-N 3.02Å; L424-Y428 VanDerWaalsContact O-CD2 3.26Å; L424-Y428 WeakPolarHBondContact O-CD2 3.38Å
425	F	38.4	Very low	34.2	Very low	60 Å²	60	83.6 Å²	83.6	26%	0.263	46%	0.458	S	S	.	.	H	α-helix	trans	-81.7	-18.5	175.3	-67.4	-80.5	0	0	0	112.9	A419 F420 L422 P423 E427 Y428 G429 I430	A419-F425 HydrophobicContact CB-CE2 4.49Å; A419-F425 WeakPolarHBondContact O-CD2 3.37Å; A419-F425 WeakPolarHBondContact O-CE2 3.44Å; F420-F425 HydrophobicContact CD1-CD1 4.34Å; F420-F425 HydrophobicContact CD1-CE1 4.31Å; F420-F425 HydrophobicContact CE1-CE1 4.34Å; L422-F425 HydrophobicContact CB-CD2 4.23Å; L422-F425 PolarHBondContact O-N 3.3Å; P423-F425 VanDerWaalsContact C-N 3.27Å; P423-F425 PolarHBondContact O-N 3.15Å; F425-E427 VanDerWaalsContact C-N 3.26Å; F425-E427 PolarHBondContact O-N 3.35Å; F425-Y428 CarbonylContact O-C 3.59Å; F425-Y428 PolarHBondContact O-N 3.49Å; F425-Y428 VanDerWaalsContact O-N 3.17Å; F425-G429 PolarHBondContact O-N 3.39Å; F425-I430 HydrophobicContact CB-CB 4.38Å; F425-I430 HydrophobicContact CD1-CD1 4.47Å; F425-I430 PolarHBondContact O-N 3.31Å; F425-I430 VanDerWaalsContact O-N 3.13Å
426	Y	38.4	Very low	33.8	Very low	118 Å²	118	89.9 Å²	89.9	46%	0.463	48%	0.478	S	S	.	.	H	α-helix	trans	-62.3	-34.5	167.8	-85.6	-110.4	0	0	0	111.7	P423 Y428 G429 R431	P423-Y426 VanDerWaalsContact O-CB 3.25Å; P423-Y426 WeakPolarHBondContact O-CB 3.41Å; P423-Y426 PolarHBondContact O-N 2.84Å; P423-Y426 VanDerWaalsContact O-N 3.16Å; Y426-Y428 PolarHBondContact O-N 3.13Å; Y426-G429 PolarHBondContact O-N 3.23Å; Y426-R431 HydrophobicContact CE1-CG 4.28Å
427	E	36.7	Very low	33.5	Very low	112 Å²	112	90.5 Å²	90.5	52%	0.523	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.9	176.8	-68.3	-177.1	170	0	0	113	P423 L424 F425	P423-E427 PolarHBondContact O-N 3.16Å; L424-E427 PolarHBondContact O-N 3.02Å; F425-E427 VanDerWaalsContact C-N 3.26Å; F425-E427 PolarHBondContact O-N 3.35Å
428	Y	36.3	Very low	33.1	Very low	165 Å²	165	98 Å²	98	65%	0.647	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	8.5	178.9	-63.3	-75.1	0	0	0	114.5	L424 F425 Y426 I430	L424-Y428 VanDerWaalsContact O-CD2 3.26Å; L424-Y428 WeakPolarHBondContact O-CD2 3.38Å; F425-Y428 CarbonylContact O-C 3.59Å; F425-Y428 PolarHBondContact O-N 3.49Å; F425-Y428 VanDerWaalsContact O-N 3.17Å; Y426-Y428 PolarHBondContact O-N 3.13Å; Y428-I430 PolarHBondContact O-N 3.17Å
429	G	31.6	Very low	32.7	Very low	57 Å²	57	102.8 Å²	102.8	59%	0.588	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	16	174.3	0	0	0	0	0	115.6	F425 Y426	F425-G429 PolarHBondContact O-N 3.39Å; Y426-G429 PolarHBondContact O-N 3.23Å
430	I	32.4	Very low	32.7	Very low	35 Å²	35	108.8 Å²	108.8	18%	0.179	56%	0.562	C	S	.	*			trans	-98.4	117	175.9	-58.3	174.4	0	0	0	107.8	F420 F425 Y428	F420-I430 HydrophobicContact CD1-CG2 4.29Å; F425-I430 HydrophobicContact CB-CB 4.38Å; F425-I430 HydrophobicContact CD1-CD1 4.47Å; F425-I430 PolarHBondContact O-N 3.31Å; F425-I430 VanDerWaalsContact O-N 3.13Å; Y428-I430 PolarHBondContact O-N 3.17Å
431	R	37.7	Very low	32.7	Very low	149 Å²	149	112.1 Å²	112.1	56%	0.562	58%	0.583	S	S	*	*			trans	-122.2	124.2	169.1	-67.1	-167.3	-171.4	-167.2	5.1	110.1	Y426	Y426-R431 HydrophobicContact CE1-CG 4.28Å
432	V	32	Very low	32.8	Very low	38 Å²	38	115.4 Å²	115.4	23%	0.23	59%	0.591	C	S	.	*			trans	-96.1	123.6	163.7	176.4	0	0	0	0	107.5	F420 S434	F420-V432 HydrophobicContact CB-CB 4.18Å; F420-V432 HydrophobicContact CB-CG2 3.48Å; F420-V432 VanDerWaalsContact CB-CG2 3.48Å; F420-V432 HydrophobicContact CG-CG2 4.25Å; V432-S434 PolarHBondContact O-N 3.46Å; V432-S434 VanDerWaalsContact O-N 3.1Å
433	S	26	Very low	32.8	Very low	124 Å²	124	119 Å²	119	87%	0.867	61%	0.607	S	S	*	*			trans	-79.2	86.1	175.1	163.4	0	0	0	0	108.9
434	S	28.4	Very low	33.2	Very low	64 Å²	64	118.5 Å²	118.5	45%	0.448	60%	0.599	S	S	.	*			trans	-120.2	111.5	154.8	63.4	0	0	0	0	108.3	V432 Y436	V432-S434 PolarHBondContact O-N 3.46Å; V432-S434 VanDerWaalsContact O-N 3.1Å; S434-Y436 PolarHBondContact O-N 3.47Å
435	S	23.6	Very low	33.5	Very low	107 Å²	107	116.5 Å²	116.5	75%	0.748	59%	0.588	S	S	*	*			trans	-66.5	127.5	169.2	36.4	0	0	0	0	108.8
436	Y	24.9	Very low	33.6	Very low	213 Å²	213	116.5 Å²	116.5	84%	0.835	59%	0.59	S	S	*	*			trans	95	105.3	176.7	-73.3	-97.1	0	0	0	117.3	S434	S434-Y436 PolarHBondContact O-N 3.47Å
437	A	28.1	Very low	33.9	Very low	97 Å²	97	119.3 Å²	119.3	80%	0.802	60%	0.6	S	S	*	*				-176.3	114.6	116.8	0	0	0	0	0	110.4
438	R	26.6	Very low	34.2	Very low	238 Å²	238	121.4 Å²	121.4	90%	0.898	61%	0.607	S	S	*	*			trans	-100.4	147.5	157.5	-143.8	-179.8	-167.2	-177.5	2.1	105
439	E	27	Very low	34.2	Very low	183 Å²	183	118.9 Å²	118.9	86%	0.855	60%	0.604	S	S	*	*			trans	87	95.7	178.1	-54.3	174.2	178.4	0	0	115
440	L	32.3	Very low	34.6	Very low	157 Å²	157	119.9 Å²	119.9	82%	0.822	60%	0.595	S	S	*	*			trans	-166.1	138.6	146.9	-99.5	164.4	0	0	0	109.3	F442	L440-F442 VanDerWaalsContact C-N 3.34Å; L440-F442 PolarHBondContact O-N 3.46Å
441	D	36	Very low	34.5	Very low	134 Å²	134	121.3 Å²	121.3	72%	0.717	62%	0.618	S	S	*	*			trans	-67.2	80.9	-175.2	-122.5	-19.2	0	0	0	111.9	E443 D444	D441-E443 VanDerWaalsContact C-N 3.29Å; D441-E443 PolarHBondContact O-N 3.15Å; D441-D444 PolarHBondContact O-N 2.94Å
442	F	39.4	Very low	34.1	Very low	115 Å²	115	118.9 Å²	118.9	50%	0.504	62%	0.624	S	S	.	*	H	α-helix	trans	-60.7	-30.6	-169.6	-178.5	-105.6	0	0	0	114.4	L422 L440 M446	L422-F442 HydrophobicContact CD1-CE2 3.99Å; L422-F442 HydrophobicContact CD1-CZ 4.19Å; L422-F442 HydrophobicContact CD2-CE2 4.25Å; L440-F442 VanDerWaalsContact C-N 3.34Å; L440-F442 PolarHBondContact O-N 3.46Å; F442-M446 HydrophobicContact CD1-CG 4.27Å; F442-M446 HydrophobicContact CD2-CG 4.31Å; F442-M446 HydrophobicContact CE1-CG 3.89Å; F442-M446 HydrophobicContact CE2-CG 3.93Å; F442-M446 HydrophobicContact CE2-SD 4.3Å; F442-M446 HydrophobicContact CG-CG 4.47Å; F442-M446 HydrophobicContact CZ-CE 4.41Å; F442-M446 HydrophobicContact CZ-CG 3.7Å; F442-M446 HydrophobicContact CZ-SD 4.15Å; F442-M446 WeakPolarHBondContact O-CG 3.46Å; F442-M446 PolarHBondContact O-N 2.6Å
443	E	38.3	Very low	34.1	Very low	126 Å²	126	128.7 Å²	128.7	59%	0.589	66%	0.657	S	S	*	*	H	α-helix	trans	-71	-34.2	-173.9	-141.3	-170.1	148.4	0	0	112.8	D441 R447	D441-E443 VanDerWaalsContact C-N 3.29Å; D441-E443 PolarHBondContact O-N 3.15Å; E443-R447 WeakPolarHBondContact O-CG 3.25Å; E443-R447 PolarHBondContact O-N 2.64Å; E443-R447 VanDerWaalsContact O-N 3.17Å; E443-R447 IonicContact OE1-CZ 3.76Å; E443-R447 IonicContact OE1-NE 3.79Å; E443-R447 IonicContact OE1-NH2 2.62Å; E443-R447 PolarHBondContact OE1-NH2 2.88Å
444	D	45.1	Very low	34.4	Very low	84 Å²	84	128.1 Å²	128.1	45%	0.449	64%	0.643	S	S	.	*	H	α-helix	trans	-78.4	-31.6	-177.8	-160.7	46.1	0	0	0	112.2	D441 K448	D441-D444 PolarHBondContact O-N 2.94Å; D444-K448 WeakPolarHBondContact O-CG 2.98Å; D444-K448 PolarHBondContact O-N 3.02Å; D444-K448 IonicContact OD1-NZ 2.69Å; D444-K448 IonicContact OD2-NZ 3.38Å; D444-K448 PolarHBondContact OD2-NZ 3.14Å
445	I	44.9	Very low	34.5	Very low	71 Å²	71	130.5 Å²	130.5	36%	0.364	66%	0.657	S	S	.	*	H	α-helix	trans	-70.5	-43	175.6	-65	174	0	0	0	110.5	K448 L449	I445-K448 PolarHBondContact O-N 3.29Å; I445-L449 HydrophobicContact CG2-CD1 3.7Å; I445-L449 WeakPolarHBondContact O-CB 3.27Å; I445-L449 PolarHBondContact O-N 3.39Å
446	M	39.1	Very low	34.8	Very low	60 Å²	60	133.2 Å²	133.2	30%	0.296	66%	0.663	S	S	.	*	H	α-helix	trans	-68.4	-35.4	178.7	-71.8	-64.6	-75.6	0	0	112.7	F442 I450 I454	F442-M446 HydrophobicContact CD1-CG 4.27Å; F442-M446 HydrophobicContact CD2-CG 4.31Å; F442-M446 HydrophobicContact CE1-CG 3.89Å; F442-M446 HydrophobicContact CE2-CG 3.93Å; F442-M446 HydrophobicContact CE2-SD 4.3Å; F442-M446 HydrophobicContact CG-CG 4.47Å; F442-M446 HydrophobicContact CZ-CE 4.41Å; F442-M446 HydrophobicContact CZ-CG 3.7Å; F442-M446 HydrophobicContact CZ-SD 4.15Å; F442-M446 WeakPolarHBondContact O-CG 3.46Å; F442-M446 PolarHBondContact O-N 2.6Å; M446-I450 HydrophobicContact CE-CD1 3.35Å; M446-I450 PolarHBondContact O-N 3.08Å; M446-I450 HydrophobicContact SD-CD1 3.96Å; M446-I454 HydrophobicContact CE-CD1 3.7Å
447	R	45.3	Very low	34.9	Very low	177 Å²	177	128.3 Å²	128.3	67%	0.668	67%	0.666	S	S	*	*	H	α-helix	trans	-65.9	-35.6	173.2	-78.6	-176.9	-168.4	-176	8.1	112.9	E443	E443-R447 WeakPolarHBondContact O-CG 3.25Å; E443-R447 PolarHBondContact O-N 2.64Å; E443-R447 VanDerWaalsContact O-N 3.17Å; E443-R447 IonicContact OE1-CZ 3.76Å; E443-R447 IonicContact OE1-NE 3.79Å; E443-R447 IonicContact OE1-NH2 2.62Å; E443-R447 PolarHBondContact OE1-NH2 2.88Å
448	K	42.5	Very low	34.7	Very low	156 Å²	156	127.1 Å²	127.1	68%	0.678	66%	0.664	S	S	*	*	H	α-helix	trans	-79.1	-33	-179.4	-78	170.7	178.9	153.9	0	114.1	D444 I445	D444-K448 WeakPolarHBondContact O-CG 2.98Å; D444-K448 PolarHBondContact O-N 3.02Å; D444-K448 IonicContact OD1-NZ 2.69Å; D444-K448 IonicContact OD2-NZ 3.38Å; D444-K448 PolarHBondContact OD2-NZ 3.14Å; I445-K448 PolarHBondContact O-N 3.29Å
449	L	36.5	Very low	34.7	Very low	111 Å²	111	121 Å²	121	58%	0.581	65%	0.653	S	S	*	*	H	α-helix	trans	-83.5	-33.3	-174.2	-84.9	167.4	0	0	0	114.6	L415 I445	L415-L449 HydrophobicContact CD1-CD1 4.25Å; L415-L449 HydrophobicContact CD2-CD1 4.07Å; I445-L449 HydrophobicContact CG2-CD1 3.7Å; I445-L449 WeakPolarHBondContact O-CB 3.27Å; I445-L449 PolarHBondContact O-N 3.39Å
450	I	40.4	Very low	34.7	Very low	79 Å²	79	120.6 Å²	120.6	41%	0.405	66%	0.655	S	S	.	*	H	α-helix	trans	-105.5	-13.9	-166.3	-52.4	179	0	0	0	112.3	M446 S452 I454	M446-I450 HydrophobicContact CE-CD1 3.35Å; M446-I450 PolarHBondContact O-N 3.08Å; M446-I450 HydrophobicContact SD-CD1 3.96Å; I450-S452 PolarHBondContact O-N 3.19Å; I450-I454 HydrophobicContact CD1-CD1 3.86Å; I450-I454 HydrophobicContact CD1-CG1 4.31Å; I450-I454 HydrophobicContact CG2-CG1 4.46Å
451	G	29.5	Very low	34.7	Very low	64 Å²	64	119.8 Å²	119.8	66%	0.66	64%	0.642	S	S	*	*	S	Bend	trans	50.6	32.6	170.6	0	0	0	0	0	114.3
452	S	30.7	Very low	34.7	Very low	99 Å²	99	118.5 Å²	118.5	69%	0.692	64%	0.635	S	S	*	*	S	Bend	trans	162.4	162.6	165.3	46.2	0	0	0	0	110.7	I450	I450-S452 PolarHBondContact O-N 3.19Å
453	R	32.6	Very low	35	Very low	244 Å²	244	117 Å²	117	92%	0.921	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-59.5	128.5	-173.5	-73.8	177.2	173.7	175.6	-2.6	112.7
454	I	32	Very low	35.4	Very low	111 Å²	111	118.5 Å²	118.5	57%	0.569	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-69.2	126.4	165.3	-56.7	171.8	0	0	0	107.9	M446 I450	M446-I454 HydrophobicContact CE-CD1 3.7Å; I450-I454 HydrophobicContact CD1-CD1 3.86Å; I450-I454 HydrophobicContact CD1-CG1 4.31Å; I450-I454 HydrophobicContact CG2-CG1 4.46Å
455	P	30.7	Very low	35.8	Very low	114 Å²	114	121.2 Å²	121.2	74%	0.74	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-80.5	139.7	179.3	30.2	-30.5	0	0	0	111.8	A457	P455-A457 PolarHBondContact O-N 3.44Å
456	D	28.3	Very low	36.9	Very low	165 Å²	165	118.3 Å²	118.3	88%	0.882	64%	0.635	S	S	*	*	S	Bend	trans	-66.7	122.3	178.5	-67.8	-42.7	0	0	0	111.4
457	A	26.9	Very low	38.2	Very low	109 Å²	109	119.3 Å²	119.3	90%	0.901	65%	0.645	S	S	*	*			trans	46.5	97.5	163.7	0	0	0	0	0	117.7	P455	P455-A457 PolarHBondContact O-N 3.44Å
458	G	25.4	Very low	38.9	Very low	72 Å²	72	117.9 Å²	117.9	74%	0.742	65%	0.651	S	S	*	*			trans	-139.1	122.1	170.2	0	0	0	0	0	112.8
459	V	25	Very low	39.4	Very low	110 Å²	110	116.4 Å²	116.4	67%	0.667	66%	0.655	S	S	*	*			trans	-56.1	128.4	172	176.9	0	0	0	0	110	Y461	V459-Y461 HydrophobicContact CB-CE2 4.34Å; V459-Y461 VanDerWaalsContact O-CD2 3.23Å; V459-Y461 WeakPolarHBondContact O-CD2 3.37Å; V459-Y461 WeakPolarHBondContact O-CE2 3.26Å; V459-Y461 PolarHBondContact O-N 3.2Å
460	L	27.5	Very low	40.4	Very low	174 Å²	174	114.1 Å²	114.1	91%	0.911	65%	0.646	S	S	*	*			trans	-68.7	115.6	172.8	-83.9	157.2	0	0	0	109.2
461	Y	32.1	Very low	41.2	Very low	140 Å²	140	116.7 Å²	116.7	55%	0.549	67%	0.668	S	S	.	*			trans	-93.2	133.7	168.6	-62.2	-84.7	0	0	0	108.6	V459 Y463	V459-Y461 HydrophobicContact CB-CE2 4.34Å; V459-Y461 VanDerWaalsContact O-CD2 3.23Å; V459-Y461 WeakPolarHBondContact O-CD2 3.37Å; V459-Y461 WeakPolarHBondContact O-CE2 3.26Å; V459-Y461 PolarHBondContact O-N 3.2Å; Y461-Y463 WeakPolarHBondContact O-CD2 3.27Å; Y461-Y463 WeakPolarHBondContact O-CE2 3.46Å; Y461-Y463 PolarHBondContact O-N 3.34Å
462	D	36	Very low	43.5	Very low	107 Å²	107	118 Å²	118	57%	0.572	66%	0.659	S	S	*	*			trans	-75.6	113.8	175.3	-143.7	-19.5	0	0	0	108.1	K385	K385-D462 IonicContact NZ-OD2 3.85Å; K385-D462 PolarHBondContact NZ-OD2 3.17Å
463	Y	46.1	Very low	45.5	Very low	83 Å²	83	119.6 Å²	119.6	33%	0.325	66%	0.659	S	S	.	*			trans	-103.2	60.2	179.4	-64.3	-85.5	0	0	0	109.4	Y461 N465 C466 N483	Y461-Y463 WeakPolarHBondContact O-CD2 3.27Å; Y461-Y463 WeakPolarHBondContact O-CE2 3.46Å; Y461-Y463 PolarHBondContact O-N 3.34Å; Y463-N465 PolarHBondContact O-N 3.47Å; Y463-C466 PolarHBondContact O-N 3.43Å; Y463-N483 HydrophobicContact CD1-CB 4.42Å
464	E	46.7	Very low	47.7	Very low	158 Å²	158	111 Å²	111	74%	0.738	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-7.6	-177	-73.5	-175.3	153.2	0	0	114.3
465	N	53.9	Low	49.8	Very low	141 Å²	141	107.8 Å²	107.8	75%	0.754	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	7.7	-175.7	-67.4	-27.9	0	0	0	115.5	Y463 P467	Y463-N465 PolarHBondContact O-N 3.47Å; N465-P467 WeakPolarHBondContact O-CD 3.1Å
466	C	68.2	Low	51.8	Low	11 Å²	11	105.3 Å²	105.3	7%	0.074	61%	0.608	C	S	.	*	S	Bend	trans	-102.3	106.3	170.3	-63.9	0	0	0	0	108.6	Y463 D468 F476 C479	Y463-C466 PolarHBondContact O-N 3.43Å; C466-D468 PolarHBondContact O-N 2.95Å; C466-F476 HydrophobicContact CB-CD2 4.28Å; C466-F476 HydrophobicContact CB-CE2 4.01Å; C466-C479 HydrophobicContact CB-CB 4.14Å; C466-C479 WeakPolarHBondContact CB-SG 3.49Å; C466-C479 WeakPolarHBondContact SG-CB 3.34Å; C466-C479 CovalentContact SG-SG 2.06Å; C466-C479 PolarHBondContact SG-SG 3.15Å
467	P	66.8	Low	54.1	Low	80 Å²	80	103.4 Å²	103.4	52%	0.519	59%	0.593	S	S	.	*			trans	-64.2	126.3	-179.5	22.9	-30.2	0	0	0	110.6	N465 T469 V470	N465-P467 WeakPolarHBondContact O-CD 3.1Å; P467-T469 PolarHBondContact O-N 3.17Å; P467-V470 HydrophobicContact CG-CG2 4.4Å
468	D	58.9	Low	56.6	Low	148 Å²	148	101.7 Å²	101.7	79%	0.791	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-2.6	179.9	-77.5	-27.4	0	0	0	113.7	C466	C466-D468 PolarHBondContact O-N 2.95Å
469	T	53.4	Low	59.2	Low	124 Å²	124	99.8 Å²	99.8	76%	0.761	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	12.7	-174.6	57.4	0	0	0	0	114.3	P467 P471	P467-T469 PolarHBondContact O-N 3.17Å; T469-P471 WeakPolarHBondContact O-CD 3.34Å
470	V	57.6	Low	61.5	Low	63 Å²	63	98.3 Å²	98.3	38%	0.382	54%	0.535	S	S	.	.			trans	-87.3	116.2	177.4	-169.7	0	0	0	0	109.4	P467 D472 A475	P467-V470 HydrophobicContact CG-CG2 4.4Å; V470-D472 HydrophobicContact CG1-CB 4.22Å; V470-D472 PolarHBondContact O-N 2.72Å; V470-D472 VanDerWaalsContact O-N 3.15Å; V470-A475 HydrophobicContact CG1-CB 3.76Å
471	P	57.6	Low	63.9	Low	134 Å²	134	94.7 Å²	94.7	87%	0.87	52%	0.519	S	S	*	.	S	Bend	trans	-67.6	-13.2	-179.3	-15.2	29.1	0	0	0	113.3	T469	T469-P471 WeakPolarHBondContact O-CD 3.34Å
472	D	77.9	Confident	65.9	Low	91 Å²	91	96.5 Å²	96.5	49%	0.487	53%	0.53	S	S	.	.			trans	-98.9	107.8	-176	-172.4	-2.5	0	0	0	111.1	V470 A474 A475 F476	V470-D472 HydrophobicContact CG1-CB 4.22Å; V470-D472 PolarHBondContact O-N 2.72Å; V470-D472 VanDerWaalsContact O-N 3.15Å; D472-A474 PolarHBondContact O-N 2.87Å; D472-A474 WeakPolarHBondContact OD1-CB 3.35Å; D472-A474 PolarHBondContact OD1-N 3.02Å; D472-A475 HydrophobicContact CB-CB 4.16Å; D472-A475 PolarHBondContact O-N 2.91Å; D472-A475 VanDerWaalsContact O-N 3.13Å; D472-F476 PolarHBondContact O-N 2.98Å
473	I	72.5	Confident	67.4	Low	132 Å²	132	95.2 Å²	95.2	68%	0.677	52%	0.523	S	S	*	.	H	α-helix	trans	-55.8	-34.1	177.1	-63.4	171.9	0	0	0	110.9	F476 E477	I473-F476 PolarHBondContact O-N 2.88Å; I473-E477 PolarHBondContact O-N 3.24Å
474	A	79	Confident	68.1	Low	64 Å²	64	99.1 Å²	99.1	53%	0.529	54%	0.537	S	S	.	.	H	α-helix	trans	-68.2	-37.6	-179.8	0	0	0	0	0	112.1	D472 E477 S478	D472-A474 PolarHBondContact O-N 2.87Å; D472-A474 WeakPolarHBondContact OD1-CB 3.35Å; D472-A474 PolarHBondContact OD1-N 3.02Å; A474-E477 PolarHBondContact O-N 3.18Å; A474-S478 WeakPolarHBondContact O-CB 3.28Å; A474-S478 PolarHBondContact O-N 3.17Å
475	A	75.2	Confident	68.1	Low	43 Å²	43	96.4 Å²	96.4	36%	0.355	53%	0.534	S	S	.	.	H	α-helix	trans	-68.2	-37	176.1	0	0	0	0	0	111.8	V470 D472 S478 C479	V470-A475 HydrophobicContact CG1-CB 3.76Å; D472-A475 HydrophobicContact CB-CB 4.16Å; D472-A475 PolarHBondContact O-N 2.91Å; D472-A475 VanDerWaalsContact O-N 3.13Å; A475-S478 PolarHBondContact O-N 2.64Å; A475-C479 PolarHBondContact O-N 3.4Å
476	F	73.4	Confident	68	Low	62 Å²	62	96 Å²	96	27%	0.272	54%	0.536	S	S	.	.	H	α-helix	trans	-67.5	-42.2	174.8	-174.9	-109.9	0	0	0	112.5	C466 D472 I473 C479 K480	C466-F476 HydrophobicContact CB-CD2 4.28Å; C466-F476 HydrophobicContact CB-CE2 4.01Å; D472-F476 PolarHBondContact O-N 2.98Å; I473-F476 PolarHBondContact O-N 2.88Å; F476-C479 WeakPolarHBondContact O-CB 3.18Å; F476-C479 PolarHBondContact O-N 3.12Å; F476-K480 HydrophobicContact CE1-CD 4.27Å; F476-K480 PolarHBondContact O-N 3.49Å; F476-K480 VanDerWaalsContact O-N 3.13Å
477	E	75.8	Confident	66.8	Low	125 Å²	125	101.8 Å²	101.8	58%	0.584	57%	0.573	S	S	*	*	H	α-helix	trans	-65.7	-38.3	174.4	-70.9	-150.2	153.1	0	0	112.5	I473 A474 C479 K480 V481	I473-E477 PolarHBondContact O-N 3.24Å; A474-E477 PolarHBondContact O-N 3.18Å; E477-C479 VanDerWaalsContact C-N 3.34Å; E477-C479 PolarHBondContact O-N 2.91Å; E477-K480 WeakPolarHBondContact O-CB 3.18Å; E477-K480 PolarHBondContact O-N 3.39Å; E477-V481 WeakPolarHBondContact O-CG2 3.27Å; E477-V481 PolarHBondContact O-N 2.7Å
478	S	80.7	Confident	65.4	Low	74 Å²	74	101.1 Å²	101.1	52%	0.517	58%	0.581	S	S	.	*	H	α-helix	trans	-60.6	-41.6	173	-175.8	0	0	0	0	112	A474 A475 K480 V481 K482	A474-S478 WeakPolarHBondContact O-CB 3.28Å; A474-S478 PolarHBondContact O-N 3.17Å; A475-S478 PolarHBondContact O-N 2.64Å; S478-K480 PolarHBondContact O-N 2.78Å; S478-V481 PolarHBondContact O-N 3.07Å; S478-K482 WeakPolarHBondContact O-CB 3.08Å; S478-K482 PolarHBondContact O-N 3.09Å
479	C	79.1	Confident	64.3	Low	32 Å²	32	97 Å²	97	22%	0.216	57%	0.574	C	S	.	*	H	α-helix	trans	-59	-43.5	174.1	-171.4	0	0	0	0	112.1	C466 A475 F476 E477 K482 N483	C466-C479 HydrophobicContact CB-CB 4.14Å; C466-C479 WeakPolarHBondContact CB-SG 3.49Å; C466-C479 WeakPolarHBondContact SG-CB 3.34Å; C466-C479 CovalentContact SG-SG 2.06Å; C466-C479 PolarHBondContact SG-SG 3.15Å; A475-C479 PolarHBondContact O-N 3.4Å; F476-C479 WeakPolarHBondContact O-CB 3.18Å; F476-C479 PolarHBondContact O-N 3.12Å; E477-C479 VanDerWaalsContact C-N 3.34Å; E477-C479 PolarHBondContact O-N 2.91Å; C479-K482 PolarHBondContact O-N 2.87Å; C479-N483 WeakPolarHBondContact O-CB 3.06Å; C479-N483 PolarHBondContact O-N 2.78Å; C479-N483 VanDerWaalsContact O-N 3.14Å; C479-N483 PolarHBondContact O-ND2 3.09Å
480	K	73.8	Confident	63.2	Low	79 Å²	79	97.7 Å²	97.7	34%	0.343	58%	0.58	S	S	.	*	H	α-helix	trans	-62.6	-42.1	176.5	-76.1	-179.2	175.4	174	0	112.8	F476 E477 S478 R484	F476-K480 HydrophobicContact CE1-CD 4.27Å; F476-K480 PolarHBondContact O-N 3.49Å; F476-K480 VanDerWaalsContact O-N 3.13Å; E477-K480 WeakPolarHBondContact O-CB 3.18Å; E477-K480 PolarHBondContact O-N 3.39Å; S478-K480 PolarHBondContact O-N 2.78Å; K480-R484 PolarHBondContact O-N 2.89Å
481	V	76.8	Confident	61.9	Low	97 Å²	97	101.9 Å²	101.9	59%	0.588	60%	0.6	S	S	*	*	H	α-helix	trans	-67.7	-41	179.5	175	0	0	0	0	110.9	E477 S478 N483 R484	E477-V481 WeakPolarHBondContact O-CG2 3.27Å; E477-V481 PolarHBondContact O-N 2.7Å; S478-V481 PolarHBondContact O-N 3.07Å; V481-N483 VanDerWaalsContact C-N 3.3Å; V481-N483 PolarHBondContact O-N 3.35Å; V481-R484 PolarHBondContact O-N 3.24Å
482	K	75.8	Confident	60.7	Low	179 Å²	179	106.8 Å²	106.8	78%	0.778	60%	0.603	S	S	*	*	H	α-helix	trans	-66.2	-30.5	-180	-136.5	176.5	-174	179.9	0	113.3	S478 C479	S478-K482 WeakPolarHBondContact O-CB 3.08Å; S478-K482 PolarHBondContact O-N 3.09Å; C479-K482 PolarHBondContact O-N 2.87Å
483	N	67.4	Low	58.6	Low	79 Å²	79	113 Å²	113	42%	0.422	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96	6	-178.8	-70.2	-31.4	0	0	0	114.3	Y463 C479 V481 P485	Y463-N483 HydrophobicContact CD1-CB 4.42Å; C479-N483 WeakPolarHBondContact O-CB 3.06Å; C479-N483 PolarHBondContact O-N 2.78Å; C479-N483 VanDerWaalsContact O-N 3.14Å; C479-N483 PolarHBondContact O-ND2 3.09Å; V481-N483 VanDerWaalsContact C-N 3.3Å; V481-N483 PolarHBondContact O-N 3.35Å; N483-P485 WeakPolarHBondContact O-CD 3.33Å
484	R	59.6	Low	56.5	Low	165 Å²	165	114.4 Å²	114.4	62%	0.623	63%	0.627	S	S	*	*	S	Bend	trans	-69.6	125.3	169.1	-80.5	179.3	-175.5	-176.6	2.7	109.4	K480 V481 V486	K480-R484 PolarHBondContact O-N 2.89Å; V481-R484 PolarHBondContact O-N 3.24Å; R484-V486 PolarHBondContact O-N 3.43Å
485	P	46.7	Very low	54.4	Low	102 Å²	102	121.3 Å²	121.3	66%	0.662	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-63	126.4	172.8	23.6	-29.8	0	0	0	109.5	N483	N483-P485 WeakPolarHBondContact O-CD 3.33Å
486	V	52.3	Low	52.4	Low	131 Å²	131	128.6 Å²	128.6	79%	0.794	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57.1	132.1	173.3	-178.1	0	0	0	0	108.3	R484 G488	R484-V486 PolarHBondContact O-N 3.43Å; V486-G488 VanDerWaalsContact C-N 3.26Å; V486-G488 PolarHBondContact O-N 2.93Å
487	P	42.6	Very low	50.5	Low	133 Å²	133	135.8 Å²	135.8	86%	0.864	70%	0.7	S	S	*	*			trans	-69.9	84.6	178.5	27.9	-31.6	0	0	0	109.9
488	G	37	Very low	48.7	Very low	67 Å²	67	138.5 Å²	138.5	69%	0.691	71%	0.71	S	S	*	*			trans	-95.2	122.7	170.9	0	0	0	0	0	110.3	V486	V486-G488 VanDerWaalsContact C-N 3.26Å; V486-G488 PolarHBondContact O-N 2.93Å
489	G	35.9	Very low	46.4	Very low	61 Å²	61	143.7 Å²	143.7	63%	0.629	73%	0.726	S	S	*	*			trans	-59.7	174.3	-174.3	0	0	0	0	0	116.5	L491	G489-L491 PolarHBondContact O-N 3.25Å; G489-L491 VanDerWaalsContact O-N 3.08Å
490	P	30.4	Very low	44.4	Very low	139 Å²	139	145.9 Å²	145.9	90%	0.903	75%	0.754	S	S	*	*			trans	-74.8	105.2	-171.3	30.4	-32.1	0	0	0	110.8
491	L	29.8	Very low	42.5	Very low	150 Å²	150	152.3 Å²	152.3	79%	0.785	78%	0.782	S	S	*	*			trans	-109.7	81	166.3	-88.1	162.5	0	0	0	109.8	G489	G489-L491 PolarHBondContact O-N 3.25Å; G489-L491 VanDerWaalsContact O-N 3.08Å
492	Y	33.5	Very low	40.8	Very low	238 Å²	238	157.8 Å²	157.8	93%	0.933	80%	0.798	S	S	*	*			trans	-104.4	93.4	148.4	-96.9	-86.4	0	0	0	109.1
493	R	33.4	Very low	38.8	Very low	220 Å²	220	159.1 Å²	159.1	83%	0.83	80%	0.804	S	S	*	*			trans	-56.6	131	164.6	-101	175.4	171	172.6	-3	110.2	K495	R493-K495 PolarHBondContact O-N 3.07Å
494	L	29.2	Very low	37.6	Very low	162 Å²	162	161.3 Å²	161.3	85%	0.848	83%	0.825	S	S	*	*			trans	-41.6	127.7	156.8	-77.7	118.2	0	0	0	112
495	K	34.1	Very low	36.5	Very low	209 Å²	209	157.9 Å²	157.9	91%	0.909	83%	0.832	S	S	*	*			trans	-113.5	105.7	149.9	-88.2	-173.9	176.6	177.4	0	109.2	R493	R493-K495 PolarHBondContact O-N 3.07Å
496	K	32.8	Very low	36.1	Very low	197 Å²	197	159.6 Å²	159.6	86%	0.857	84%	0.841	S	S	*	*			trans	-56.9	132.7	157.2	-80.8	175.3	172.5	173.6	0	108.7
497	K	34.7	Very low	35.3	Very low	213 Å²	213	163.5 Å²	163.5	93%	0.926	85%	0.847	S	S	*	*			trans	-131.4	118	151.6	-130.8	-179.8	-177.4	-176.7	0	108.6
498	K	36.6	Very low	35.1	Very low	181 Å²	181	161.9 Å²	161.9	79%	0.787	84%	0.839	S	S	*	*			trans	-71.6	142.3	175.3	-82.7	-178.6	169.7	-175.3	0	110.6
499	E	33.3	Very low	35.3	Very low	184 Å²	184	168.5 Å²	168.5	86%	0.86	85%	0.849	S	S	*	*			trans	50.4	117.4	137.7	-63.1	176.5	156.5	0	0	120.5
500	G	36.1	Very low	35.1	Very low	78 Å²	78	174.6 Å²	174.6	80%	0.804	86%	0.858	S	S	*	*			trans	-158	97.2	156.2	0	0	0	0	0	110.3
501	K	34.7	Very low	35.5	Very low	213 Å²	213	174.1 Å²	174.1	93%	0.926	85%	0.853	S	S	*	*			trans	-56.8	133.6	171.1	-78.8	169.8	172.1	169.2	0	111
502	K	39.9	Very low	35.7	Very low	213 Å²	213	173.6 Å²	173.6	93%	0.926	85%	0.851	S	S	*	*			trans	-165.3	137.5	130.4	-109	171.6	-175.6	-178.9	0	112.1
503	K	35.7	Very low	36	Very low	206 Å²	206	168.3 Å²	168.3	90%	0.896	83%	0.833	S	S	*	*			trans	-80	141.4	-176.8	-59.3	168.2	174.5	178.4	0	110.3
504	S	41.4	Very low	36.2	Very low	125 Å²	125	165.9 Å²	165.9	87%	0.874	84%	0.836	S	S	*	*				-179.6	142.5	128	54.2	0	0	0	0	111.2
505	A	36.6	Very low	36.9	Very low	93 Å²	93	160.5 Å²	160.5	77%	0.769	81%	0.812	S	S	*	*			trans	-73.6	147	-171	0	0	0	0	0	113.7
506	T	37.9	Very low	37.6	Very low	138 Å²	138	156.7 Å²	156.7	85%	0.847	81%	0.811	S	S	*	*				-158.1	119.7	126.7	-57.4	0	0	0	0	108	S508	T506-S508 PolarHBondContact O-N 3.16Å
507	K	35.9	Very low	38.6	Very low	214 Å²	214	147.5 Å²	147.5	93%	0.93	77%	0.772	S	S	*	*			trans	-67.7	97	176.1	-76.6	174	175.5	173.2	0	109.5
508	S	38.8	Very low	39.6	Very low	98 Å²	98	141.3 Å²	141.3	69%	0.685	75%	0.748	S	S	*	*			trans	-98.3	116.6	158.8	166	0	0	0	0	107.7	T506 K510	T506-S508 PolarHBondContact O-N 3.16Å; S508-K510 PolarHBondContact O-N 3.17Å
509	K	40	Very low	40.6	Very low	207 Å²	207	133.8 Å²	133.8	90%	0.9	72%	0.718	S	S	*	*			trans	-64.7	80.8	166.2	-84.8	179.3	173.6	176	0	107.6	T511	K509-T511 PolarHBondContact O-N 3.39Å; K509-T511 VanDerWaalsContact O-N 3.16Å
510	K	32.8	Very low	41.9	Very low	189 Å²	189	126.7 Å²	126.7	82%	0.822	69%	0.688	S	S	*	*			trans	-69.7	103.7	160.4	-119.9	178.9	178.7	179.1	0	105.8	S508 D512	S508-K510 PolarHBondContact O-N 3.17Å; K510-D512 PolarHBondContact O-N 2.82Å
511	T	37.6	Very low	43.4	Very low	129 Å²	129	128.2 Å²	128.2	79%	0.791	68%	0.682	S	S	*	*			trans	-55.9	120.6	167.8	41.7	0	0	0	0	107.9	K509	K509-T511 PolarHBondContact O-N 3.39Å; K509-T511 VanDerWaalsContact O-N 3.16Å
512	D	34.1	Very low	44.6	Very low	139 Å²	139	120.4 Å²	120.4	74%	0.743	65%	0.65	S	S	*	*	S	Bend	trans	-53.1	138.6	169.6	-75	-47.9	0	0	0	109.8	K510	K510-D512 PolarHBondContact O-N 2.82Å
513	F	40.6	Very low	45.7	Very low	127 Å²	127	112.4 Å²	112.4	56%	0.557	62%	0.62	S	S	*	*			trans	95.9	59.8	166.9	-54.3	-74.1	0	0	0	119.7	S515 N586	F513-S515 VanDerWaalsContact C-N 3.33Å; F513-S515 PolarHBondContact O-N 2.98Å; F513-N586 WeakPolarHBondContact CE1-ND2 3.47Å; F513-N586 WeakPolarHBondContact CE1-OD1 3.45Å; F513-N586 WeakPolarHBondContact CZ-ND2 3.33Å; F513-N586 WeakPolarHBondContact CZ-OD1 3.27Å
514	D	36.5	Very low	47.2	Very low	169 Å²	169	109.1 Å²	109.1	90%	0.904	60%	0.602	S	S	*	*			trans	-84	81.9	140.6	-78.6	-29.1	0	0	0	108.6	S516	D514-S516 PolarHBondContact O-N 3.48Å
515	S	44.8	Very low	48.5	Very low	49 Å²	49	108.5 Å²	108.5	34%	0.343	59%	0.589	S	S	.	*			trans	-69.4	113.1	163.8	62.1	0	0	0	0	107.4	F513 C517 C520	F513-S515 VanDerWaalsContact C-N 3.33Å; F513-S515 PolarHBondContact O-N 2.98Å; S515-C517 PolarHBondContact O-N 2.99Å; S515-C520 WeakPolarHBondContact OG-CB 3.44Å
516	S	48.1	Very low	49.3	Very low	128 Å²	128	110 Å²	110	90%	0.895	58%	0.581	S	S	*	*			trans	-66.1	17.7	177.5	59.3	0	0	0	0	114.2	D514	D514-S516 PolarHBondContact O-N 3.48Å
517	C	54.2	Low	50.4	Low	4 Å²	4	104 Å²	104	3%	0.027	54%	0.544	C	S	.	.			trans	-102.1	117.2	-176.8	-161.8	0	0	0	0	109.2	S515 C520 C576 G578	S515-C517 PolarHBondContact O-N 2.99Å; C517-C520 VanDerWaalsContact CB-SG 3.55Å; C517-C520 WeakPolarHBondContact O-CB 3.31Å; C517-C520 PolarHBondContact O-N 3.22Å; C517-C520 PolarHBondContact O-SG 3.43Å; C517-C576 HydrophobicContact CB-CB 3.41Å; C517-C576 VanDerWaalsContact CB-CB 3.41Å; C517-C576 WeakPolarHBondContact CB-SG 3.47Å; C517-C576 VanDerWaalsContact SG-C 3.5Å; C517-C576 WeakPolarHBondContact SG-CB 3.45Å; C517-C576 CovalentContact SG-SG 1.98Å; C517-C576 PolarHBondContact SG-SG 3.08Å; C517-G578 VanDerWaalsContact SG-CA 3.59Å; C517-G578 PolarHBondContact SG-N 2.81Å
518	I	56	Low	52.3	Low	84 Å²	84	99.7 Å²	99.7	43%	0.431	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-54.2	-40.6	-171.1	-58.2	169.3	0	0	0	113.6	Y261 C520 T521	Y261-I518 HydrophobicContact CE1-CG2 3.81Å; Y261-I518 WeakPolarHBondContact OH-CG2 3.47Å; I518-C520 PolarHBondContact O-N 3.02Å; I518-C520 VanDerWaalsContact O-N 3.11Å; I518-T521 PolarHBondContact O-N 2.99Å; I518-T521 PolarHBondContact O-OG1 2.85Å
519	P	57.4	Low	53.9	Low	22 Å²	22	97.7 Å²	97.7	14%	0.143	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-64.9	-18.6	179.3	-18.3	31.2	0	0	0	113.7	T521 I522 F583 H592	P519-T521 VanDerWaalsContact C-N 3.25Å; P519-T521 PolarHBondContact O-N 3.44Å; P519-I522 WeakPolarHBondContact O-CB 3.41Å; P519-I522 WeakPolarHBondContact O-CG1 3.4Å; P519-I522 PolarHBondContact O-N 3.1Å; P519-F583 HydrophobicContact CB-CE1 3.63Å; P519-F583 HydrophobicContact CB-CZ 3.79Å; P519-F583 HydrophobicContact CG-CE1 3.9Å; P519-F583 HydrophobicContact CG-CZ 4.41Å; P519-H592 PolarHBondContact O-CE1 2.95Å
520	C	60.8	Low	55.8	Low	36 Å²	36	88.9 Å²	88.9	24%	0.243	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-78.9	-8.7	-177.7	-46.7	0	0	0	0	113.4	S515 C517 I518 C576 I585	S515-C520 WeakPolarHBondContact OG-CB 3.44Å; C517-C520 VanDerWaalsContact CB-SG 3.55Å; C517-C520 WeakPolarHBondContact O-CB 3.31Å; C517-C520 PolarHBondContact O-N 3.22Å; C517-C520 PolarHBondContact O-SG 3.43Å; I518-C520 PolarHBondContact O-N 3.02Å; I518-C520 VanDerWaalsContact O-N 3.11Å; C520-C576 PolarHBondContact SG-SG 3.49Å; C520-I585 HydrophobicContact CB-CD1 4.05Å; C520-I585 WeakPolarHBondContact SG-CD1 3.44Å
521	T	67.2	Low	58	Low	110 Å²	110	84.9 Å²	84.9	68%	0.675	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-75.9	-13.8	170.2	62.5	0	0	0	0	111.9	I518 P519 P523	I518-T521 PolarHBondContact O-N 2.99Å; I518-T521 PolarHBondContact O-OG1 2.85Å; P519-T521 VanDerWaalsContact C-N 3.25Å; P519-T521 PolarHBondContact O-N 3.44Å; T521-P523 WeakPolarHBondContact O-CD 3.42Å
522	I	60.7	Low	59.9	Low	49 Å²	49	87.1 Å²	87.1	25%	0.251	45%	0.446	S	S	.	.	S	Bend	trans	-66.9	124.5	178.6	-62	167.3	0	0	0	108.8	P519 R524 M526 H527 H592	P519-I522 WeakPolarHBondContact O-CB 3.41Å; P519-I522 WeakPolarHBondContact O-CG1 3.4Å; P519-I522 PolarHBondContact O-N 3.1Å; I522-R524 PolarHBondContact O-N 3.2Å; I522-M526 HydrophobicContact CG2-CB 4.22Å; I522-M526 HydrophobicContact CG2-SD 4.21Å; I522-H527 VanDerWaalsContact CG2-CE1 3.4Å; I522-H527 WeakPolarHBondContact CG2-CE1 3.4Å; I522-H527 PolarHBondContact O-CE1 3.26Å; I522-H592 VanDerWaalsContact CD1-ND1 3.33Å; I522-H592 WeakPolarHBondContact CD1-ND1 3.36Å
523	P	61.8	Low	62	Low	45 Å²	45	86.4 Å²	86.4	29%	0.292	44%	0.436	S	S	.	.			trans	-57.4	135.3	-176.8	-25.8	33.6	0	0	0	113.4	T521 N525 M526 H527	T521-P523 WeakPolarHBondContact O-CD 3.42Å; P523-N525 WeakPolarHBondContact CB-OD1 3.25Å; P523-N525 PolarHBondContact O-N 2.7Å; P523-M526 HydrophobicContact CG-SD 4.37Å; P523-M526 WeakPolarHBondContact O-CB 3.45Å; P523-M526 PolarHBondContact O-N 3.03Å; P523-H527 PolarHBondContact O-ND1 2.77Å
524	R	66.9	Low	64.1	Low	137 Å²	137	82.3 Å²	82.3	52%	0.517	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-52.1	-31.1	177	-90.6	-173	167.6	-165.3	-6.7	114.5	I522 M526 H527 I547 E588	I522-R524 PolarHBondContact O-N 3.2Å; R524-M526 PolarHBondContact O-N 3.34Å; R524-H527 WeakPolarHBondContact O-CB 3.35Å; R524-H527 PolarHBondContact O-N 3.41Å; R524-I547 HydrophobicContact CG-CD1 4.17Å; R524-E588 IonicContact CZ-OE1 2.77Å; R524-E588 IonicContact CZ-OE2 3.8Å; R524-E588 IonicContact NH2-OE1 3.66Å; R524-E588 PolarHBondContact NH2-OE1 3.07Å; R524-E588 IonicContact NH2-OE2 2.95Å; R524-E588 PolarHBondContact NH2-OE2 3.4Å
525	N	68.7	Low	66.6	Low	112 Å²	112	80 Å²	80	60%	0.599	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-70.9	-15.3	178.9	64.3	-57.9	0	0	0	114.2	K197 P523 H527	K197-N525 VanDerWaalsContact CE-OD1 3.31Å; K197-N525 WeakPolarHBondContact CE-OD1 3.46Å; K197-N525 PolarHBondContact NZ-OD1 3.22Å; P523-N525 WeakPolarHBondContact CB-OD1 3.25Å; P523-N525 PolarHBondContact O-N 2.7Å; N525-H527 VanDerWaalsContact C-N 3.27Å
526	M	54.9	Low	68.9	Low	123 Å²	123	78.7 Å²	78.7	61%	0.606	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-82.5	-11.7	170.6	-68	-178	164	0	0	112.3	I522 P523 R524	I522-M526 HydrophobicContact CG2-CB 4.22Å; I522-M526 HydrophobicContact CG2-SD 4.21Å; P523-M526 HydrophobicContact CG-SD 4.37Å; P523-M526 WeakPolarHBondContact O-CB 3.45Å; P523-M526 PolarHBondContact O-N 3.03Å; R524-M526 PolarHBondContact O-N 3.34Å
527	H	61.5	Low	71.1	Confident	14 Å²	14	77.1 Å²	77.1	7%	0.065	38%	0.384	C	S	.	.	S	Bend	trans	-94.3	138.2	179.4	-60.4	78.6	0	0	0	110.2	I522 P523 R524 N525 T529 H545 I547 H592	I522-H527 VanDerWaalsContact CG2-CE1 3.4Å; I522-H527 WeakPolarHBondContact CG2-CE1 3.4Å; I522-H527 PolarHBondContact O-CE1 3.26Å; P523-H527 PolarHBondContact O-ND1 2.77Å; R524-H527 WeakPolarHBondContact O-CB 3.35Å; R524-H527 PolarHBondContact O-N 3.41Å; N525-H527 VanDerWaalsContact C-N 3.27Å; H527-T529 VanDerWaalsContact C-N 3.35Å; H527-T529 PolarHBondContact O-N 2.88Å; H527-H545 VanDerWaalsContact CD2-CB 3.47Å; H527-H545 WeakPolarHBondContact CD2-CB 3.18Å; H527-I547 HydrophobicContact CB-CB 4.2Å; H527-I547 HydrophobicContact CB-CD1 3.36Å; H527-I547 HydrophobicContact CB-CG1 3.54Å; H527-I547 VanDerWaalsContact CD2-CD1 3.48Å; H527-I547 WeakPolarHBondContact CD2-CD1 3.37Å; H527-I547 VanDerWaalsContact CD2-CG1 3.41Å; H527-I547 WeakPolarHBondContact CD2-CG1 3.39Å; H527-H592 AromaticContact NE2-CE1 3.26Å; H527-H592 PolarHBondContact NE2-CE1 3.38Å; H527-H592 VanDerWaalsContact NE2-CE1 3.26Å; H527-H592 AromaticContact NE2-ND1 3.86Å
528	R	74.8	Confident	73	Confident	122 Å²	122	77.1 Å²	77.1	46%	0.46	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	96.7	164.8	-167.2	175.1	-173.4	-178.5	-0.3	108	M530 E539 H545 I547	R528-M530 HydrophobicContact CG-CG 4.49Å; R528-E539 PolarHBondContact NH1-O 2.83Å; R528-H545 PolarHBondContact N-O 3.39Å; R528-I547 PolarHBondContact O-N 3.35Å; R528-I547 VanDerWaalsContact O-N 3.09Å; R528-I547 VanDerWaalsContact O-O 3.09Å
529	T	72.8	Confident	74.8	Confident	57 Å²	57	78.1 Å²	78.1	35%	0.35	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	129.7	179.4	-52.6	0	0	0	0	109.6	H527 E531 I547	H527-T529 VanDerWaalsContact C-N 3.35Å; H527-T529 PolarHBondContact O-N 2.88Å; T529-E531 HydrophobicContact CG2-CG 4.3Å; T529-I547 WeakPolarHBondContact CA-O 3.41Å; T529-I547 HydrophobicContact CG2-CG2 4.33Å
530	M	79.7	Confident	76.5	Confident	22 Å²	22	77.1 Å²	77.1	11%	0.108	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	114.2	-176.9	-69.2	175.3	-80.6	0	0	112.5	R528 F536 V538 I546 I547 V548 S549	R528-M530 HydrophobicContact CG-CG 4.49Å; M530-F536 HydrophobicContact CB-CE2 3.84Å; M530-F536 HydrophobicContact CB-CZ 4.06Å; M530-F536 HydrophobicContact SD-CE2 4.05Å; M530-V538 HydrophobicContact CE-CB 4.12Å; M530-V538 HydrophobicContact CE-CG1 3.39Å; M530-V538 HydrophobicContact CE-CG2 3.74Å; M530-V538 HydrophobicContact SD-CB 3.82Å; M530-V538 HydrophobicContact SD-CG1 3.3Å; M530-V538 WeakPolarHBondContact SD-CG1 3.1Å; M530-V538 HydrophobicContact SD-CG2 3.18Å; M530-V538 WeakPolarHBondContact SD-CG2 2.93Å; M530-I546 HydrophobicContact CE-CG2 3.37Å; M530-I547 PolarHBondContact N-O 2.89Å; M530-V548 HydrophobicContact CE-CG2 4.01Å; M530-S549 PolarHBondContact O-N 3.49Å
531	E	78.5	Confident	77.9	Confident	105 Å²	105	82.8 Å²	82.8	49%	0.491	40%	0.396	S	S	.	.			trans	-120.2	49.8	-176.1	-61	-178.1	177.1	0	0	111	T529	T529-E531 HydrophobicContact CG2-CG 4.3Å
532	R	76.7	Confident	79	Confident	175 Å²	175	81.7 Å²	81.7	66%	0.66	39%	0.386	S	S	*	.			trans	-89	144.3	176.4	-72.5	-170.6	174.1	-175.3	-1.7	111.8	F536 K612	R532-F536 HydrophobicContact CB-CB 4.48Å; R532-F536 HydrophobicContact CB-CD1 3.95Å; R532-F536 HydrophobicContact CB-CD2 4.49Å; R532-F536 HydrophobicContact CB-CE1 4.26Å; R532-F536 HydrophobicContact CB-CG 4.07Å; R532-K612 WeakPolarHBondContact O-CE 3.32Å; R532-K612 PolarHBondContact O-NZ 3.36Å
533	K	80	Confident	80.3	Confident	125 Å²	125	83.7 Å²	83.7	54%	0.543	40%	0.397	S	S	.	.	S	Bend	trans	-70.4	147.7	170.9	-79.1	179.8	176.3	173.8	0	111.2	D552	K533-D552 VanDerWaalsContact CE-CG 3.41Å; K533-D552 WeakPolarHBondContact CE-OD1 2.89Å; K533-D552 VanDerWaalsContact CE-OD2 3.27Å; K533-D552 WeakPolarHBondContact CE-OD2 3.32Å; K533-D552 WeakPolarHBondContact CG-OD1 3.45Å
534	G	84.1	Confident	81.6	Confident	41 Å²	41	84.2 Å²	84.2	42%	0.423	40%	0.395	S	S	.	.	S	Bend	trans	70.8	-156.6	172	0	0	0	0	0	114.6	K612	G534-K612 WeakPolarHBondContact O-CG 3.41Å
535	N	89.4	Confident	82.8	Confident	121 Å²	121	79.4 Å²	79.4	65%	0.647	38%	0.378	S	S	*	.	S	Bend	trans	-82.8	131.5	179.5	-62.7	-21.4	0	0	0	110.2	S613	N535-S613 WeakPolarHBondContact CA-O 3.44Å; N535-S613 WeakPolarHBondContact OD1-CB 3.37Å; N535-S613 PolarHBondContact OD1-N 3.33Å
536	F	92.9	Very high	83.9	Confident	21 Å²	21	74.1 Å²	74.1	9%	0.092	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.8	179.3	64.8	-82.8	0	0	0	112.9	M530 R532 V538 V548 K612 S613 V614 R615	M530-F536 HydrophobicContact CB-CE2 3.84Å; M530-F536 HydrophobicContact CB-CZ 4.06Å; M530-F536 HydrophobicContact SD-CE2 4.05Å; R532-F536 HydrophobicContact CB-CB 4.48Å; R532-F536 HydrophobicContact CB-CD1 3.95Å; R532-F536 HydrophobicContact CB-CD2 4.49Å; R532-F536 HydrophobicContact CB-CE1 4.26Å; R532-F536 HydrophobicContact CB-CG 4.07Å; F536-V538 HydrophobicContact CD2-CG2 3.53Å; F536-V538 HydrophobicContact CE2-CG2 3.39Å; F536-V548 HydrophobicContact CZ-CG1 3.86Å; F536-K612 HydrophobicContact CE1-CD 4.08Å; F536-K612 VanDerWaalsContact CE1-CE 3.47Å; F536-S613 PolarHBondContact N-O 3Å; F536-V614 HydrophobicContact CD1-CG2 3.92Å; F536-V614 HydrophobicContact CD2-CG1 4.11Å; F536-V614 HydrophobicContact CE1-CB 4.41Å; F536-V614 HydrophobicContact CE1-CG1 4.32Å; F536-V614 HydrophobicContact CE1-CG2 3.32Å; F536-V614 HydrophobicContact CE2-CG1 3.69Å; F536-V614 HydrophobicContact CE2-CG2 4.22Å; F536-V614 HydrophobicContact CZ-CB 4.33Å; F536-V614 HydrophobicContact CZ-CG1 3.83Å; F536-V614 HydrophobicContact CZ-CG2 3.53Å; F536-V614 WeakPolarHBondContact O-CA 3.33Å; F536-R615 PolarHBondContact O-N 3.22Å
537	H	94.1	Very high	85.8	Confident	94 Å²	94	68.3 Å²	68.3	44%	0.435	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.1	177.6	-180	-116.2	0	0	0	109.9	E539 R615 S617	H537-E539 IonicContact CE1-OE1 2.63Å; H537-R615 CarbonylContact C-O 3.46Å; H537-R615 WeakPolarHBondContact CA-O 3.26Å; H537-R615 PolarHBondContact CD2-O 2.89Å; H537-S617 PolarHBondContact CE1-OG 2.81Å; H537-S617 WeakPolarHBondContact NE2-CB 3.37Å; H537-S617 PolarHBondContact NE2-OG 3.35Å
538	V	93.6	Very high	87.4	Confident	4 Å²	4	67.6 Å²	67.6	2%	0.024	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.6	178.5	-178	0	0	0	0	108.5	M530 F536 V614 R615 L616 S617	M530-V538 HydrophobicContact CE-CB 4.12Å; M530-V538 HydrophobicContact CE-CG1 3.39Å; M530-V538 HydrophobicContact CE-CG2 3.74Å; M530-V538 HydrophobicContact SD-CB 3.82Å; M530-V538 HydrophobicContact SD-CG1 3.3Å; M530-V538 WeakPolarHBondContact SD-CG1 3.1Å; M530-V538 HydrophobicContact SD-CG2 3.18Å; M530-V538 WeakPolarHBondContact SD-CG2 2.93Å; F536-V538 HydrophobicContact CD2-CG2 3.53Å; F536-V538 HydrophobicContact CE2-CG2 3.39Å; V538-V614 HydrophobicContact CG2-CG1 3.8Å; V538-R615 PolarHBondContact N-O 3.22Å; V538-L616 HydrophobicContact CB-CD2 3.57Å; V538-L616 HydrophobicContact CG1-CD2 4.08Å; V538-L616 HydrophobicContact CG2-CD2 3.87Å; V538-L616 CarbonylContact O-C 3.54Å; V538-L616 WeakPolarHBondContact O-CA 3.41Å; V538-S617 PolarHBondContact O-N 3.16Å; V538-S617 PolarHBondContact O-OG 2.86Å
539	E	93.8	Very high	88.3	Confident	105 Å²	105	62.1 Å²	62.1	49%	0.491	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	128.1	165.8	-70.6	174.3	-168.2	0	0	109.5	R528 H537 S617	R528-E539 PolarHBondContact NH1-O 2.83Å; H537-E539 IonicContact CE1-OE1 2.63Å; E539-S617 CarbonylContact C-O 3.58Å; E539-S617 VanDerWaalsContact CA-O 3.31Å; E539-S617 WeakPolarHBondContact CA-O 3.25Å; E539-S617 WeakPolarHBondContact CG-OG 3.29Å
540	F	93.2	Very high	89.2	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.009	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	148.7	177.6	68.7	-89.7	0	0	0	111.4	I546 A594 R595 D598 A599 L616 S617 V618 S619	F540-I546 HydrophobicContact CB-CD1 3.41Å; F540-I546 VanDerWaalsContact CB-CD1 3.41Å; F540-I546 HydrophobicContact CB-CG1 4.18Å; F540-I546 HydrophobicContact CD1-CD1 3.86Å; F540-I546 HydrophobicContact CD2-CD1 3.91Å; F540-I546 HydrophobicContact CG-CD1 3.47Å; F540-I546 VanDerWaalsContact CG-CD1 3.47Å; F540-A594 HydrophobicContact CD2-CB 3.51Å; F540-A594 HydrophobicContact CE2-CB 3.57Å; F540-A594 HydrophobicContact CG-CB 4.36Å; F540-A594 HydrophobicContact CZ-CB 4.45Å; F540-R595 WeakPolarHBondContact CE2-O 3.4Å; F540-R595 WeakPolarHBondContact CZ-O 3.19Å; F540-D598 HydrophobicContact CZ-CB 4.44Å; F540-A599 HydrophobicContact CE1-CB 4.3Å; F540-A599 HydrophobicContact CZ-CB 4.24Å; F540-L616 HydrophobicContact CD1-CB 3.98Å; F540-L616 HydrophobicContact CE1-CB 3.77Å; F540-S617 WeakPolarHBondContact CD1-O 3.47Å; F540-S617 VanDerWaalsContact CE1-C 3.48Å; F540-S617 WeakPolarHBondContact CE1-O 2.89Å; F540-S617 PolarHBondContact N-O 3.26Å; F540-V618 HydrophobicContact CE1-CG2 4.26Å; F540-V618 HydrophobicContact CE2-CG2 3.99Å; F540-V618 HydrophobicContact CZ-CG2 3.63Å; F540-S619 WeakPolarHBondContact O-CB 3.31Å; F540-S619 PolarHBondContact O-N 2.96Å
541	R	90.6	Very high	89.7	Confident	154 Å²	154	60.3 Å²	60.3	58%	0.581	29%	0.287	S	S	*	.			trans	-84.7	150.3	169.6	-65.8	-177.6	-179.4	177.6	0.4	109.5	L543 Q544	R541-L543 PolarHBondContact O-N 2.95Å; R541-Q544 HydrophobicContact CB-CB 4.43Å; R541-Q544 WeakPolarHBondContact O-CB 3.39Å; R541-Q544 PolarHBondContact O-N 3.41Å; R541-Q544 VanDerWaalsContact O-N 3.08Å
542	L	89.8	Confident	90	Very high	87 Å²	87	57 Å²	57	46%	0.455	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	143.5	171.9	-63.4	175.4	0	0	0	109.9	Q544 A594 R596 V618	L542-Q544 PolarHBondContact O-N 3.27Å; L542-A594 CarbonylContact C-O 3.59Å; L542-A594 WeakPolarHBondContact CA-O 3.49Å; L542-R596 HydrophobicContact CD2-CG 3.8Å; L542-V618 HydrophobicContact CD2-CG1 4.04Å; L542-V618 HydrophobicContact CD2-CG2 4.47Å; L542-V618 HydrophobicContact CG-CG1 4.2Å
543	L	88.6	Confident	90.2	Very high	92 Å²	92	52.2 Å²	52.2	48%	0.482	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	3.9	-177.3	-49.4	171.5	0	0	0	114.4	D258 R541 A593 A594	D258-L543 WeakPolarHBondContact OD2-CD1 3.45Å; R541-L543 PolarHBondContact O-N 2.95Å; L543-A593 HydrophobicContact CD2-CB 4.24Å; L543-A594 PolarHBondContact N-O 2.95Å
544	Q	89.3	Confident	90.3	Very high	55 Å²	55	52.3 Å²	52.3	26%	0.257	27%	0.271	S	S	.	.			trans	-72.5	139.7	174.6	-169.8	168.7	14.1	0	0	111.3	R541 L542 A594	R541-Q544 HydrophobicContact CB-CB 4.43Å; R541-Q544 WeakPolarHBondContact O-CB 3.39Å; R541-Q544 PolarHBondContact O-N 3.41Å; R541-Q544 VanDerWaalsContact O-N 3.08Å; L542-Q544 PolarHBondContact O-N 3.27Å; Q544-A594 WeakPolarHBondContact O-CB 3.4Å; Q544-A594 PolarHBondContact O-N 2.83Å
545	H	90.8	Very high	90.2	Very high	36 Å²	36	57.6 Å²	57.6	17%	0.167	28%	0.282	C	S	.	.			trans	-84.1	128	170.8	-63.6	-84.5	0	0	0	111	H527 R528 I591 H592 A593	H527-H545 VanDerWaalsContact CD2-CB 3.47Å; H527-H545 WeakPolarHBondContact CD2-CB 3.18Å; R528-H545 PolarHBondContact N-O 3.39Å; H545-I591 WeakPolarHBondContact CA-O 3.34Å; H545-H592 AromaticContact CE1-ND1 3.71Å; H545-H592 WeakPolarHBondContact ND1-CA 3.34Å; H545-H592 AromaticContact ND1-CG 3.8Å; H545-H592 AromaticContact ND1-ND1 3.23Å; H545-H592 PolarHBondContact ND1-ND1 3.02Å; H545-A593 PolarHBondContact ND1-N 2.83Å
546	I	93.6	Very high	89.9	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.4	-173	-49	175.2	0	0	0	108.9	M530 F540 V548 I591 A594 L616	M530-I546 HydrophobicContact CE-CG2 3.37Å; F540-I546 HydrophobicContact CB-CD1 3.41Å; F540-I546 VanDerWaalsContact CB-CD1 3.41Å; F540-I546 HydrophobicContact CB-CG1 4.18Å; F540-I546 HydrophobicContact CD1-CD1 3.86Å; F540-I546 HydrophobicContact CD2-CD1 3.91Å; F540-I546 HydrophobicContact CG-CD1 3.47Å; F540-I546 VanDerWaalsContact CG-CD1 3.47Å; I546-V548 HydrophobicContact CG2-CG2 3.85Å; I546-I591 HydrophobicContact CB-CB 4.25Å; I546-I591 PolarHBondContact N-O 3.47Å; I546-I591 PolarHBondContact O-N 3.48Å; I546-A594 HydrophobicContact CD1-CB 3.59Å; I546-A594 HydrophobicContact CG1-CB 4.11Å; I546-L616 HydrophobicContact CD1-CD1 4.33Å
547	I	94.6	Very high	89.3	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	124.4	168	-66.1	174	0	0	0	108.7	R524 H527 R528 T529 M530 E588 L589 H590	R524-I547 HydrophobicContact CG-CD1 4.17Å; H527-I547 HydrophobicContact CB-CB 4.2Å; H527-I547 HydrophobicContact CB-CD1 3.36Å; H527-I547 HydrophobicContact CB-CG1 3.54Å; H527-I547 VanDerWaalsContact CD2-CD1 3.48Å; H527-I547 WeakPolarHBondContact CD2-CD1 3.37Å; H527-I547 VanDerWaalsContact CD2-CG1 3.41Å; H527-I547 WeakPolarHBondContact CD2-CG1 3.39Å; R528-I547 PolarHBondContact O-N 3.35Å; R528-I547 VanDerWaalsContact O-N 3.09Å; R528-I547 VanDerWaalsContact O-O 3.09Å; T529-I547 WeakPolarHBondContact CA-O 3.41Å; T529-I547 HydrophobicContact CG2-CG2 4.33Å; M530-I547 PolarHBondContact N-O 2.89Å; I547-E588 HydrophobicContact CG2-CB 4.09Å; I547-E588 HydrophobicContact CG2-CG 4.43Å; I547-L589 WeakPolarHBondContact CA-O 3.46Å; I547-H590 VanDerWaalsContact CD1-CE1 3.4Å; I547-H590 WeakPolarHBondContact CD1-CE1 3.42Å
548	V	94.7	Very high	88.8	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	112.9	177.9	-173.7	0	0	0	0	108.5	M530 F536 I546 W565 E588 L589 V614 L616	M530-V548 HydrophobicContact CE-CG2 4.01Å; F536-V548 HydrophobicContact CZ-CG1 3.86Å; I546-V548 HydrophobicContact CG2-CG2 3.85Å; V548-W565 HydrophobicContact CB-CH2 4.2Å; V548-W565 HydrophobicContact CB-CZ2 4.43Å; V548-W565 HydrophobicContact CG1-CH2 3.5Å; V548-W565 VanDerWaalsContact CG1-CH2 3.5Å; V548-W565 HydrophobicContact CG1-CZ2 4.05Å; V548-W565 HydrophobicContact CG1-CZ3 4.31Å; V548-W565 WeakPolarHBondContact O-CZ2 3.36Å; V548-E588 CarbonylContact O-C 3.53Å; V548-E588 WeakPolarHBondContact O-CA 3.48Å; V548-L589 HydrophobicContact CB-CB 4.25Å; V548-L589 PolarHBondContact N-O 3.24Å; V548-L589 PolarHBondContact O-N 2.99Å; V548-V614 HydrophobicContact CG1-CB 4.17Å; V548-V614 HydrophobicContact CG1-CG1 4.02Å; V548-V614 HydrophobicContact CG1-CG2 3.68Å; V548-V614 HydrophobicContact CG2-CG1 4.47Å; V548-L616 HydrophobicContact CG2-CD2 4.49Å
549	S	93.4	Very high	88.5	Confident	6 Å²	6	66.3 Å²	66.3	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.8	176.3	-174.8	0	0	0	0	110.8	M530 L551 K612	M530-S549 PolarHBondContact O-N 3.49Å; S549-L551 VanDerWaalsContact C-N 3.34Å; S549-L551 PolarHBondContact OG-N 2.92Å; S549-K612 PolarHBondContact O-NZ 3.26Å
550	C	92	Very high	88.1	Confident	4 Å²	4	64.8 Å²	64.8	3%	0.027	33%	0.33	C	S	.	.			trans	-79.1	-26.3	171.5	-175.6	0	0	0	0	111.9	I563 W565 G587 C604	C550-I563 HydrophobicContact CB-CG2 3.92Å; C550-W565 HydrophobicContact CB-CH2 4.49Å; C550-W565 HydrophobicContact CB-CZ2 3.57Å; C550-G587 VanDerWaalsContact CB-O 3.27Å; C550-G587 WeakPolarHBondContact CB-O 3.44Å; C550-G587 PolarHBondContact N-O 2.93Å; C550-C604 HydrophobicContact CB-CB 3.76Å; C550-C604 WeakPolarHBondContact CB-SG 3.49Å; C550-C604 WeakPolarHBondContact SG-CB 3.47Å; C550-C604 CovalentContact SG-SG 1.99Å; C550-C604 PolarHBondContact SG-SG 3.2Å
551	L	89.3	Confident	87.6	Confident	37 Å²	37	72.4 Å²	72.4	19%	0.194	37%	0.366	C	S	.	.	S	Bend	trans	-68.7	139.9	-176	-64.2	173.2	0	0	0	110.2	S549 P558 L560 I563	S549-L551 VanDerWaalsContact C-N 3.34Å; S549-L551 PolarHBondContact OG-N 2.92Å; L551-P558 HydrophobicContact CD2-CG 3.9Å; L551-L560 HydrophobicContact CD1-CD2 4.24Å; L551-I563 HydrophobicContact CD2-CD1 3.63Å; L551-I563 HydrophobicContact CG-CD1 4.19Å
552	D	84.7	Confident	87.6	Confident	37 Å²	37	66.1 Å²	66.1	20%	0.198	35%	0.346	C	S	.	.			trans	-88	116.4	171	-166.7	-9.9	0	0	0	106.9	K533 N554 K555	K533-D552 VanDerWaalsContact CE-CG 3.41Å; K533-D552 WeakPolarHBondContact CE-OD1 2.89Å; K533-D552 VanDerWaalsContact CE-OD2 3.27Å; K533-D552 WeakPolarHBondContact CE-OD2 3.32Å; K533-D552 WeakPolarHBondContact CG-OD1 3.45Å; D552-N554 PolarHBondContact O-N 3.17Å; D552-K555 HydrophobicContact CB-CB 4.27Å; D552-K555 HydrophobicContact CB-CD 4.22Å; D552-K555 HydrophobicContact CB-CG 4.21Å; D552-K555 PolarHBondContact O-N 2.71Å
553	P	81.1	Confident	87.8	Confident	74 Å²	74	62.4 Å²	62.4	48%	0.481	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.6	-170.6	19.8	-32.4	0	0	0	113.6
554	N	83.1	Confident	88.1	Confident	126 Å²	126	60.5 Å²	60.5	67%	0.674	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	1.9	-178.1	-61	-1.3	0	0	0	114	D552	D552-N554 PolarHBondContact O-N 3.17Å
555	K	82.6	Confident	88.5	Confident	152 Å²	152	57.9 Å²	57.9	66%	0.661	31%	0.306	S	S	*	.	S	Bend	trans	-112.1	147.4	179.5	-68.4	-174.1	-179.8	179	0	110.8	D552 A557	D552-K555 HydrophobicContact CB-CB 4.27Å; D552-K555 HydrophobicContact CB-CD 4.22Å; D552-K555 HydrophobicContact CB-CG 4.21Å; D552-K555 PolarHBondContact O-N 2.71Å; K555-A557 PolarHBondContact O-N 2.87Å
556	K	82.5	Confident	88.7	Confident	208 Å²	208	57.9 Å²	57.9	90%	0.904	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-52.5	126.6	171.2	-97.5	-175.6	176	178.2	0	109.1	P558	K556-P558 VanDerWaalsContact O-CD 3.29Å; K556-P558 WeakPolarHBondContact O-CD 3.43Å; K556-P558 VanDerWaalsContact O-N 3.16Å
557	A	80.4	Confident	88.8	Confident	73 Å²	73	60.4 Å²	60.4	60%	0.603	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-57.6	118.4	-179.9	0	0	0	0	0	109.4	K555	K555-A557 PolarHBondContact O-N 2.87Å
558	P	82.4	Confident	88.7	Confident	42 Å²	42	65.1 Å²	65.1	27%	0.273	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-62.3	164.8	168	25.1	-30.8	0	0	0	110.1	L551 K556 L560 I563 I606	L551-P558 HydrophobicContact CD2-CG 3.9Å; K556-P558 VanDerWaalsContact O-CD 3.29Å; K556-P558 WeakPolarHBondContact O-CD 3.43Å; K556-P558 VanDerWaalsContact O-N 3.16Å; P558-L560 PolarHBondContact O-N 3.28Å; P558-I563 HydrophobicContact CG-CD1 4.28Å; P558-I606 HydrophobicContact CB-CG2 3.9Å; P558-I606 HydrophobicContact CG-CD1 3.95Å; P558-I606 HydrophobicContact CG-CG2 3.92Å
559	D	87.5	Confident	88.4	Confident	101 Å²	101	75 Å²	75	54%	0.54	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-52.9	116	172.7	-179.3	3.1	0	0	0	110.1	Q561 S562	D559-Q561 PolarHBondContact O-N 3Å; D559-Q561 VanDerWaalsContact O-N 3.1Å; D559-Q561 PolarHBondContact OD1-N 2.82Å; D559-S562 WeakPolarHBondContact O-CB 3.41Å; D559-S562 PolarHBondContact O-N 3.41Å; D559-S562 PolarHBondContact O-OG 3.44Å
560	L	85.3	Confident	88.3	Confident	73 Å²	73	78.1 Å²	78.1	38%	0.382	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-56.5	-28.6	-175.4	-68.6	168.9	0	0	0	112	L551 P558 S562 I563 N586	L551-L560 HydrophobicContact CD1-CD2 4.24Å; P558-L560 PolarHBondContact O-N 3.28Å; L560-S562 PolarHBondContact O-N 3.46Å; L560-I563 HydrophobicContact CD2-CD1 4.24Å; L560-I563 PolarHBondContact O-N 3.05Å; L560-N586 WeakPolarHBondContact CD2-O 3.42Å
561	Q	84	Confident	88.1	Confident	161 Å²	161	85.9 Å²	85.9	75%	0.752	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-70.2	-20.8	178	-60.3	-165	8.2	0	0	113.2	D559 I563	D559-Q561 PolarHBondContact O-N 3Å; D559-Q561 VanDerWaalsContact O-N 3.1Å; D559-Q561 PolarHBondContact OD1-N 2.82Å; Q561-I563 VanDerWaalsContact C-N 3.32Å
562	S	89.9	Confident	88.3	Confident	22 Å²	22	88.2 Å²	88.2	15%	0.154	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-84.9	-5.2	179.5	74	0	0	0	0	113.9	D559 L560 K607	D559-S562 WeakPolarHBondContact O-CB 3.41Å; D559-S562 PolarHBondContact O-N 3.41Å; D559-S562 PolarHBondContact O-OG 3.44Å; L560-S562 PolarHBondContact O-N 3.46Å; S562-K607 PolarHBondContact O-N 3.14Å
563	I	93.6	Very high	88.7	Confident	10 Å²	10	87.4 Å²	87.4	5%	0.051	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	122.2	-178.2	-53.4	176.3	0	0	0	109.1	C550 L551 P558 L560 Q561 K605 I606	C550-I563 HydrophobicContact CB-CG2 3.92Å; L551-I563 HydrophobicContact CD2-CD1 3.63Å; L551-I563 HydrophobicContact CG-CD1 4.19Å; P558-I563 HydrophobicContact CG-CD1 4.28Å; L560-I563 HydrophobicContact CD2-CD1 4.24Å; L560-I563 PolarHBondContact O-N 3.05Å; Q561-I563 VanDerWaalsContact C-N 3.32Å; I563-K605 WeakPolarHBondContact CA-O 3.33Å; I563-I606 HydrophobicContact CG1-CG1 4.31Å
564	T	95.5	Very high	89.1	Confident	51 Å²	51	85.6 Å²	85.6	31%	0.313	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.1	177.6	56.2	0	0	0	0	110.2	V572 K605	T564-V572 HydrophobicContact CG2-CG1 4.4Å; T564-K605 PolarHBondContact N-O 2.9Å; T564-K605 PolarHBondContact O-N 2.95Å; T564-K605 PolarHBondContact OG1-O 2.94Å
565	W	96.8	Very high	89.3	Confident	1 Å²	1	87 Å²	87	0%	0.004	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	143	172.1	-74.8	91.3	0	0	0	110.1	V548 C550 V572 I573 V584 G587 L589 I603 C604 V614	V548-W565 HydrophobicContact CB-CH2 4.2Å; V548-W565 HydrophobicContact CB-CZ2 4.43Å; V548-W565 HydrophobicContact CG1-CH2 3.5Å; V548-W565 VanDerWaalsContact CG1-CH2 3.5Å; V548-W565 HydrophobicContact CG1-CZ2 4.05Å; V548-W565 HydrophobicContact CG1-CZ3 4.31Å; V548-W565 WeakPolarHBondContact O-CZ2 3.36Å; C550-W565 HydrophobicContact CB-CH2 4.49Å; C550-W565 HydrophobicContact CB-CZ2 3.57Å; W565-V572 CarbonylContact O-C 3.59Å; W565-V572 WeakPolarHBondContact O-CG1 3.28Å; W565-I573 HydrophobicContact CB-CB 4.44Å; W565-I573 HydrophobicContact CB-CD1 4.4Å; W565-I573 PolarHBondContact O-N 3.03Å; W565-V584 HydrophobicContact CB-CG2 3.7Å; W565-V584 HydrophobicContact CG-CG2 4.04Å; W565-G587 PolarHBondContact NE1-O 3.17Å; W565-L589 HydrophobicContact CD2-CB 3.68Å; W565-L589 HydrophobicContact CD2-CD2 4.39Å; W565-L589 HydrophobicContact CE3-CB 4.13Å; W565-L589 HydrophobicContact CE3-CD2 4.04Å; W565-L589 HydrophobicContact CG-CB 3.91Å; W565-L589 HydrophobicContact CZ2-CB 4.11Å; W565-L589 HydrophobicContact CZ3-CD2 4.33Å; W565-I603 WeakPolarHBondContact CA-O 3.14Å; W565-C604 HydrophobicContact CD2-CB 3.87Å; W565-C604 HydrophobicContact CE3-CB 3.84Å; W565-C604 HydrophobicContact CH2-CB 3.77Å; W565-C604 HydrophobicContact CZ2-CB 3.81Å; W565-C604 HydrophobicContact CZ3-CB 3.79Å; W565-V614 HydrophobicContact CH2-CG2 4.17Å; W565-V614 HydrophobicContact CZ3-CG2 4.34Å
566	Q	96.1	Very high	89.3	Confident	36 Å²	36	80.9 Å²	80.9	17%	0.168	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.8	171.3	63.3	178.2	33.5	0	0	108.8	Y602 I603 K605	Q566-Y602 WeakPolarHBondContact O-CA 3.22Å; Q566-I603 HydrophobicContact CG-CB 3.91Å; Q566-I603 PolarHBondContact N-O 3.1Å; Q566-I603 PolarHBondContact O-N 3.03Å; Q566-K605 VanDerWaalsContact CD-NZ 3.34Å; Q566-K605 VanDerWaalsContact NE2-CE 3.34Å; Q566-K605 VanDerWaalsContact NE2-NZ 3.19Å
567	K	96	Very high	89	Confident	53 Å²	53	81.3 Å²	81.3	23%	0.23	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	141.7	165.3	-165.3	179.9	-175.5	-168.2	0	108.2	K569 S570 E597 A599 Y602	K567-K569 PolarHBondContact O-N 2.87Å; K567-S570 WeakPolarHBondContact O-CB 3.1Å; K567-S570 PolarHBondContact O-N 3.22Å; K567-E597 PolarHBondContact NZ-O 3.05Å; K567-A599 WeakPolarHBondContact CE-O 3.34Å; K567-A599 PolarHBondContact NZ-O 3.42Å; K567-Y602 HydrophobicContact CB-CD1 4.1Å; K567-Y602 HydrophobicContact CB-CE1 3.92Å; K567-Y602 HydrophobicContact CD-CE1 4.15Å; K567-Y602 HydrophobicContact CD-CE2 4.46Å; K567-Y602 HydrophobicContact CG-CD1 4.26Å; K567-Y602 HydrophobicContact CG-CE1 3.92Å; K567-Y602 HydrophobicContact CG-CE2 4.28Å
568	E	92.8	Very high	88.3	Confident	100 Å²	100	79.2 Å²	79.2	47%	0.467	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	126.7	-179.2	179.6	170.2	-146.1	0	0	110.3	S570 T601	E568-S570 PolarHBondContact O-N 3.4Å; E568-T601 WeakPolarHBondContact CB-O 3.36Å; E568-T601 PolarHBondContact N-O 2.92Å; E568-T601 WeakPolarHBondContact OE2-CB 3.48Å; E568-T601 PolarHBondContact OE2-OG1 3.22Å
569	K	88	Confident	87.6	Confident	209 Å²	209	85 Å²	85	91%	0.909	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	17.2	-174	-54.6	174.7	-177.4	-178.6	0	115.7	K567	K567-K569 PolarHBondContact O-N 2.87Å
570	S	90.5	Very high	87.2	Confident	71 Å²	71	83.5 Å²	83.5	50%	0.497	42%	0.423	S	S	.	.	S	Bend	trans	-117.9	175.5	175.1	-160.7	0	0	0	0	111.8	K567 E568	K567-S570 WeakPolarHBondContact O-CB 3.1Å; K567-S570 PolarHBondContact O-N 3.22Å; E568-S570 PolarHBondContact O-N 3.4Å
571	H	89.1	Confident	87.3	Confident	166 Å²	166	82.2 Å²	82.2	77%	0.769	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-68.6	160.4	175.3	-63.3	-67.5	0	0	0	111.7	I573	H571-I573 PolarHBondContact O-N 3.08Å
572	V	92.4	Very high	87.6	Confident	86 Å²	86	75.9 Å²	75.9	52%	0.521	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	128.2	172.8	179.6	0	0	0	0	108.7	T564 W565 G574	T564-V572 HydrophobicContact CG2-CG1 4.4Å; W565-V572 CarbonylContact O-C 3.59Å; W565-V572 WeakPolarHBondContact O-CG1 3.28Å; V572-G574 PolarHBondContact O-N 2.64Å
573	I	93.5	Very high	87.8	Confident	21 Å²	21	74.8 Å²	74.8	11%	0.108	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	120.8	179.1	-59.1	173.4	0	0	0	107.6	W565 H571 V584 L589 Y602	W565-I573 HydrophobicContact CB-CB 4.44Å; W565-I573 HydrophobicContact CB-CD1 4.4Å; W565-I573 PolarHBondContact O-N 3.03Å; H571-I573 PolarHBondContact O-N 3.08Å; I573-V584 HydrophobicContact CB-CG2 4.13Å; I573-V584 HydrophobicContact CG2-CG2 4.02Å; I573-V584 WeakPolarHBondContact O-CG2 3.45Å; I573-L589 HydrophobicContact CD1-CD1 3.62Å; I573-L589 HydrophobicContact CG2-CD1 4.25Å; I573-Y602 HydrophobicContact CD1-CD1 3.66Å; I573-Y602 HydrophobicContact CD1-CE1 3.63Å
574	G	89.4	Confident	87.7	Confident	36 Å²	36	75 Å²	75	37%	0.371	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-73	171.8	-176.4	0	0	0	0	0	113.9	V572 F583 V584	V572-G574 PolarHBondContact O-N 2.64Å; G574-F583 WeakPolarHBondContact O-CA 3.43Å; G574-V584 PolarHBondContact O-N 3.46Å
575	K	87.5	Confident	87.5	Confident	155 Å²	155	73.9 Å²	73.9	67%	0.674	38%	0.378	S	S	*	.	B	Isolated β-bridge	trans	-64.4	158.7	165	-64.4	-175.5	-179.3	-178.4	0	110.2	R577	K575-R577 PolarHBondContact O-N 3.48Å
576	C	83.2	Confident	87.1	Confident	24 Å²	24	76.2 Å²	76.2	16%	0.162	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-61.1	118	-177.7	-155.4	0	0	0	0	111.9	C517 C520 F583 I585	C517-C576 HydrophobicContact CB-CB 3.41Å; C517-C576 VanDerWaalsContact CB-CB 3.41Å; C517-C576 WeakPolarHBondContact CB-SG 3.47Å; C517-C576 VanDerWaalsContact SG-C 3.5Å; C517-C576 WeakPolarHBondContact SG-CB 3.45Å; C517-C576 CovalentContact SG-SG 1.98Å; C517-C576 PolarHBondContact SG-SG 3.08Å; C520-C576 PolarHBondContact SG-SG 3.49Å; C576-F583 HydrophobicContact CB-CB 4.05Å; C576-F583 HydrophobicContact CB-CD1 4.28Å; C576-F583 HydrophobicContact CB-CD2 3.65Å; C576-F583 HydrophobicContact CB-CE2 4.06Å; C576-F583 HydrophobicContact CB-CG 3.73Å; C576-F583 HydrophobicContact CB-CZ 4.48Å; C576-F583 WeakPolarHBondContact SG-CD1 3.22Å; C576-F583 WeakPolarHBondContact SG-CE1 3.39Å; C576-F583 VanDerWaalsContact SG-CE2 3.57Å; C576-F583 VanDerWaalsContact SG-CG 3.51Å; C576-F583 WeakPolarHBondContact SG-CZ 3.39Å; C576-I585 HydrophobicContact CB-CD1 3.98Å; C576-I585 HydrophobicContact CB-CG1 4.3Å
577	R	76.1	Confident	86.8	Confident	216 Å²	216	74.7 Å²	74.7	82%	0.815	38%	0.384	S	S	*	.			trans	-115.8	28	179.7	-72.2	-172.4	177	179.3	-0.5	113.3	K575 L579	K575-R577 PolarHBondContact O-N 3.48Å; R577-L579 VanDerWaalsContact C-N 3.26Å; R577-L579 PolarHBondContact O-N 2.84Å; R577-L579 VanDerWaalsContact O-N 3.12Å
578	G	65	Low	86.7	Confident	29 Å²	29	72.7 Å²	72.7	30%	0.299	38%	0.375	S	S	.	.	S	Bend	trans	83.4	-30.7	173.1	0	0	0	0	0	115.9	C517	C517-G578 VanDerWaalsContact SG-CA 3.59Å; C517-G578 PolarHBondContact SG-N 2.81Å
579	L	67.1	Low	86.8	Confident	164 Å²	164	68 Å²	68	86%	0.859	35%	0.353	S	S	*	.	S	Bend	trans	-115.1	-10.8	-175.9	-66.9	170.6	0	0	0	114.8	R577	R577-L579 VanDerWaalsContact C-N 3.26Å; R577-L579 PolarHBondContact O-N 2.84Å; R577-L579 VanDerWaalsContact O-N 3.12Å
580	N	80.1	Confident	87.1	Confident	69 Å²	69	58.6 Å²	58.6	37%	0.369	31%	0.313	S	S	.	.			trans	-75.9	131.8	-176.6	-63.4	1.1	0	0	0	110.3	S582 F583	N580-S582 VanDerWaalsContact C-N 3.34Å; N580-S582 WeakPolarHBondContact CB-O 3.46Å; N580-F583 WeakPolarHBondContact O-CD1 3.5Å
581	T	85.9	Confident	87.3	Confident	46 Å²	46	55.2 Å²	55.2	28%	0.282	29%	0.289	S	S	.	.	S	Bend	trans	-71	-32.6	172.3	51.6	0	0	0	0	112	I591 H592	T581-I591 WeakPolarHBondContact O-CA 3.18Å; T581-H592 PolarHBondContact O-N 2.89Å
582	S	91.4	Very high	87.4	Confident	28 Å²	28	48 Å²	48	20%	0.196	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131.8	174.7	56.8	0	0	0	0	111.1	N580 H590	N580-S582 VanDerWaalsContact C-N 3.34Å; N580-S582 WeakPolarHBondContact CB-O 3.46Å; S582-H590 CarbonylContact C-O 3.59Å; S582-H590 VanDerWaalsContact CA-O 3.3Å; S582-H590 WeakPolarHBondContact CA-O 3.35Å
583	F	93.6	Very high	87.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	167.1	-179.2	55.7	-101.1	0	0	0	112.4	P519 G574 C576 N580 I585 H590 H592	P519-F583 HydrophobicContact CB-CE1 3.63Å; P519-F583 HydrophobicContact CB-CZ 3.79Å; P519-F583 HydrophobicContact CG-CE1 3.9Å; P519-F583 HydrophobicContact CG-CZ 4.41Å; G574-F583 WeakPolarHBondContact O-CA 3.43Å; C576-F583 HydrophobicContact CB-CB 4.05Å; C576-F583 HydrophobicContact CB-CD1 4.28Å; C576-F583 HydrophobicContact CB-CD2 3.65Å; C576-F583 HydrophobicContact CB-CE2 4.06Å; C576-F583 HydrophobicContact CB-CG 3.73Å; C576-F583 HydrophobicContact CB-CZ 4.48Å; C576-F583 WeakPolarHBondContact SG-CD1 3.22Å; C576-F583 WeakPolarHBondContact SG-CE1 3.39Å; C576-F583 VanDerWaalsContact SG-CE2 3.57Å; C576-F583 VanDerWaalsContact SG-CG 3.51Å; C576-F583 WeakPolarHBondContact SG-CZ 3.39Å; N580-F583 WeakPolarHBondContact O-CD1 3.5Å; F583-I585 HydrophobicContact CD2-CD1 3.81Å; F583-I585 HydrophobicContact CD2-CG1 3.8Å; F583-I585 HydrophobicContact CE2-CD1 3.42Å; F583-I585 VanDerWaalsContact CE2-CD1 3.42Å; F583-I585 HydrophobicContact CE2-CG1 3.88Å; F583-I585 HydrophobicContact CZ-CD1 4.43Å; F583-H590 HydrophobicContact CD2-CB 3.75Å; F583-H590 HydrophobicContact CE2-CB 3.4Å; F583-H590 AromaticContact CE2-CG 3.8Å; F583-H590 HydrophobicContact CG-CB 4.46Å; F583-H590 HydrophobicContact CZ-CB 3.88Å; F583-H590 PolarHBondContact N-O 3.09Å; F583-H590 PolarHBondContact O-N 3.3Å; F583-H592 AromaticContact CE1-CD2 3.1Å; F583-H592 WeakPolarHBondContact CE1-CD2 3.44Å; F583-H592 AromaticContact CE1-NE2 3.38Å; F583-H592 WeakPolarHBondContact CE1-NE2 3.3Å; F583-H592 AromaticContact CE2-NE2 3.92Å; F583-H592 AromaticContact CZ-CD2 3.29Å; F583-H592 WeakPolarHBondContact CZ-CD2 3.32Å; F583-H592 AromaticContact CZ-NE2 2.96Å; F583-H592 WeakPolarHBondContact CZ-NE2 3.12Å
584	V	92.9	Very high	87.1	Confident	15 Å²	15	44.4 Å²	44.4	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.7	179	-177.6	0	0	0	0	111.3	W565 I573 G574 E588	W565-V584 HydrophobicContact CB-CG2 3.7Å; W565-V584 HydrophobicContact CG-CG2 4.04Å; I573-V584 HydrophobicContact CB-CG2 4.13Å; I573-V584 HydrophobicContact CG2-CG2 4.02Å; I573-V584 WeakPolarHBondContact O-CG2 3.45Å; G574-V584 PolarHBondContact O-N 3.46Å; V584-E588 VanDerWaalsContact CA-O 3.3Å; V584-E588 WeakPolarHBondContact CA-O 3.33Å
585	I	89.7	Confident	87.3	Confident	27 Å²	27	47 Å²	47	14%	0.138	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.8	172.5	-68.1	-177.6	0	0	0	109.1	C520 C576 F583 G587 E588	C520-I585 HydrophobicContact CB-CD1 4.05Å; C520-I585 WeakPolarHBondContact SG-CD1 3.44Å; C576-I585 HydrophobicContact CB-CD1 3.98Å; C576-I585 HydrophobicContact CB-CG1 4.3Å; F583-I585 HydrophobicContact CD2-CD1 3.81Å; F583-I585 HydrophobicContact CD2-CG1 3.8Å; F583-I585 HydrophobicContact CE2-CD1 3.42Å; F583-I585 VanDerWaalsContact CE2-CD1 3.42Å; F583-I585 HydrophobicContact CE2-CG1 3.88Å; F583-I585 HydrophobicContact CZ-CD1 4.43Å; I585-G587 PolarHBondContact O-N 3.3Å; I585-G587 VanDerWaalsContact O-N 3.13Å; I585-E588 PolarHBondContact N-O 3.05Å; I585-E588 WeakPolarHBondContact O-CA 3.49Å; I585-E588 WeakPolarHBondContact O-CB 3.49Å; I585-E588 PolarHBondContact O-N 3.23Å
586	N	88.7	Confident	87.6	Confident	50 Å²	50	48.9 Å²	48.9	27%	0.267	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	36.5	177.5	-60.9	-16.5	0	0	0	113.7	F513 L560 E588	F513-N586 WeakPolarHBondContact CE1-ND2 3.47Å; F513-N586 WeakPolarHBondContact CE1-OD1 3.45Å; F513-N586 WeakPolarHBondContact CZ-ND2 3.33Å; F513-N586 WeakPolarHBondContact CZ-OD1 3.27Å; L560-N586 WeakPolarHBondContact CD2-O 3.42Å; N586-E588 PolarHBondContact O-N 2.86Å
587	G	90.3	Very high	88.1	Confident	3 Å²	3	53 Å²	53	3%	0.031	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	4.7	-177.7	0	0	0	0	0	114.8	C550 W565 I585	C550-G587 VanDerWaalsContact CB-O 3.27Å; C550-G587 WeakPolarHBondContact CB-O 3.44Å; C550-G587 PolarHBondContact N-O 2.93Å; W565-G587 PolarHBondContact NE1-O 3.17Å; I585-G587 PolarHBondContact O-N 3.3Å; I585-G587 VanDerWaalsContact O-N 3.13Å
588	E	93.6	Very high	89	Confident	12 Å²	12	43.3 Å²	43.3	6%	0.056	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	142.4	173.9	-57.5	172.8	166.9	0	0	109.7	R524 I547 V548 V584 I585 N586 H590	R524-E588 IonicContact CZ-OE1 2.77Å; R524-E588 IonicContact CZ-OE2 3.8Å; R524-E588 IonicContact NH2-OE1 3.66Å; R524-E588 PolarHBondContact NH2-OE1 3.07Å; R524-E588 IonicContact NH2-OE2 2.95Å; R524-E588 PolarHBondContact NH2-OE2 3.4Å; I547-E588 HydrophobicContact CG2-CB 4.09Å; I547-E588 HydrophobicContact CG2-CG 4.43Å; V548-E588 CarbonylContact O-C 3.53Å; V548-E588 WeakPolarHBondContact O-CA 3.48Å; V584-E588 VanDerWaalsContact CA-O 3.3Å; V584-E588 WeakPolarHBondContact CA-O 3.33Å; I585-E588 PolarHBondContact N-O 3.05Å; I585-E588 WeakPolarHBondContact O-CA 3.49Å; I585-E588 WeakPolarHBondContact O-CB 3.49Å; I585-E588 PolarHBondContact O-N 3.23Å; N586-E588 PolarHBondContact O-N 2.86Å; E588-H590 WeakPolarHBondContact CB-NE2 3.43Å; E588-H590 PolarHBondContact O-CD2 2.77Å; E588-H590 IonicContact OE2-CE1 3.58Å; E588-H590 IonicContact OE2-NE2 3.84Å; E588-H590 PolarHBondContact OE2-NE2 3.47Å; E588-H590 VanDerWaalsContact OE2-NE2 3.07Å
589	L	95.1	Very high	90.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.5	168.1	170.7	68.3	0	0	0	108.4	I547 V548 W565 I573 I591 Y602	I547-L589 WeakPolarHBondContact CA-O 3.46Å; V548-L589 HydrophobicContact CB-CB 4.25Å; V548-L589 PolarHBondContact N-O 3.24Å; V548-L589 PolarHBondContact O-N 2.99Å; W565-L589 HydrophobicContact CD2-CB 3.68Å; W565-L589 HydrophobicContact CD2-CD2 4.39Å; W565-L589 HydrophobicContact CE3-CB 4.13Å; W565-L589 HydrophobicContact CE3-CD2 4.04Å; W565-L589 HydrophobicContact CG-CB 3.91Å; W565-L589 HydrophobicContact CZ2-CB 4.11Å; W565-L589 HydrophobicContact CZ3-CD2 4.33Å; I573-L589 HydrophobicContact CD1-CD1 3.62Å; I573-L589 HydrophobicContact CG2-CD1 4.25Å; L589-I591 HydrophobicContact CD1-CG1 4.38Å; L589-I591 HydrophobicContact CD2-CD1 4.27Å; L589-I591 HydrophobicContact CD2-CG1 4.49Å; L589-I591 HydrophobicContact CG-CD1 4.5Å; L589-I591 HydrophobicContact CG-CG1 4.19Å; L589-Y602 HydrophobicContact CD1-CD1 4.44Å; L589-Y602 HydrophobicContact CD2-CD1 3.32Å; L589-Y602 HydrophobicContact CD2-CD2 4.44Å; L589-Y602 HydrophobicContact CD2-CE1 3.87Å; L589-Y602 HydrophobicContact CD2-CG 3.63Å
590	H	94.6	Very high	91.8	Very high	13 Å²	13	36.8 Å²	36.8	6%	0.06	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.7	176.7	-69.8	-116.6	0	0	0	108.1	I547 S582 F583 E588	I547-H590 VanDerWaalsContact CD1-CE1 3.4Å; I547-H590 WeakPolarHBondContact CD1-CE1 3.42Å; S582-H590 CarbonylContact C-O 3.59Å; S582-H590 VanDerWaalsContact CA-O 3.3Å; S582-H590 WeakPolarHBondContact CA-O 3.35Å; F583-H590 HydrophobicContact CD2-CB 3.75Å; F583-H590 HydrophobicContact CE2-CB 3.4Å; F583-H590 AromaticContact CE2-CG 3.8Å; F583-H590 HydrophobicContact CG-CB 4.46Å; F583-H590 HydrophobicContact CZ-CB 3.88Å; F583-H590 PolarHBondContact N-O 3.09Å; F583-H590 PolarHBondContact O-N 3.3Å; E588-H590 WeakPolarHBondContact CB-NE2 3.43Å; E588-H590 PolarHBondContact O-CD2 2.77Å; E588-H590 IonicContact OE2-CE1 3.58Å; E588-H590 IonicContact OE2-NE2 3.84Å; E588-H590 PolarHBondContact OE2-NE2 3.47Å; E588-H590 VanDerWaalsContact OE2-NE2 3.07Å
591	I	94.7	Very high	92.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	115.4	172.8	-54.5	177.7	0	0	0	107.3	H545 I546 T581 L589 A594 D598 Y602 L616	H545-I591 WeakPolarHBondContact CA-O 3.34Å; I546-I591 HydrophobicContact CB-CB 4.25Å; I546-I591 PolarHBondContact N-O 3.47Å; I546-I591 PolarHBondContact O-N 3.48Å; T581-I591 WeakPolarHBondContact O-CA 3.18Å; L589-I591 HydrophobicContact CD1-CG1 4.38Å; L589-I591 HydrophobicContact CD2-CD1 4.27Å; L589-I591 HydrophobicContact CD2-CG1 4.49Å; L589-I591 HydrophobicContact CG-CD1 4.5Å; L589-I591 HydrophobicContact CG-CG1 4.19Å; I591-A594 HydrophobicContact CG2-CB 3.87Å; I591-D598 HydrophobicContact CD1-CB 4.49Å; I591-D598 HydrophobicContact CG2-CB 4.09Å; I591-Y602 HydrophobicContact CD1-CE1 4.32Å; I591-Y602 HydrophobicContact CD1-CE2 4.38Å; I591-L616 HydrophobicContact CD1-CD1 3.29Å
592	H	90	Very high	93.2	Very high	14 Å²	14	32.5 Å²	32.5	7%	0.065	17%	0.166	C	C	.	.	S	Bend	trans	-94	132.7	178.7	-69.8	-88.8	0	0	0	111	P519 I522 H527 H545 T581 F583 A594	P519-H592 PolarHBondContact O-CE1 2.95Å; I522-H592 VanDerWaalsContact CD1-ND1 3.33Å; I522-H592 WeakPolarHBondContact CD1-ND1 3.36Å; H527-H592 AromaticContact NE2-CE1 3.26Å; H527-H592 PolarHBondContact NE2-CE1 3.38Å; H527-H592 VanDerWaalsContact NE2-CE1 3.26Å; H527-H592 AromaticContact NE2-ND1 3.86Å; H545-H592 AromaticContact CE1-ND1 3.71Å; H545-H592 WeakPolarHBondContact ND1-CA 3.34Å; H545-H592 AromaticContact ND1-CG 3.8Å; H545-H592 AromaticContact ND1-ND1 3.23Å; H545-H592 PolarHBondContact ND1-ND1 3.02Å; T581-H592 PolarHBondContact O-N 2.89Å; F583-H592 AromaticContact CE1-CD2 3.1Å; F583-H592 WeakPolarHBondContact CE1-CD2 3.44Å; F583-H592 AromaticContact CE1-NE2 3.38Å; F583-H592 WeakPolarHBondContact CE1-NE2 3.3Å; F583-H592 AromaticContact CE2-NE2 3.92Å; F583-H592 AromaticContact CZ-CD2 3.29Å; F583-H592 WeakPolarHBondContact CZ-CD2 3.32Å; F583-H592 AromaticContact CZ-NE2 2.96Å; F583-H592 WeakPolarHBondContact CZ-NE2 3.12Å; H592-A594 PolarHBondContact O-N 3.29Å
593	A	88.5	Confident	93.4	Very high	32 Å²	32	32 Å²	32	26%	0.264	16%	0.161	S	C	.	.	S	Bend	trans	48.3	60	-179.6	0	0	0	0	0	112.2	L543 H545 R595	L543-A593 HydrophobicContact CD2-CB 4.24Å; H545-A593 PolarHBondContact ND1-N 2.83Å; A593-R595 WeakPolarHBondContact O-CG 3.32Å; A593-R595 PolarHBondContact O-N 3.08Å
594	A	91.4	Very high	93.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.			trans	-54.2	131.4	-169.3	0	0	0	0	0	112.9	F540 L542 L543 Q544 I546 I591 H592 D598	F540-A594 HydrophobicContact CD2-CB 3.51Å; F540-A594 HydrophobicContact CE2-CB 3.57Å; F540-A594 HydrophobicContact CG-CB 4.36Å; F540-A594 HydrophobicContact CZ-CB 4.45Å; L542-A594 CarbonylContact C-O 3.59Å; L542-A594 WeakPolarHBondContact CA-O 3.49Å; L543-A594 PolarHBondContact N-O 2.95Å; Q544-A594 WeakPolarHBondContact O-CB 3.4Å; Q544-A594 PolarHBondContact O-N 2.83Å; I546-A594 HydrophobicContact CD1-CB 3.59Å; I546-A594 HydrophobicContact CG1-CB 4.11Å; I591-A594 HydrophobicContact CG2-CB 3.87Å; H592-A594 PolarHBondContact O-N 3.29Å; A594-D598 WeakPolarHBondContact CA-OD2 3.17Å
595	R	94	Very high	93.7	Very high	91 Å²	91	33.9 Å²	33.9	34%	0.343	17%	0.168	S	C	.	.			trans	-108	173.3	-175.4	-53.8	178.9	-167.4	-178.9	2.1	110.9	F540 A593 E597 D598	F540-R595 WeakPolarHBondContact CE2-O 3.4Å; F540-R595 WeakPolarHBondContact CZ-O 3.19Å; A593-R595 WeakPolarHBondContact O-CG 3.32Å; A593-R595 PolarHBondContact O-N 3.08Å; R595-E597 HydrophobicContact CB-CG 3.95Å; R595-E597 WeakPolarHBondContact CD-OE1 3.04Å; R595-E597 IonicContact CZ-OE1 3.07Å; R595-E597 IonicContact NE-OE1 3.61Å; R595-E597 IonicContact NH1-OE1 3.68Å; R595-E597 PolarHBondContact NH1-OE1 2.84Å; R595-E597 PolarHBondContact O-N 3.25Å; R595-D598 PolarHBondContact N-OD2 3.44Å; R595-D598 WeakPolarHBondContact O-CB 3.45Å; R595-D598 PolarHBondContact O-N 3.06Å
596	R	92.8	Very high	93.9	Very high	194 Å²	194	34 Å²	34	73%	0.732	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-58.7	-36.9	173.1	-75.1	-169.2	179.1	174.3	0.6	112.1	L542 D598 A599 V618	L542-R596 HydrophobicContact CD2-CG 3.8Å; R596-D598 PolarHBondContact O-N 2.96Å; R596-A599 VanDerWaalsContact O-CB 3.25Å; R596-A599 WeakPolarHBondContact O-CB 3.26Å; R596-A599 PolarHBondContact O-N 3.33Å; R596-A599 VanDerWaalsContact O-N 3.15Å; R596-V618 HydrophobicContact CG-CG2 4.25Å
597	E	93.9	Very high	94.1	Very high	111 Å²	111	39.6 Å²	39.6	52%	0.519	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-61.5	-28	177.1	-10	166.6	-148	0	0	112.2	K567 R595 A599	K567-E597 PolarHBondContact NZ-O 3.05Å; R595-E597 HydrophobicContact CB-CG 3.95Å; R595-E597 WeakPolarHBondContact CD-OE1 3.04Å; R595-E597 IonicContact CZ-OE1 3.07Å; R595-E597 IonicContact NE-OE1 3.61Å; R595-E597 IonicContact NH1-OE1 3.68Å; R595-E597 PolarHBondContact NH1-OE1 2.84Å; R595-E597 PolarHBondContact O-N 3.25Å; E597-A599 PolarHBondContact O-N 2.62Å
598	D	95.1	Very high	94.1	Very high	11 Å²	11	42.1 Å²	42.1	6%	0.059	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-76.4	-11	179.8	-64.5	-50.5	0	0	0	112.5	F540 I591 A594 R595 R596 Y602	F540-D598 HydrophobicContact CZ-CB 4.44Å; I591-D598 HydrophobicContact CD1-CB 4.49Å; I591-D598 HydrophobicContact CG2-CB 4.09Å; A594-D598 WeakPolarHBondContact CA-OD2 3.17Å; R595-D598 PolarHBondContact N-OD2 3.44Å; R595-D598 WeakPolarHBondContact O-CB 3.45Å; R595-D598 PolarHBondContact O-N 3.06Å; R596-D598 PolarHBondContact O-N 2.96Å; D598-Y602 WeakPolarHBondContact O-CE2 3.45Å; D598-Y602 PolarHBondContact O-OH 3.2Å
599	A	95.3	Very high	94.1	Very high	31 Å²	31	49.4 Å²	49.4	26%	0.256	25%	0.248	S	C	.	.			trans	-63.3	143.6	172.7	0	0	0	0	0	111.3	F540 K567 R596 E597 L616 V618	F540-A599 HydrophobicContact CE1-CB 4.3Å; F540-A599 HydrophobicContact CZ-CB 4.24Å; K567-A599 WeakPolarHBondContact CE-O 3.34Å; K567-A599 PolarHBondContact NZ-O 3.42Å; R596-A599 VanDerWaalsContact O-CB 3.25Å; R596-A599 WeakPolarHBondContact O-CB 3.26Å; R596-A599 PolarHBondContact O-N 3.33Å; R596-A599 VanDerWaalsContact O-N 3.15Å; E597-A599 PolarHBondContact O-N 2.62Å; A599-L616 WeakPolarHBondContact CA-O 3.16Å; A599-V618 HydrophobicContact CB-CG2 4.07Å
600	G	96.3	Very high	94	Very high	25 Å²	25	54.7 Å²	54.7	26%	0.258	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	142.4	-176.3	-178.5	0	0	0	0	0	112.9	L616	G600-L616 PolarHBondContact N-O 3.17Å; G600-L616 PolarHBondContact O-N 3.49Å
601	T	97	Very high	93.9	Very high	22 Å²	22	57.9 Å²	57.9	14%	0.135	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	130.7	178.1	-43.2	0	0	0	0	110	E568 S613 V614	E568-T601 WeakPolarHBondContact CB-O 3.36Å; E568-T601 PolarHBondContact N-O 2.92Å; E568-T601 WeakPolarHBondContact OE2-CB 3.48Å; E568-T601 PolarHBondContact OE2-OG1 3.22Å; T601-S613 WeakPolarHBondContact CG2-OG 3.08Å; T601-V614 CarbonylContact C-O 3.56Å; T601-V614 WeakPolarHBondContact CA-O 3.38Å
602	Y	97.7	Very high	93.8	Very high	3 Å²	3	58.3 Å²	58.3	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.4	175.6	-69.1	-98.7	0	0	0	109.3	Q566 K567 I573 L589 I591 D598 S613 V614 L616	Q566-Y602 WeakPolarHBondContact O-CA 3.22Å; K567-Y602 HydrophobicContact CB-CD1 4.1Å; K567-Y602 HydrophobicContact CB-CE1 3.92Å; K567-Y602 HydrophobicContact CD-CE1 4.15Å; K567-Y602 HydrophobicContact CD-CE2 4.46Å; K567-Y602 HydrophobicContact CG-CD1 4.26Å; K567-Y602 HydrophobicContact CG-CE1 3.92Å; K567-Y602 HydrophobicContact CG-CE2 4.28Å; I573-Y602 HydrophobicContact CD1-CD1 3.66Å; I573-Y602 HydrophobicContact CD1-CE1 3.63Å; L589-Y602 HydrophobicContact CD1-CD1 4.44Å; L589-Y602 HydrophobicContact CD2-CD1 3.32Å; L589-Y602 HydrophobicContact CD2-CD2 4.44Å; L589-Y602 HydrophobicContact CD2-CE1 3.87Å; L589-Y602 HydrophobicContact CD2-CG 3.63Å; I591-Y602 HydrophobicContact CD1-CE1 4.32Å; I591-Y602 HydrophobicContact CD1-CE2 4.38Å; D598-Y602 WeakPolarHBondContact O-CE2 3.45Å; D598-Y602 PolarHBondContact O-OH 3.2Å; Y602-S613 CarbonylContact O-C 3.57Å; Y602-S613 WeakPolarHBondContact O-CA 3.42Å; Y602-V614 PolarHBondContact N-O 3.18Å; Y602-V614 PolarHBondContact O-N 2.88Å; Y602-L616 HydrophobicContact CD2-CB 4.41Å; Y602-L616 HydrophobicContact CD2-CD1 3.71Å; Y602-L616 HydrophobicContact CD2-CG 3.74Å; Y602-L616 HydrophobicContact CE2-CB 4.17Å; Y602-L616 HydrophobicContact CE2-CD1 3.4Å; Y602-L616 VanDerWaalsContact CE2-CD1 3.4Å; Y602-L616 HydrophobicContact CE2-CG 3.79Å
603	I	96.8	Very high	94.1	Very high	17 Å²	17	58.5 Å²	58.5	9%	0.087	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.4	-176.8	-57.6	169	0	0	0	107.8	W565 Q566 K605 Q610 K612	W565-I603 WeakPolarHBondContact CA-O 3.14Å; Q566-I603 HydrophobicContact CG-CB 3.91Å; Q566-I603 PolarHBondContact N-O 3.1Å; Q566-I603 PolarHBondContact O-N 3.03Å; I603-K605 HydrophobicContact CG2-CG 4.27Å; I603-Q610 HydrophobicContact CG2-CB 4.17Å; I603-Q610 VanDerWaalsContact CG2-CD 3.47Å; I603-Q610 HydrophobicContact CG2-CG 3.56Å; I603-K612 WeakPolarHBondContact CA-O 3.24Å
604	C	96.4	Very high	94.5	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.2	166.7	-176.8	0	0	0	0	110.7	C550 W565 V611 K612	C550-C604 HydrophobicContact CB-CB 3.76Å; C550-C604 WeakPolarHBondContact CB-SG 3.49Å; C550-C604 WeakPolarHBondContact SG-CB 3.47Å; C550-C604 CovalentContact SG-SG 1.99Å; C550-C604 PolarHBondContact SG-SG 3.2Å; W565-C604 HydrophobicContact CD2-CB 3.87Å; W565-C604 HydrophobicContact CE3-CB 3.84Å; W565-C604 HydrophobicContact CH2-CB 3.77Å; W565-C604 HydrophobicContact CZ2-CB 3.81Å; W565-C604 HydrophobicContact CZ3-CB 3.79Å; C604-V611 PolarHBondContact O-N 3.25Å; C604-K612 HydrophobicContact CB-CB 3.98Å; C604-K612 PolarHBondContact N-O 2.76Å; C604-K612 PolarHBondContact O-N 3.18Å
605	K	95	Very high	94.7	Very high	56 Å²	56	64.5 Å²	64.5	24%	0.243	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.3	172.8	-65	172.9	174.1	173.6	0	110.3	I563 T564 Q566 I603 K609 Q610	I563-K605 WeakPolarHBondContact CA-O 3.33Å; T564-K605 PolarHBondContact N-O 2.9Å; T564-K605 PolarHBondContact O-N 2.95Å; T564-K605 PolarHBondContact OG1-O 2.94Å; Q566-K605 VanDerWaalsContact CD-NZ 3.34Å; Q566-K605 VanDerWaalsContact NE2-CE 3.34Å; Q566-K605 VanDerWaalsContact NE2-NZ 3.19Å; I603-K605 HydrophobicContact CG2-CG 4.27Å; K605-K609 CarbonylContact C-O 3.58Å; K605-K609 WeakPolarHBondContact CA-O 3.41Å; K605-Q610 HydrophobicContact CG-CB 4.41Å
606	I	94.1	Very high	94.8	Very high	30 Å²	30	60.3 Å²	60.3	15%	0.154	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120	173.4	-52.9	-176.4	0	0	0	107	P558 I563 G608 K609 V611	P558-I606 HydrophobicContact CB-CG2 3.9Å; P558-I606 HydrophobicContact CG-CD1 3.95Å; P558-I606 HydrophobicContact CG-CG2 3.92Å; I563-I606 HydrophobicContact CG1-CG1 4.31Å; I606-G608 PolarHBondContact O-N 3.08Å; I606-K609 PolarHBondContact N-O 3.14Å; I606-K609 PolarHBondContact O-N 3.4Å; I606-K609 VanDerWaalsContact O-N 3.14Å; I606-V611 HydrophobicContact CB-CG2 3.73Å; I606-V611 HydrophobicContact CD1-CB 4.14Å; I606-V611 HydrophobicContact CD1-CG1 4.13Å; I606-V611 HydrophobicContact CD1-CG2 3.81Å; I606-V611 HydrophobicContact CG1-CB 4.16Å; I606-V611 HydrophobicContact CG1-CG2 3.59Å
607	K	92.5	Very high	95	Very high	166 Å²	166	52.4 Å²	52.4	72%	0.722	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	41.9	-172.5	-60	-179.3	177.4	-176.1	0	112.3	S562 K609	S562-K607 PolarHBondContact O-N 3.14Å; K607-K609 PolarHBondContact O-N 3.49Å; K607-K609 VanDerWaalsContact O-N 3.14Å
608	G	91.7	Very high	95	Very high	56 Å²	56	49.2 Å²	49.2	58%	0.577	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-15.8	179.7	0	0	0	0	0	116	I606	I606-G608 PolarHBondContact O-N 3.08Å
609	K	93.3	Very high	94.7	Very high	165 Å²	165	50.6 Å²	50.6	72%	0.717	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	132.1	176.2	-65.9	-173	179.9	-175.7	0	110.5	K605 I606 K607 V611	K605-K609 CarbonylContact C-O 3.58Å; K605-K609 WeakPolarHBondContact CA-O 3.41Å; I606-K609 PolarHBondContact N-O 3.14Å; I606-K609 PolarHBondContact O-N 3.4Å; I606-K609 VanDerWaalsContact O-N 3.14Å; K607-K609 PolarHBondContact O-N 3.49Å; K607-K609 VanDerWaalsContact O-N 3.14Å; K609-V611 WeakPolarHBondContact O-CG2 3.49Å; K609-V611 PolarHBondContact O-N 3.46Å
610	Q	93.6	Very high	93.6	Very high	112 Å²	112	54 Å²	54	52%	0.523	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	124.9	174.4	173.1	169	-2.1	0	0	110.1	I603 K605	I603-Q610 HydrophobicContact CG2-CB 4.17Å; I603-Q610 VanDerWaalsContact CG2-CD 3.47Å; I603-Q610 HydrophobicContact CG2-CG 3.56Å; K605-Q610 HydrophobicContact CG-CB 4.41Å
611	V	91.9	Very high	91.9	Very high	80 Å²	80	55.1 Å²	55.1	49%	0.485	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-33	-179.5	-176.9	0	0	0	0	111.4	C604 I606 K609	C604-V611 PolarHBondContact O-N 3.25Å; I606-V611 HydrophobicContact CB-CG2 3.73Å; I606-V611 HydrophobicContact CD1-CB 4.14Å; I606-V611 HydrophobicContact CD1-CG1 4.13Å; I606-V611 HydrophobicContact CD1-CG2 3.81Å; I606-V611 HydrophobicContact CG1-CB 4.16Å; I606-V611 HydrophobicContact CG1-CG2 3.59Å; K609-V611 WeakPolarHBondContact O-CG2 3.49Å; K609-V611 PolarHBondContact O-N 3.46Å
612	K	93.6	Very high	90.1	Very high	8 Å²	8	61.8 Å²	61.8	4%	0.035	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	140.6	-172.3	-148.9	-178.9	-152.9	-173.6	0	111.2	R532 G534 F536 S549 I603 C604 V614	R532-K612 WeakPolarHBondContact O-CE 3.32Å; R532-K612 PolarHBondContact O-NZ 3.36Å; G534-K612 WeakPolarHBondContact O-CG 3.41Å; F536-K612 HydrophobicContact CE1-CD 4.08Å; F536-K612 VanDerWaalsContact CE1-CE 3.47Å; S549-K612 PolarHBondContact O-NZ 3.26Å; I603-K612 WeakPolarHBondContact CA-O 3.24Å; C604-K612 HydrophobicContact CB-CB 3.98Å; C604-K612 PolarHBondContact N-O 2.76Å; C604-K612 PolarHBondContact O-N 3.18Å; K612-V614 HydrophobicContact CD-CG2 4.33Å; K612-V614 HydrophobicContact CG-CG2 4.36Å
613	S	95.4	Very high	88.1	Confident	19 Å²	19	70.8 Å²	70.8	13%	0.133	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.6	169.8	-169.2	0	0	0	0	110.1	N535 F536 T601 Y602	N535-S613 WeakPolarHBondContact CA-O 3.44Å; N535-S613 WeakPolarHBondContact OD1-CB 3.37Å; N535-S613 PolarHBondContact OD1-N 3.33Å; F536-S613 PolarHBondContact N-O 3Å; T601-S613 WeakPolarHBondContact CG2-OG 3.08Å; Y602-S613 CarbonylContact O-C 3.57Å; Y602-S613 WeakPolarHBondContact O-CA 3.42Å
614	V	96.5	Very high	86.4	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	117.1	-177	-177.3	0	0	0	0	109	F536 V538 V548 W565 T601 Y602 K612 L616	F536-V614 HydrophobicContact CD1-CG2 3.92Å; F536-V614 HydrophobicContact CD2-CG1 4.11Å; F536-V614 HydrophobicContact CE1-CB 4.41Å; F536-V614 HydrophobicContact CE1-CG1 4.32Å; F536-V614 HydrophobicContact CE1-CG2 3.32Å; F536-V614 HydrophobicContact CE2-CG1 3.69Å; F536-V614 HydrophobicContact CE2-CG2 4.22Å; F536-V614 HydrophobicContact CZ-CB 4.33Å; F536-V614 HydrophobicContact CZ-CG1 3.83Å; F536-V614 HydrophobicContact CZ-CG2 3.53Å; F536-V614 WeakPolarHBondContact O-CA 3.33Å; V538-V614 HydrophobicContact CG2-CG1 3.8Å; V548-V614 HydrophobicContact CG1-CB 4.17Å; V548-V614 HydrophobicContact CG1-CG1 4.02Å; V548-V614 HydrophobicContact CG1-CG2 3.68Å; V548-V614 HydrophobicContact CG2-CG1 4.47Å; W565-V614 HydrophobicContact CH2-CG2 4.17Å; W565-V614 HydrophobicContact CZ3-CG2 4.34Å; T601-V614 CarbonylContact C-O 3.56Å; T601-V614 WeakPolarHBondContact CA-O 3.38Å; Y602-V614 PolarHBondContact N-O 3.18Å; Y602-V614 PolarHBondContact O-N 2.88Å; K612-V614 HydrophobicContact CD-CG2 4.33Å; K612-V614 HydrophobicContact CG-CG2 4.36Å; V614-L616 HydrophobicContact CG1-CD2 3.87Å
615	R	96.6	Very high	84.8	Confident	158 Å²	158	78.9 Å²	78.9	60%	0.596	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	112.1	177.1	-173.5	175.6	179.5	148.2	-1.2	109.4	F536 H537 V538	F536-R615 PolarHBondContact O-N 3.22Å; H537-R615 CarbonylContact C-O 3.46Å; H537-R615 WeakPolarHBondContact CA-O 3.26Å; H537-R615 PolarHBondContact CD2-O 2.89Å; V538-R615 PolarHBondContact N-O 3.22Å
616	L	96.5	Very high	83.4	Confident	3 Å²	3	80.2 Å²	80.2	2%	0.016	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	127.3	173.1	-56.2	-172.6	0	0	0	109.4	V538 F540 I546 V548 I591 A599 G600 Y602 V614	V538-L616 HydrophobicContact CB-CD2 3.57Å; V538-L616 HydrophobicContact CG1-CD2 4.08Å; V538-L616 HydrophobicContact CG2-CD2 3.87Å; V538-L616 CarbonylContact O-C 3.54Å; V538-L616 WeakPolarHBondContact O-CA 3.41Å; F540-L616 HydrophobicContact CD1-CB 3.98Å; F540-L616 HydrophobicContact CE1-CB 3.77Å; I546-L616 HydrophobicContact CD1-CD1 4.33Å; V548-L616 HydrophobicContact CG2-CD2 4.49Å; I591-L616 HydrophobicContact CD1-CD1 3.29Å; A599-L616 WeakPolarHBondContact CA-O 3.16Å; G600-L616 PolarHBondContact N-O 3.17Å; G600-L616 PolarHBondContact O-N 3.49Å; Y602-L616 HydrophobicContact CD2-CB 4.41Å; Y602-L616 HydrophobicContact CD2-CD1 3.71Å; Y602-L616 HydrophobicContact CD2-CG 3.74Å; Y602-L616 HydrophobicContact CE2-CB 4.17Å; Y602-L616 HydrophobicContact CE2-CD1 3.4Å; Y602-L616 VanDerWaalsContact CE2-CD1 3.4Å; Y602-L616 HydrophobicContact CE2-CG 3.79Å; V614-L616 HydrophobicContact CG1-CD2 3.87Å
617	S	95.7	Very high	82.2	Confident	28 Å²	28	85.2 Å²	85.2	20%	0.196	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.5	173.5	61.1	0	0	0	0	110.6	H537 V538 E539 F540 S619	H537-S617 PolarHBondContact CE1-OG 2.81Å; H537-S617 WeakPolarHBondContact NE2-CB 3.37Å; H537-S617 PolarHBondContact NE2-OG 3.35Å; V538-S617 PolarHBondContact O-N 3.16Å; V538-S617 PolarHBondContact O-OG 2.86Å; E539-S617 CarbonylContact C-O 3.58Å; E539-S617 VanDerWaalsContact CA-O 3.31Å; E539-S617 WeakPolarHBondContact CA-O 3.25Å; E539-S617 WeakPolarHBondContact CG-OG 3.29Å; F540-S617 WeakPolarHBondContact CD1-O 3.47Å; F540-S617 VanDerWaalsContact CE1-C 3.48Å; F540-S617 WeakPolarHBondContact CE1-O 2.89Å; F540-S617 PolarHBondContact N-O 3.26Å; S617-S619 PolarHBondContact O-N 3Å
618	V	94.1	Very high	81.2	Confident	43 Å²	43	84.6 Å²	84.6	26%	0.261	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	125.9	173.6	-175.4	0	0	0	0	107.4	F540 L542 R596 A599 S620	F540-V618 HydrophobicContact CE1-CG2 4.26Å; F540-V618 HydrophobicContact CE2-CG2 3.99Å; F540-V618 HydrophobicContact CZ-CG2 3.63Å; L542-V618 HydrophobicContact CD2-CG1 4.04Å; L542-V618 HydrophobicContact CD2-CG2 4.47Å; L542-V618 HydrophobicContact CG-CG1 4.2Å; R596-V618 HydrophobicContact CG-CG2 4.25Å; A599-V618 HydrophobicContact CB-CG2 4.07Å; V618-S620 VanDerWaalsContact C-N 3.34Å; V618-S620 PolarHBondContact O-N 3.07Å
619	S	89.4	Confident	80.2	Confident	40 Å²	40	88.7 Å²	88.7	28%	0.28	44%	0.439	S	S	.	.			trans	-57.2	100.2	165.4	172.4	0	0	0	0	107.3	F540 S617 G621	F540-S619 WeakPolarHBondContact O-CB 3.31Å; F540-S619 PolarHBondContact O-N 2.96Å; S617-S619 PolarHBondContact O-N 3Å; S619-G621 PolarHBondContact O-N 3.32Å
620	S	71.5	Confident	79.2	Confident	103 Å²	103	88.2 Å²	88.2	72%	0.72	43%	0.434	S	S	*	.			trans	-63.7	119.4	167.9	59.2	0	0	0	0	105.7	V618 K622	V618-S620 VanDerWaalsContact C-N 3.34Å; V618-S620 PolarHBondContact O-N 3.07Å; S620-K622 VanDerWaalsContact C-N 3.29Å; S620-K622 PolarHBondContact O-N 3.05Å
621	G	60.5	Low	78.3	Confident	49 Å²	49	88 Å²	88	51%	0.505	43%	0.432	S	S	.	.			trans	-60.5	90.9	-174.2	0	0	0	0	0	111.1	S619 W623 I624	S619-G621 PolarHBondContact O-N 3.32Å; G621-W623 PolarHBondContact O-N 3Å; G621-W623 VanDerWaalsContact O-N 3.08Å; G621-I624 PolarHBondContact O-N 3.24Å
622	K	59	Low	77.5	Confident	161 Å²	161	87.7 Å²	87.7	70%	0.7	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-19.5	166.1	-111.2	-178.8	175	179.5	0	111.9	S620 I624 S625 D626	S620-K622 VanDerWaalsContact C-N 3.29Å; S620-K622 PolarHBondContact O-N 3.05Å; K622-I624 VanDerWaalsContact C-N 3.27Å; K622-I624 PolarHBondContact O-N 3.07Å; K622-S625 WeakPolarHBondContact O-CB 3.07Å; K622-S625 PolarHBondContact O-N 3.16Å; K622-D626 PolarHBondContact O-N 3.43Å
623	W	56.4	Low	76.8	Confident	192 Å²	192	92.3 Å²	92.3	73%	0.727	46%	0.456	S	S	*	.	H	α-helix	trans	-55.2	-33.9	178.5	-82.1	73.2	0	0	0	114.8	G621 F627	G621-W623 PolarHBondContact O-N 3Å; G621-W623 VanDerWaalsContact O-N 3.08Å; W623-F627 WeakPolarHBondContact O-CB 3.23Å; W623-F627 PolarHBondContact O-N 3.07Å
624	I	59.8	Low	76	Confident	118 Å²	118	95.6 Å²	95.6	61%	0.605	47%	0.471	S	S	*	.	H	α-helix	trans	-70.4	-39.3	178.1	-67.5	172.9	0	0	0	110	G621 K622 D626 W628	G621-I624 PolarHBondContact O-N 3.24Å; K622-I624 VanDerWaalsContact C-N 3.27Å; K622-I624 PolarHBondContact O-N 3.07Å; I624-D626 PolarHBondContact O-N 3.07Å; I624-W628 VanDerWaalsContact CG2-CD1 3.49Å; I624-W628 WeakPolarHBondContact O-CB 2.94Å; I624-W628 PolarHBondContact O-N 2.95Å
625	S	62.9	Low	75.2	Confident	69 Å²	69	97.9 Å²	97.9	48%	0.483	49%	0.485	S	S	.	.	H	α-helix	trans	-58.9	-50.4	175.3	160.9	0	0	0	0	110.8	K622 W628 F629	K622-S625 WeakPolarHBondContact O-CB 3.07Å; K622-S625 PolarHBondContact O-N 3.16Å; S625-W628 PolarHBondContact O-N 3.4Å; S625-F629 WeakPolarHBondContact O-CB 3.18Å; S625-F629 PolarHBondContact O-N 3.46Å
626	D	66.7	Low	74.4	Confident	84 Å²	84	93.7 Å²	93.7	45%	0.449	48%	0.478	S	S	.	.	H	α-helix	trans	-69.2	-40	-174.9	-60.1	-16.4	0	0	0	111.5	K622 I624 F629 Y630	K622-D626 PolarHBondContact O-N 3.43Å; I624-D626 PolarHBondContact O-N 3.07Å; D626-F629 WeakPolarHBondContact O-CB 3.43Å; D626-F629 PolarHBondContact O-N 3Å; D626-Y630 WeakPolarHBondContact O-CD2 3.46Å; D626-Y630 PolarHBondContact O-N 2.78Å
627	F	68.3	Low	73.9	Confident	135 Å²	135	95 Å²	95	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-63.2	-43.8	175.6	-175.7	-94.3	0	0	0	112.2	W623 F629 Y630 F631	W623-F627 WeakPolarHBondContact O-CB 3.23Å; W623-F627 PolarHBondContact O-N 3.07Å; F627-F629 VanDerWaalsContact C-N 3.32Å; F627-Y630 PolarHBondContact O-N 3.17Å; F627-F631 HydrophobicContact CE1-CD2 4.4Å; F627-F631 HydrophobicContact CZ-CD2 4.4Å; F627-F631 WeakPolarHBondContact O-CB 3.42Å; F627-F631 PolarHBondContact O-N 3.15Å
628	W	72.6	Confident	73.3	Confident	154 Å²	154	96.8 Å²	96.8	58%	0.583	50%	0.503	S	S	*	.	H	α-helix	trans	-66.3	-35.7	174.4	-83.7	98.4	0	0	0	111.8	I624 S625 F631 C632	I624-W628 VanDerWaalsContact CG2-CD1 3.49Å; I624-W628 WeakPolarHBondContact O-CB 2.94Å; I624-W628 PolarHBondContact O-N 2.95Å; S625-W628 PolarHBondContact O-N 3.4Å; W628-F631 PolarHBondContact O-N 2.87Å; W628-C632 WeakPolarHBondContact O-CB 3.39Å; W628-C632 PolarHBondContact O-N 3.29Å; W628-C632 PolarHBondContact O-SG 2.75Å
629	F	70	Confident	72.8	Confident	141 Å²	141	100.1 Å²	100.1	62%	0.618	52%	0.518	S	S	*	.	H	α-helix	trans	-61.5	-45.8	174.4	-137.8	-95.7	0	0	0	111.2	S625 D626 F627 I633	S625-F629 WeakPolarHBondContact O-CB 3.18Å; S625-F629 PolarHBondContact O-N 3.46Å; D626-F629 WeakPolarHBondContact O-CB 3.43Å; D626-F629 PolarHBondContact O-N 3Å; F627-F629 VanDerWaalsContact C-N 3.32Å; F629-I633 HydrophobicContact CD1-CD1 3.4Å; F629-I633 HydrophobicContact CD1-CG1 4.48Å; F629-I633 HydrophobicContact CE1-CD1 3.34Å; F629-I633 HydrophobicContact CG-CD1 4.36Å; F629-I633 HydrophobicContact CZ-CD1 4.27Å; F629-I633 WeakPolarHBondContact O-CB 3.35Å; F629-I633 VanDerWaalsContact O-CG1 3.27Å; F629-I633 WeakPolarHBondContact O-CG1 3.48Å; F629-I633 PolarHBondContact O-N 3.36Å; F629-I633 VanDerWaalsContact O-N 3.09Å
630	Y	73.1	Confident	72.5	Confident	156 Å²	156	103.8 Å²	103.8	61%	0.612	53%	0.534	S	S	*	.	H	α-helix	trans	-66	-43.1	175.5	-81.8	-65.7	0	0	0	112.5	D626 F627 I633 I634	D626-Y630 WeakPolarHBondContact O-CD2 3.46Å; D626-Y630 PolarHBondContact O-N 2.78Å; F627-Y630 PolarHBondContact O-N 3.17Å; Y630-I633 PolarHBondContact O-N 3.21Å; Y630-I634 HydrophobicContact CD1-CD1 3.55Å; Y630-I634 HydrophobicContact CD1-CG1 4.26Å; Y630-I634 HydrophobicContact CE1-CD1 4.3Å; Y630-I634 HydrophobicContact CG-CD1 4.43Å; Y630-I634 WeakPolarHBondContact O-CB 3.27Å; Y630-I634 WeakPolarHBondContact O-CG1 3.44Å; Y630-I634 PolarHBondContact O-N 3.01Å
631	F	73.6	Confident	73.1	Confident	108 Å²	108	103.7 Å²	103.7	47%	0.474	53%	0.525	S	S	.	.	H	α-helix	trans	-66.6	-42.3	179.8	-160.2	-90.4	0	0	0	111.7	F627 W628 I633 V635	F627-F631 HydrophobicContact CE1-CD2 4.4Å; F627-F631 HydrophobicContact CZ-CD2 4.4Å; F627-F631 WeakPolarHBondContact O-CB 3.42Å; F627-F631 PolarHBondContact O-N 3.15Å; W628-F631 PolarHBondContact O-N 2.87Å; F631-I633 VanDerWaalsContact C-N 3.33Å; F631-I633 PolarHBondContact O-N 2.87Å; F631-V635 HydrophobicContact CD1-CG2 4.16Å; F631-V635 HydrophobicContact CD2-CG2 3.87Å; F631-V635 HydrophobicContact CE1-CG2 4.14Å; F631-V635 HydrophobicContact CE2-CG2 3.85Å; F631-V635 HydrophobicContact CG-CG2 4.03Å; F631-V635 HydrophobicContact CZ-CG2 3.99Å; F631-V635 VanDerWaalsContact O-CB 3.27Å; F631-V635 WeakPolarHBondContact O-CB 3.17Å; F631-V635 WeakPolarHBondContact O-CG2 3.23Å; F631-V635 PolarHBondContact O-N 3.5Å
632	C	75.1	Confident	74.2	Confident	73 Å²	73	105.8 Å²	105.8	49%	0.493	52%	0.524	S	S	.	.	H	α-helix	trans	-72.9	-20.4	179.1	-70.5	0	0	0	0	114	W628 P636	W628-C632 WeakPolarHBondContact O-CB 3.39Å; W628-C632 PolarHBondContact O-N 3.29Å; W628-C632 PolarHBondContact O-SG 2.75Å; C632-P636 VanDerWaalsContact O-CD 3.24Å; C632-P636 WeakPolarHBondContact O-CD 3.35Å; C632-P636 WeakPolarHBondContact O-CG 3.4Å
633	I	78	Confident	75.3	Confident	104 Å²	104	99.9 Å²	99.9	53%	0.533	51%	0.509	S	S	.	.	H	α-helix	trans	-99.3	-47	178.4	-65.1	176.9	0	0	0	111.3	F629 Y630 F631 G637	F629-I633 HydrophobicContact CD1-CD1 3.4Å; F629-I633 HydrophobicContact CD1-CG1 4.48Å; F629-I633 HydrophobicContact CE1-CD1 3.34Å; F629-I633 HydrophobicContact CG-CD1 4.36Å; F629-I633 HydrophobicContact CZ-CD1 4.27Å; F629-I633 WeakPolarHBondContact O-CB 3.35Å; F629-I633 VanDerWaalsContact O-CG1 3.27Å; F629-I633 WeakPolarHBondContact O-CG1 3.48Å; F629-I633 PolarHBondContact O-N 3.36Å; F629-I633 VanDerWaalsContact O-N 3.09Å; Y630-I633 PolarHBondContact O-N 3.21Å; F631-I633 VanDerWaalsContact C-N 3.33Å; F631-I633 PolarHBondContact O-N 2.87Å; I633-G637 PolarHBondContact O-N 2.86Å
634	I	78.6	Confident	76.4	Confident	88 Å²	88	95.1 Å²	95.1	45%	0.451	50%	0.497	S	S	.	.	H	α-helix	trans	-74.7	-41.8	-173.8	-62.4	-177.6	0	0	0	111.4	Y630 G637 T638	Y630-I634 HydrophobicContact CD1-CD1 3.55Å; Y630-I634 HydrophobicContact CD1-CG1 4.26Å; Y630-I634 HydrophobicContact CE1-CD1 4.3Å; Y630-I634 HydrophobicContact CG-CD1 4.43Å; Y630-I634 WeakPolarHBondContact O-CB 3.27Å; Y630-I634 WeakPolarHBondContact O-CG1 3.44Å; Y630-I634 PolarHBondContact O-N 3.01Å; I634-G637 PolarHBondContact O-N 3.38Å; I634-T638 HydrophobicContact CG2-CG2 4.05Å; I634-T638 WeakPolarHBondContact O-CB 3.43Å; I634-T638 WeakPolarHBondContact O-CG2 3.3Å; I634-T638 PolarHBondContact O-N 2.99Å; I634-T638 PolarHBondContact O-OG1 2.98Å
635	V	79.9	Confident	77.2	Confident	49 Å²	49	94.6 Å²	94.6	30%	0.297	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-45.3	-175.6	-179.2	0	0	0	0	111.7	F631 T638 L639	F631-V635 HydrophobicContact CD1-CG2 4.16Å; F631-V635 HydrophobicContact CD2-CG2 3.87Å; F631-V635 HydrophobicContact CE1-CG2 4.14Å; F631-V635 HydrophobicContact CE2-CG2 3.85Å; F631-V635 HydrophobicContact CG-CG2 4.03Å; F631-V635 HydrophobicContact CZ-CG2 3.99Å; F631-V635 VanDerWaalsContact O-CB 3.27Å; F631-V635 WeakPolarHBondContact O-CB 3.17Å; F631-V635 WeakPolarHBondContact O-CG2 3.23Å; F631-V635 PolarHBondContact O-N 3.5Å; V635-T638 WeakPolarHBondContact CA-OG1 2.99Å; V635-T638 PolarHBondContact O-OG1 2.84Å; V635-T638 VanDerWaalsContact O-OG1 3.09Å; V635-L639 HydrophobicContact CG1-CD1 4.04Å; V635-L639 WeakPolarHBondContact O-CB 3.17Å; V635-L639 VanDerWaalsContact O-CG 3.32Å; V635-L639 WeakPolarHBondContact O-CG 2.95Å; V635-L639 PolarHBondContact O-N 2.63Å
636	P	81.4	Confident	78.1	Confident	69 Å²	69	95.7 Å²	95.7	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-66.9	-37.3	173.5	-22.8	37	0	0	0	112.4	C632 L639 L640	C632-P636 VanDerWaalsContact O-CD 3.24Å; C632-P636 WeakPolarHBondContact O-CD 3.35Å; C632-P636 WeakPolarHBondContact O-CG 3.4Å; P636-L639 PolarHBondContact O-N 3.18Å; P636-L640 VanDerWaalsContact O-CB 3.28Å; P636-L640 WeakPolarHBondContact O-CB 3.42Å; P636-L640 PolarHBondContact O-N 2.86Å
637	G	84.2	Confident	78.6	Confident	32 Å²	32	99.7 Å²	99.7	33%	0.33	50%	0.503	S	S	.	.	H	α-helix	trans	-62.3	-45.5	177.3	0	0	0	0	0	112.7	I633 I634 L640 I641	I633-G637 PolarHBondContact O-N 2.86Å; I634-G637 PolarHBondContact O-N 3.38Å; G637-L640 PolarHBondContact O-N 3.23Å; G637-I641 VanDerWaalsContact O-CG1 3.28Å; G637-I641 WeakPolarHBondContact O-CG1 3.39Å; G637-I641 PolarHBondContact O-N 2.92Å
638	T	83.8	Confident	78.8	Confident	64 Å²	64	96.2 Å²	96.2	39%	0.393	50%	0.495	S	S	.	.	H	α-helix	trans	-69	-39.1	177.7	43.9	0	0	0	0	112.4	I634 V635 L640 I641 L642	I634-T638 HydrophobicContact CG2-CG2 4.05Å; I634-T638 WeakPolarHBondContact O-CB 3.43Å; I634-T638 WeakPolarHBondContact O-CG2 3.3Å; I634-T638 PolarHBondContact O-N 2.99Å; I634-T638 PolarHBondContact O-OG1 2.98Å; V635-T638 WeakPolarHBondContact CA-OG1 2.99Å; V635-T638 PolarHBondContact O-OG1 2.84Å; V635-T638 VanDerWaalsContact O-OG1 3.09Å; T638-L640 VanDerWaalsContact C-N 3.32Å; T638-L640 PolarHBondContact O-N 3.05Å; T638-I641 PolarHBondContact O-N 3.31Å; T638-L642 WeakPolarHBondContact O-CB 3.21Å; T638-L642 PolarHBondContact O-N 3.09Å
639	L	83.4	Confident	78.8	Confident	113 Å²	113	96.8 Å²	96.8	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-63.6	-37.1	173	-75.9	171.3	0	0	0	112.3	V635 P636 G643	V635-L639 HydrophobicContact CG1-CD1 4.04Å; V635-L639 WeakPolarHBondContact O-CB 3.17Å; V635-L639 VanDerWaalsContact O-CG 3.32Å; V635-L639 WeakPolarHBondContact O-CG 2.95Å; V635-L639 PolarHBondContact O-N 2.63Å; P636-L639 PolarHBondContact O-N 3.18Å; L639-G643 PolarHBondContact O-N 2.91Å
640	L	84	Confident	79.2	Confident	118 Å²	118	96 Å²	96	62%	0.618	51%	0.505	S	S	*	.	H	α-helix	trans	-68.2	-41.1	176.9	-161.5	150.1	0	0	0	111.3	P636 G637 T638 G643 L644	P636-L640 VanDerWaalsContact O-CB 3.28Å; P636-L640 WeakPolarHBondContact O-CB 3.42Å; P636-L640 PolarHBondContact O-N 2.86Å; G637-L640 PolarHBondContact O-N 3.23Å; T638-L640 VanDerWaalsContact C-N 3.32Å; T638-L640 PolarHBondContact O-N 3.05Å; L640-G643 PolarHBondContact O-N 2.86Å; L640-L644 HydrophobicContact CD2-CD1 3.76Å; L640-L644 HydrophobicContact CD2-CG 4.39Å; L640-L644 WeakPolarHBondContact O-CG 3.35Å; L640-L644 PolarHBondContact O-N 3.15Å
641	I	83.9	Confident	78.9	Confident	100 Å²	100	91.8 Å²	91.8	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-64	-46	174.1	-67	165.1	0	0	0	111.1	G637 T638 G643 L644 L645	G637-I641 VanDerWaalsContact O-CG1 3.28Å; G637-I641 WeakPolarHBondContact O-CG1 3.39Å; G637-I641 PolarHBondContact O-N 2.92Å; T638-I641 PolarHBondContact O-N 3.31Å; I641-G643 VanDerWaalsContact C-N 3.34Å; I641-G643 PolarHBondContact O-N 2.62Å; I641-L644 PolarHBondContact O-N 2.72Å; I641-L645 HydrophobicContact CG2-CD1 4.08Å; I641-L645 WeakPolarHBondContact O-CG 3.32Å; I641-L645 PolarHBondContact O-N 3.2Å
642	L	82.7	Confident	78.1	Confident	93 Å²	93	90.7 Å²	90.7	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-63.1	-40.4	176.4	-85.4	161.7	0	0	0	111.9	T638 L644 L645 I646	T638-L642 WeakPolarHBondContact O-CB 3.21Å; T638-L642 PolarHBondContact O-N 3.09Å; L642-L644 VanDerWaalsContact C-N 3.34Å; L642-L644 PolarHBondContact O-N 3.43Å; L642-L645 PolarHBondContact O-N 3.23Å; L642-I646 WeakPolarHBondContact O-CB 3.27Å; L642-I646 VanDerWaalsContact O-CG1 3.27Å; L642-I646 WeakPolarHBondContact O-CG1 3.2Å; L642-I646 PolarHBondContact O-N 3.49Å
643	G	83.5	Confident	77.1	Confident	37 Å²	37	94.7 Å²	94.7	38%	0.381	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-44.3	174.1	0	0	0	0	0	112	L639 L640 I641 W647	L639-G643 PolarHBondContact O-N 2.91Å; L640-G643 PolarHBondContact O-N 2.86Å; I641-G643 VanDerWaalsContact C-N 3.34Å; I641-G643 PolarHBondContact O-N 2.62Å; G643-W647 VanDerWaalsContact O-CB 3.29Å; G643-W647 WeakPolarHBondContact O-CB 3.37Å; G643-W647 PolarHBondContact O-N 2.81Å
644	L	78.1	Confident	76	Confident	92 Å²	92	94.3 Å²	94.3	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-40.1	175.6	-73.5	169.5	0	0	0	112.6	L640 I641 L642 W647 C648	L640-L644 HydrophobicContact CD2-CD1 3.76Å; L640-L644 HydrophobicContact CD2-CG 4.39Å; L640-L644 WeakPolarHBondContact O-CG 3.35Å; L640-L644 PolarHBondContact O-N 3.15Å; I641-L644 PolarHBondContact O-N 2.72Å; L642-L644 VanDerWaalsContact C-N 3.34Å; L642-L644 PolarHBondContact O-N 3.43Å; L644-W647 PolarHBondContact O-N 3.48Å; L644-C648 WeakPolarHBondContact O-CB 3.49Å; L644-C648 PolarHBondContact O-N 3.32Å; L644-C648 PolarHBondContact O-SG 3.31Å
645	L	78.4	Confident	74.8	Confident	107 Å²	107	93.3 Å²	93.3	56%	0.56	52%	0.518	S	S	*	.	H	α-helix	trans	-67	-43.2	177.6	-72.3	171.3	0	0	0	112.2	I641 L642 W647 C648 Q649	I641-L645 HydrophobicContact CG2-CD1 4.08Å; I641-L645 WeakPolarHBondContact O-CG 3.32Å; I641-L645 PolarHBondContact O-N 3.2Å; L642-L645 PolarHBondContact O-N 3.23Å; L645-W647 VanDerWaalsContact C-N 3.31Å; L645-C648 PolarHBondContact O-N 3.2Å; L645-Q649 PolarHBondContact O-N 3.09Å
646	I	80.8	Confident	73.4	Confident	92 Å²	92	98.8 Å²	98.8	47%	0.472	55%	0.545	S	S	.	.	H	α-helix	trans	-63.5	-41.8	175	-68.6	166.5	0	0	0	109.8	L642 C648 Q649 I650	L642-I646 WeakPolarHBondContact O-CB 3.27Å; L642-I646 VanDerWaalsContact O-CG1 3.27Å; L642-I646 WeakPolarHBondContact O-CG1 3.2Å; L642-I646 PolarHBondContact O-N 3.49Å; I646-C648 VanDerWaalsContact C-N 3.3Å; I646-C648 PolarHBondContact O-N 3.03Å; I646-Q649 PolarHBondContact O-N 3.13Å; I646-Q649 VanDerWaalsContact O-N 3.12Å; I646-I650 HydrophobicContact CG2-CD1 3.72Å; I646-I650 HydrophobicContact CG2-CG1 4.44Å; I646-I650 WeakPolarHBondContact O-CG1 3.24Å; I646-I650 PolarHBondContact O-N 3.02Å
647	W	76.5	Confident	72	Confident	168 Å²	168	105.6 Å²	105.6	64%	0.636	57%	0.568	S	S	*	*	H	α-helix	trans	-64.6	-36.5	178	-153.9	-2.2	0	0	0	112.1	G643 L644 L645 Q649 I650 I651	G643-W647 VanDerWaalsContact O-CB 3.29Å; G643-W647 WeakPolarHBondContact O-CB 3.37Å; G643-W647 PolarHBondContact O-N 2.81Å; L644-W647 PolarHBondContact O-N 3.48Å; L645-W647 VanDerWaalsContact C-N 3.31Å; W647-Q649 VanDerWaalsContact C-N 3.34Å; W647-I650 PolarHBondContact O-N 2.84Å; W647-I651 PolarHBondContact O-N 3.34Å
648	C	72.8	Confident	70.2	Confident	62 Å²	62	108.5 Å²	108.5	42%	0.419	59%	0.588	S	S	.	*	H	α-helix	trans	-67.1	-30.4	172.6	-70.2	0	0	0	0	113.2	L644 L645 I646	L644-C648 WeakPolarHBondContact O-CB 3.49Å; L644-C648 PolarHBondContact O-N 3.32Å; L644-C648 PolarHBondContact O-SG 3.31Å; L645-C648 PolarHBondContact O-N 3.2Å; I646-C648 VanDerWaalsContact C-N 3.3Å; I646-C648 PolarHBondContact O-N 3.03Å
649	Q	74.1	Confident	68.5	Low	166 Å²	166	109 Å²	109	78%	0.776	59%	0.594	S	S	*	*	H	α-helix	trans	-75.1	-32.7	174.1	-92	-162.7	-25.8	0	0	113.2	L645 I646 W647	L645-Q649 PolarHBondContact O-N 3.09Å; I646-Q649 PolarHBondContact O-N 3.13Å; I646-Q649 VanDerWaalsContact O-N 3.12Å; W647-Q649 VanDerWaalsContact C-N 3.34Å
650	I	76.9	Confident	67.2	Low	124 Å²	124	106.7 Å²	106.7	64%	0.636	60%	0.598	S	S	*	*	H	α-helix	trans	-78.5	-24.2	-177.8	-65.7	170.1	0	0	0	111.7	I646 W647	I646-I650 HydrophobicContact CG2-CD1 3.72Å; I646-I650 HydrophobicContact CG2-CG1 4.44Å; I646-I650 WeakPolarHBondContact O-CG1 3.24Å; I646-I650 PolarHBondContact O-N 3.02Å; W647-I650 PolarHBondContact O-N 2.84Å
651	I	68.1	Low	65.9	Low	69 Å²	69	105.6 Å²	105.6	35%	0.354	60%	0.596	S	S	.	*			trans	-126.5	81.8	178.7	-48.9	178.7	0	0	0	109.5	W647 D653 C654	W647-I651 PolarHBondContact O-N 3.34Å; I651-D653 PolarHBondContact O-N 3.38Å; I651-C654 HydrophobicContact CG2-CB 3.86Å
652	P	55.4	Low	64.8	Low	84 Å²	84	103.1 Å²	103.1	55%	0.545	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.6	-26.2	-176.3	-18.7	31	0	0	0	113.4
653	D	55.8	Low	64	Low	157 Å²	157	104.5 Å²	104.5	84%	0.84	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-4.5	-163.9	-64.5	-32	0	0	0	115.3	I651	I651-D653 PolarHBondContact O-N 3.38Å
654	C	54.7	Low	63.3	Low	97 Å²	97	107.7 Å²	107.7	66%	0.655	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	-15.8	-176.7	-72.9	0	0	0	0	115.7	I651	I651-C654 HydrophobicContact CG2-CB 3.86Å
655	C	51.6	Low	62.7	Low	66 Å²	66	105.9 Å²	105.9	45%	0.446	61%	0.613	S	S	.	*	S	Bend	trans	-102.1	-12.6	-167.5	-71.2	0	0	0	0	115.9	K657	C655-K657 PolarHBondContact O-N 3.36Å
656	L	50.7	Low	62.4	Low	165 Å²	165	106.6 Å²	106.6	86%	0.864	61%	0.613	S	S	*	*	S	Bend	trans	-83.6	-3.3	-172.1	-97.9	150.5	0	0	0	115.8
657	K	52.1	Low	62.2	Low	212 Å²	212	108.6 Å²	108.6	92%	0.922	62%	0.622	S	S	*	*	S	Bend	trans	-121	-5.8	-178	-82	-176.9	178.2	177.3	0	117.2	C655	C655-K657 PolarHBondContact O-N 3.36Å
658	A	48.2	Very low	62	Low	93 Å²	93	103.8 Å²	103.8	77%	0.769	62%	0.618	S	S	*	*	S	Bend	trans	-136.3	5.3	-164.4	0	0	0	0	0	118.8
659	S	46.4	Very low	62.1	Low	74 Å²	74	106.8 Å²	106.8	52%	0.517	63%	0.629	S	S	.	*			trans	-139	129.8	179.8	65.1	0	0	0	0	114.3	V661	S659-V661 PolarHBondContact O-N 2.9Å; S659-V661 WeakPolarHBondContact OG-CG2 3.49Å
660	G	57.3	Low	62.5	Low	65 Å²	65	102.5 Å²	102.5	67%	0.67	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	27.5	179.5	0	0	0	0	0	115.6	G662 L663	G660-G662 PolarHBondContact O-N 3.09Å; G660-L663 PolarHBondContact O-N 3.23Å
661	V	56.8	Low	62.7	Low	94 Å²	94	104.5 Å²	104.5	57%	0.57	61%	0.613	S	S	*	*	H	α-helix	trans	-65.8	-26	177.9	-175.4	0	0	0	0	111.2	S659 L663 V664 A665	S659-V661 PolarHBondContact O-N 2.9Å; S659-V661 WeakPolarHBondContact OG-CG2 3.49Å; V661-L663 VanDerWaalsContact C-N 3.27Å; V661-L663 PolarHBondContact O-N 3.28Å; V661-V664 PolarHBondContact O-N 2.82Å; V661-A665 PolarHBondContact O-N 3.08Å; V661-A665 VanDerWaalsContact O-N 3.13Å
662	G	59.5	Low	63.4	Low	49 Å²	49	102.9 Å²	102.9	51%	0.505	61%	0.613	S	S	.	*	H	α-helix	trans	-57.6	-36.5	173.4	0	0	0	0	0	113.4	G660 Q666	G660-G662 PolarHBondContact O-N 3.09Å; G662-Q666 WeakPolarHBondContact O-CB 3.47Å; G662-Q666 PolarHBondContact O-N 3.28Å
663	L	67.1	Low	64.9	Low	121 Å²	121	107 Å²	107	63%	0.634	62%	0.618	S	S	*	*	H	α-helix	trans	-71	-37.9	-177.7	-148.3	99.8	0	0	0	112.2	G660 V661 Q666 M667	G660-L663 PolarHBondContact O-N 3.23Å; V661-L663 VanDerWaalsContact C-N 3.27Å; V661-L663 PolarHBondContact O-N 3.28Å; L663-Q666 PolarHBondContact O-N 3.1Å; L663-M667 PolarHBondContact O-N 2.89Å
664	V	67.5	Low	66.3	Low	105 Å²	105	104.3 Å²	104.3	64%	0.636	60%	0.604	S	S	*	*	H	α-helix	trans	-73.2	-38.9	179.9	-178.4	0	0	0	0	110.9	V661 Q666 M667 A668	V661-V664 PolarHBondContact O-N 2.82Å; V664-Q666 VanDerWaalsContact C-N 3.3Å; V664-Q666 PolarHBondContact O-N 3.26Å; V664-M667 PolarHBondContact O-N 2.81Å; V664-A668 WeakPolarHBondContact O-CB 3.39Å; V664-A668 PolarHBondContact O-N 3.23Å
665	A	66.7	Low	67.5	Low	53 Å²	53	103 Å²	103	44%	0.438	59%	0.589	S	S	.	*	H	α-helix	trans	-63.7	-37.9	173.9	0	0	0	0	0	111.7	V661 A668 L669	V661-A665 PolarHBondContact O-N 3.08Å; V661-A665 VanDerWaalsContact O-N 3.13Å; A665-A668 PolarHBondContact O-N 3.47Å; A665-L669 WeakPolarHBondContact O-CG 3.44Å; A665-L669 PolarHBondContact O-N 2.78Å
666	Q	72.5	Confident	68.8	Low	123 Å²	123	106.5 Å²	106.5	58%	0.575	60%	0.601	S	S	*	*	H	α-helix	trans	-69.3	-42.7	177.9	-155	164.2	0.7	0	0	111.7	G662 L663 V664 A668 L669 D670	G662-Q666 WeakPolarHBondContact O-CB 3.47Å; G662-Q666 PolarHBondContact O-N 3.28Å; L663-Q666 PolarHBondContact O-N 3.1Å; V664-Q666 VanDerWaalsContact C-N 3.3Å; V664-Q666 PolarHBondContact O-N 3.26Å; Q666-A668 VanDerWaalsContact C-N 3.34Å; Q666-A668 PolarHBondContact O-N 3.28Å; Q666-L669 PolarHBondContact O-N 3.23Å; Q666-D670 PolarHBondContact O-N 3.07Å
667	M	75.4	Confident	70.5	Confident	133 Å²	133	103.9 Å²	103.9	66%	0.655	58%	0.584	S	S	*	*	H	α-helix	trans	-60.9	-39.4	172.2	-84	-171.5	169.1	0	0	113.1	L663 V664 D670 Y671	L663-M667 PolarHBondContact O-N 2.89Å; V664-M667 PolarHBondContact O-N 2.81Å; M667-D670 PolarHBondContact O-N 3.47Å; M667-Y671 WeakPolarHBondContact O-CB 3.39Å; M667-Y671 PolarHBondContact O-N 3.37Å
668	A	72.6	Confident	71.7	Confident	68 Å²	68	99.6 Å²	99.6	56%	0.562	57%	0.569	S	S	*	*	H	α-helix	trans	-67.5	-36.4	177.8	0	0	0	0	0	112.3	V664 A665 Q666 G672	V664-A668 WeakPolarHBondContact O-CB 3.39Å; V664-A668 PolarHBondContact O-N 3.23Å; A665-A668 PolarHBondContact O-N 3.47Å; Q666-A668 VanDerWaalsContact C-N 3.34Å; Q666-A668 PolarHBondContact O-N 3.28Å; A668-G672 PolarHBondContact O-N 3.39Å
669	L	75.8	Confident	73.2	Confident	124 Å²	124	100.4 Å²	100.4	65%	0.649	56%	0.556	S	S	*	*	H	α-helix	trans	-69	-41.8	174.9	-80.5	166.9	0	0	0	112.2	A665 Q666 G672 R673	A665-L669 WeakPolarHBondContact O-CG 3.44Å; A665-L669 PolarHBondContact O-N 2.78Å; Q666-L669 PolarHBondContact O-N 3.23Å; L669-G672 PolarHBondContact O-N 3.5Å; L669-R673 PolarHBondContact O-N 3.02Å; L669-R673 VanDerWaalsContact O-N 3.07Å
670	D	82.3	Confident	75.1	Confident	77 Å²	77	103.2 Å²	103.2	41%	0.412	56%	0.56	S	S	.	*	H	α-helix	trans	-65.2	-42.6	176.3	-71.9	-25.2	0	0	0	110.8	Q666 M667 G672 R673 D674	Q666-D670 PolarHBondContact O-N 3.07Å; M667-D670 PolarHBondContact O-N 3.47Å; D670-G672 VanDerWaalsContact C-N 3.34Å; D670-G672 PolarHBondContact O-N 3.1Å; D670-R673 WeakPolarHBondContact O-CB 3.32Å; D670-R673 PolarHBondContact O-N 2.94Å; D670-R673 VanDerWaalsContact O-N 3.1Å; D670-D674 PolarHBondContact O-N 3.26Å; D670-D674 VanDerWaalsContact O-N 3.09Å
671	Y	81.5	Confident	76.4	Confident	165 Å²	165	105.5 Å²	105.5	65%	0.647	55%	0.553	S	S	*	*	H	α-helix	trans	-63.1	-38.1	175.8	-162.3	-101.7	0	0	0	112.9	M667 R673 I675	M667-Y671 WeakPolarHBondContact O-CB 3.39Å; M667-Y671 PolarHBondContact O-N 3.37Å; Y671-R673 VanDerWaalsContact C-N 3.3Å; Y671-R673 PolarHBondContact O-N 2.83Å; Y671-I675 HydrophobicContact CD1-CD1 3.79Å; Y671-I675 HydrophobicContact CE1-CD1 3.53Å; Y671-I675 HydrophobicContact CE1-CG1 4.33Å; Y671-I675 WeakPolarHBondContact O-CG1 3.34Å; Y671-I675 PolarHBondContact O-N 3.45Å
672	G	82.5	Confident	77.3	Confident	35 Å²	35	106.9 Å²	106.9	36%	0.361	55%	0.553	S	S	.	*	H	α-helix	trans	-65.3	-33.3	174	0	0	0	0	0	113.1	A668 L669 D670 M676	A668-G672 PolarHBondContact O-N 3.39Å; L669-G672 PolarHBondContact O-N 3.5Å; D670-G672 VanDerWaalsContact C-N 3.34Å; D670-G672 PolarHBondContact O-N 3.1Å; G672-M676 PolarHBondContact O-N 3.42Å
673	R	85.3	Confident	78.1	Confident	170 Å²	170	111.8 Å²	111.8	64%	0.642	56%	0.56	S	S	*	*	H	α-helix	trans	-70.1	-42.3	178.5	-155.5	-177.4	-80	167	-4.3	111.2	L669 D670 Y671 M676 Q677	L669-R673 PolarHBondContact O-N 3.02Å; L669-R673 VanDerWaalsContact O-N 3.07Å; D670-R673 WeakPolarHBondContact O-CB 3.32Å; D670-R673 PolarHBondContact O-N 2.94Å; D670-R673 VanDerWaalsContact O-N 3.1Å; Y671-R673 VanDerWaalsContact C-N 3.3Å; Y671-R673 PolarHBondContact O-N 2.83Å; R673-M676 PolarHBondContact O-N 3.49Å; R673-Q677 PolarHBondContact O-N 2.86Å; R673-Q677 VanDerWaalsContact O-N 3.09Å
674	D	85.3	Confident	78.8	Confident	102 Å²	102	111.5 Å²	111.5	55%	0.545	56%	0.556	S	S	.	*	H	α-helix	trans	-64.1	-40.2	176.4	-76.1	-12.3	0	0	0	112.6	D670 M676 Q677 M678	D670-D674 PolarHBondContact O-N 3.26Å; D670-D674 VanDerWaalsContact O-N 3.09Å; D674-M676 PolarHBondContact O-N 2.71Å; D674-Q677 PolarHBondContact O-N 3.47Å; D674-M678 PolarHBondContact O-N 3.41Å
675	I	81.5	Confident	79	Confident	68 Å²	68	109.3 Å²	109.3	35%	0.349	55%	0.548	S	S	.	.	H	α-helix	trans	-63.4	-42	176.4	-72.4	176.2	0	0	0	111.5	Y671 Q677 M678 Q679	Y671-I675 HydrophobicContact CD1-CD1 3.79Å; Y671-I675 HydrophobicContact CE1-CD1 3.53Å; Y671-I675 HydrophobicContact CE1-CG1 4.33Å; Y671-I675 WeakPolarHBondContact O-CG1 3.34Å; Y671-I675 PolarHBondContact O-N 3.45Å; I675-Q677 VanDerWaalsContact C-N 3.26Å; I675-Q677 PolarHBondContact O-N 2.94Å; I675-M678 PolarHBondContact O-N 3.25Å; I675-Q679 PolarHBondContact O-N 3.43Å
676	M	77.3	Confident	79.3	Confident	140 Å²	140	112.4 Å²	112.4	69%	0.69	55%	0.554	S	S	*	*	H	α-helix	trans	-64.8	-33.9	176.4	-80.7	-134.6	-86	0	0	112.1	G672 R673 D674 K680	G672-M676 PolarHBondContact O-N 3.42Å; R673-M676 PolarHBondContact O-N 3.49Å; D674-M676 PolarHBondContact O-N 2.71Å; M676-K680 WeakPolarHBondContact O-CB 3.28Å; M676-K680 PolarHBondContact O-N 3.45Å; M676-K680 VanDerWaalsContact O-N 3.07Å
677	Q	86.6	Confident	79.5	Confident	111 Å²	111	108.3 Å²	108.3	52%	0.519	55%	0.545	S	S	.	.	H	α-helix	trans	-69.3	-44.1	176.7	-161.2	152.9	-19	0	0	111.5	R673 D674 I675 Q679 K680 E681	R673-Q677 PolarHBondContact O-N 2.86Å; R673-Q677 VanDerWaalsContact O-N 3.09Å; D674-Q677 PolarHBondContact O-N 3.47Å; I675-Q677 VanDerWaalsContact C-N 3.26Å; I675-Q677 PolarHBondContact O-N 2.94Å; Q677-Q679 PolarHBondContact O-N 3.01Å; Q677-K680 WeakPolarHBondContact O-CB 3.37Å; Q677-K680 PolarHBondContact O-N 3.01Å; Q677-K680 VanDerWaalsContact O-N 3.16Å; Q677-E681 WeakPolarHBondContact O-CG 3.43Å; Q677-E681 PolarHBondContact O-N 3.09Å
678	M	77.9	Confident	79.2	Confident	122 Å²	122	107.1 Å²	107.1	60%	0.601	54%	0.541	S	S	*	.	H	α-helix	trans	-60.2	-42.2	172.5	-85.4	-157.7	-68.3	0	0	112.9	D674 I675 K680 E681 E682	D674-M678 PolarHBondContact O-N 3.41Å; I675-M678 PolarHBondContact O-N 3.25Å; M678-K680 VanDerWaalsContact C-N 3.28Å; M678-K680 PolarHBondContact O-N 3.06Å; M678-E681 PolarHBondContact O-N 2.67Å; M678-E682 WeakPolarHBondContact O-CB 3.28Å; M678-E682 PolarHBondContact O-N 3.47Å
679	Q	80.1	Confident	79.2	Confident	109 Å²	109	110.8 Å²	110.8	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-32	176.7	-78.7	-167.7	-9.7	0	0	113	I675 Q677 K683	I675-Q679 PolarHBondContact O-N 3.43Å; Q677-Q679 PolarHBondContact O-N 3.01Å; Q679-K683 WeakPolarHBondContact O-CG 3.38Å; Q679-K683 PolarHBondContact O-N 3.01Å; Q679-K683 VanDerWaalsContact O-N 3.09Å
680	K	86.3	Confident	79	Confident	134 Å²	134	112.7 Å²	112.7	58%	0.583	55%	0.549	S	S	*	.	H	α-helix	trans	-67	-46	174.6	-169.8	-177.2	176	-171.3	0	110.6	M676 Q677 M678 E682 K683 E684	M676-K680 WeakPolarHBondContact O-CB 3.28Å; M676-K680 PolarHBondContact O-N 3.45Å; M676-K680 VanDerWaalsContact O-N 3.07Å; Q677-K680 WeakPolarHBondContact O-CB 3.37Å; Q677-K680 PolarHBondContact O-N 3.01Å; Q677-K680 VanDerWaalsContact O-N 3.16Å; M678-K680 VanDerWaalsContact C-N 3.28Å; M678-K680 PolarHBondContact O-N 3.06Å; K680-E682 VanDerWaalsContact C-N 3.34Å; K680-E682 PolarHBondContact O-N 3.47Å; K680-K683 PolarHBondContact O-N 2.83Å; K680-E684 WeakPolarHBondContact O-CG 3.27Å; K680-E684 PolarHBondContact O-N 3.35Å
681	E	84	Confident	78.6	Confident	112 Å²	112	116.7 Å²	116.7	52%	0.523	56%	0.563	S	S	.	*	H	α-helix	trans	-62.6	-39.7	175.9	-70.1	177.1	-178.3	0	0	112.1	Q677 M678 K683 E684 A685	Q677-E681 WeakPolarHBondContact O-CG 3.43Å; Q677-E681 PolarHBondContact O-N 3.09Å; M678-E681 PolarHBondContact O-N 2.67Å; E681-K683 PolarHBondContact O-N 3.02Å; E681-E684 PolarHBondContact O-N 3.18Å; E681-A685 WeakPolarHBondContact O-CB 3.46Å; E681-A685 PolarHBondContact O-N 3.44Å
682	E	75.6	Confident	78.5	Confident	123 Å²	123	115.8 Å²	115.8	58%	0.575	56%	0.562	S	S	*	*	H	α-helix	trans	-66.2	-38	177.7	-156.4	178.7	-161.7	0	0	111.9	M678 K680 A685 Q686	M678-E682 WeakPolarHBondContact O-CB 3.28Å; M678-E682 PolarHBondContact O-N 3.47Å; K680-E682 VanDerWaalsContact C-N 3.34Å; K680-E682 PolarHBondContact O-N 3.47Å; E682-A685 PolarHBondContact O-N 3.06Å; E682-Q686 WeakPolarHBondContact O-CG 3.42Å; E682-Q686 PolarHBondContact O-N 3.13Å
683	K	76.9	Confident	78.2	Confident	153 Å²	153	119 Å²	119	67%	0.665	57%	0.571	S	S	*	*	H	α-helix	trans	-66.1	-39.4	172.2	-79.7	179.3	179.2	173.6	0	112.3	Q679 K680 E681 Q686 G687	Q679-K683 WeakPolarHBondContact O-CG 3.38Å; Q679-K683 PolarHBondContact O-N 3.01Å; Q679-K683 VanDerWaalsContact O-N 3.09Å; K680-K683 PolarHBondContact O-N 2.83Å; E681-K683 PolarHBondContact O-N 3.02Å; K683-Q686 PolarHBondContact O-N 3.35Å; K683-G687 PolarHBondContact O-N 3.34Å
684	E	80.5	Confident	77.9	Confident	115 Å²	115	118.6 Å²	118.6	54%	0.537	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-40.2	175.6	-73.4	177.6	-172.1	0	0	111.4	K680 E681 G687 L688	K680-E684 WeakPolarHBondContact O-CG 3.27Å; K680-E684 PolarHBondContact O-N 3.35Å; E681-E684 PolarHBondContact O-N 3.18Å; E684-G687 PolarHBondContact O-N 2.77Å; E684-L688 PolarHBondContact O-N 3.48Å; E684-L688 VanDerWaalsContact O-N 3.08Å
685	A	73.5	Confident	77.7	Confident	58 Å²	58	117.6 Å²	117.6	48%	0.479	57%	0.568	S	S	.	*	H	α-helix	trans	-62.8	-43.7	174.6	0	0	0	0	0	112.5	E681 E682 G687 L688 E689	E681-A685 WeakPolarHBondContact O-CB 3.46Å; E681-A685 PolarHBondContact O-N 3.44Å; E682-A685 PolarHBondContact O-N 3.06Å; A685-G687 VanDerWaalsContact C-N 3.3Å; A685-G687 PolarHBondContact O-N 3.26Å; A685-L688 PolarHBondContact O-N 2.89Å; A685-E689 PolarHBondContact O-N 3.37Å
686	Q	72.4	Confident	77.5	Confident	118 Å²	118	117.1 Å²	117.1	55%	0.551	57%	0.574	S	S	*	*	H	α-helix	trans	-65.2	-32.9	174.5	-73.2	-178.4	7.5	0	0	112.7	E682 K683 L688 K690	E682-Q686 WeakPolarHBondContact O-CG 3.42Å; E682-Q686 PolarHBondContact O-N 3.13Å; K683-Q686 PolarHBondContact O-N 3.35Å; Q686-L688 VanDerWaalsContact C-N 3.34Å; Q686-K690 PolarHBondContact O-N 3.48Å
687	G	75.8	Confident	77.5	Confident	38 Å²	38	118.8 Å²	118.8	39%	0.392	57%	0.572	S	S	.	*	H	α-helix	trans	-63	-39.4	172.4	0	0	0	0	0	112.6	K683 E684 A685 K690 K691	K683-G687 PolarHBondContact O-N 3.34Å; E684-G687 PolarHBondContact O-N 2.77Å; A685-G687 VanDerWaalsContact C-N 3.3Å; A685-G687 PolarHBondContact O-N 3.26Å; G687-K690 PolarHBondContact O-N 2.95Å; G687-K691 PolarHBondContact O-N 2.99Å; G687-K691 VanDerWaalsContact O-N 3.14Å
688	L	70	Confident	77.1	Confident	108 Å²	108	117.6 Å²	117.6	57%	0.565	57%	0.567	S	S	*	*	H	α-helix	trans	-68.8	-39.6	179	-126.6	107.1	0	0	0	112.5	E684 A685 Q686 K691 K692	E684-L688 PolarHBondContact O-N 3.48Å; E684-L688 VanDerWaalsContact O-N 3.08Å; A685-L688 PolarHBondContact O-N 2.89Å; Q686-L688 VanDerWaalsContact C-N 3.34Å; L688-K691 PolarHBondContact O-N 3.41Å; L688-K692 PolarHBondContact O-N 3.25Å
689	E	71.6	Confident	77.2	Confident	144 Å²	144	116.9 Å²	116.9	67%	0.673	57%	0.565	S	S	*	*	H	α-helix	trans	-63.7	-41.5	174.1	-85.3	-154.4	144.7	0	0	112.3	A685 K691 K692 L693	A685-E689 PolarHBondContact O-N 3.37Å; E689-K691 VanDerWaalsContact C-N 3.3Å; E689-K691 PolarHBondContact O-N 2.93Å; E689-K692 PolarHBondContact O-N 3.35Å; E689-L693 PolarHBondContact O-N 2.89Å
690	K	71.7	Confident	76.9	Confident	165 Å²	165	114.3 Å²	114.3	72%	0.717	56%	0.562	S	S	*	*	H	α-helix	trans	-60	-40.3	174.6	-82.6	-178.7	177.6	173.9	0	111.9	Q686 G687 L693 Y694	Q686-K690 PolarHBondContact O-N 3.48Å; G687-K690 PolarHBondContact O-N 2.95Å; K690-L693 PolarHBondContact O-N 3.06Å; K690-Y694 WeakPolarHBondContact O-CB 3.29Å; K690-Y694 PolarHBondContact O-N 3.3Å
691	K	73.8	Confident	76.1	Confident	160 Å²	160	117 Å²	117	70%	0.696	57%	0.569	S	S	*	*	H	α-helix	trans	-62.7	-45.4	174	-104.2	-177.9	177.2	178.3	0	111.9	G687 L688 E689 L693 Y694 V695	G687-K691 PolarHBondContact O-N 2.99Å; G687-K691 VanDerWaalsContact O-N 3.14Å; L688-K691 PolarHBondContact O-N 3.41Å; E689-K691 VanDerWaalsContact C-N 3.3Å; E689-K691 PolarHBondContact O-N 2.93Å; K691-L693 PolarHBondContact O-N 2.84Å; K691-Y694 PolarHBondContact O-N 3.31Å; K691-V695 WeakPolarHBondContact O-CG2 3.37Å; K691-V695 PolarHBondContact O-N 3.4Å
692	K	80.8	Confident	75.6	Confident	147 Å²	147	116 Å²	116	64%	0.639	57%	0.567	S	S	*	*	H	α-helix	trans	-61	-43.5	176.5	-74.3	-179.1	177.9	177.6	0	112	L688 E689 Y694 V695 A696	L688-K692 PolarHBondContact O-N 3.25Å; E689-K692 PolarHBondContact O-N 3.35Å; K692-Y694 VanDerWaalsContact C-N 3.32Å; K692-Y694 PolarHBondContact O-N 2.78Å; K692-V695 PolarHBondContact O-N 3.47Å; K692-A696 WeakPolarHBondContact O-CB 3.49Å; K692-A696 PolarHBondContact O-N 3.38Å
693	L	75	Confident	75.2	Confident	102 Å²	102	120.4 Å²	120.4	53%	0.534	58%	0.578	S	S	.	*	H	α-helix	trans	-65.7	-36.1	178.5	-142.5	97.8	0	0	0	112.2	E689 K690 K691 R697	E689-L693 PolarHBondContact O-N 2.89Å; K690-L693 PolarHBondContact O-N 3.06Å; K691-L693 PolarHBondContact O-N 2.84Å; L693-R697 WeakPolarHBondContact O-CG 3.12Å; L693-R697 PolarHBondContact O-N 3.35Å; L693-R697 VanDerWaalsContact O-N 3.12Å
694	Y	79.6	Confident	74.2	Confident	162 Å²	162	122.9 Å²	122.9	64%	0.635	58%	0.583	S	S	*	*	H	α-helix	trans	-65.4	-47.7	175.2	-178	-98.4	0	0	0	111.7	K690 K691 K692 A696 R697 Q698	K690-Y694 WeakPolarHBondContact O-CB 3.29Å; K690-Y694 PolarHBondContact O-N 3.3Å; K691-Y694 PolarHBondContact O-N 3.31Å; K692-Y694 VanDerWaalsContact C-N 3.32Å; K692-Y694 PolarHBondContact O-N 2.78Å; Y694-A696 PolarHBondContact O-N 3.27Å; Y694-R697 PolarHBondContact O-N 2.94Å; Y694-Q698 HydrophobicContact CE1-CG 4.49Å; Y694-Q698 PolarHBondContact O-N 3.33Å
695	V	79.9	Confident	72.8	Confident	81 Å²	81	122.9 Å²	122.9	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-62.2	-42.4	177.4	174.2	0	0	0	0	111.3	K691 K692 R697 Q698 L699	K691-V695 WeakPolarHBondContact O-CG2 3.37Å; K691-V695 PolarHBondContact O-N 3.4Å; K692-V695 PolarHBondContact O-N 3.47Å; V695-R697 VanDerWaalsContact C-N 3.34Å; V695-R697 PolarHBondContact O-N 3.2Å; V695-Q698 PolarHBondContact O-N 3.41Å; V695-L699 HydrophobicContact CG1-CD1 3.99Å; V695-L699 PolarHBondContact O-N 3.38Å
696	A	79	Confident	71.6	Confident	58 Å²	58	128.8 Å²	128.8	48%	0.479	61%	0.609	S	S	.	*	H	α-helix	trans	-61.4	-39.3	176.4	0	0	0	0	0	112.6	K692 Y694 A700	K692-A696 WeakPolarHBondContact O-CB 3.49Å; K692-A696 PolarHBondContact O-N 3.38Å; Y694-A696 PolarHBondContact O-N 3.27Å; A696-A700 WeakPolarHBondContact O-CB 3.37Å; A696-A700 PolarHBondContact O-N 3.12Å
697	R	77.1	Confident	70.1	Confident	174 Å²	174	130.1 Å²	130.1	66%	0.657	64%	0.64	S	S	*	*	H	α-helix	trans	-68.6	-35.8	175.2	-78.2	179.8	-178.1	174.4	2.3	112.9	L693 Y694 V695 R701	L693-R697 WeakPolarHBondContact O-CG 3.12Å; L693-R697 PolarHBondContact O-N 3.35Å; L693-R697 VanDerWaalsContact O-N 3.12Å; Y694-R697 PolarHBondContact O-N 2.94Å; V695-R697 VanDerWaalsContact C-N 3.34Å; V695-R697 PolarHBondContact O-N 3.2Å; R697-R701 PolarHBondContact O-N 3.42Å; R697-R701 VanDerWaalsContact O-N 3.11Å
698	Q	78	Confident	69.8	Low	87 Å²	87	134.8 Å²	134.8	41%	0.407	65%	0.652	S	S	.	*	H	α-helix	trans	-65.3	-47.9	175.4	-113.9	-78.1	-12.6	0	0	110.9	Y694 V695 A700 R701 N702	Y694-Q698 HydrophobicContact CE1-CG 4.49Å; Y694-Q698 PolarHBondContact O-N 3.33Å; V695-Q698 PolarHBondContact O-N 3.41Å; Q698-A700 VanDerWaalsContact C-N 3.33Å; Q698-A700 PolarHBondContact O-N 3.18Å; Q698-R701 PolarHBondContact O-N 3.23Å; Q698-R701 VanDerWaalsContact O-N 3.1Å; Q698-N702 PolarHBondContact O-N 2.92Å; Q698-N702 VanDerWaalsContact O-N 3.09Å; Q698-N702 PolarHBondContact OE1-ND2 3.32Å
699	L	79.2	Confident	69.8	Low	107 Å²	107	136.2 Å²	136.2	56%	0.56	66%	0.657	S	S	*	*	H	α-helix	trans	-61	-38.9	175.2	-76.6	164.9	0	0	0	112.9	V695 R701 N702 R703	V695-L699 HydrophobicContact CG1-CD1 3.99Å; V695-L699 PolarHBondContact O-N 3.38Å; L699-R701 VanDerWaalsContact C-N 3.31Å; L699-R701 PolarHBondContact O-N 3.05Å; L699-N702 PolarHBondContact O-N 3.44Å; L699-R703 PolarHBondContact O-N 3.03Å
700	A	73.5	Confident	69.7	Low	54 Å²	54	135.7 Å²	135.7	45%	0.446	66%	0.656	S	S	.	*	H	α-helix	trans	-67.1	-30	176	0	0	0	0	0	113.2	A696 Q698	A696-A700 WeakPolarHBondContact O-CB 3.37Å; A696-A700 PolarHBondContact O-N 3.12Å; Q698-A700 VanDerWaalsContact C-N 3.33Å; Q698-A700 PolarHBondContact O-N 3.18Å
701	R	71.1	Confident	69.6	Low	190 Å²	190	134 Å²	134	72%	0.717	65%	0.652	S	S	*	*	H	α-helix	trans	-71.8	-43.9	173.4	-81.3	-178	178.7	177.3	-1	111.6	R697 Q698 L699 R703 R704	R697-R701 PolarHBondContact O-N 3.42Å; R697-R701 VanDerWaalsContact O-N 3.11Å; Q698-R701 PolarHBondContact O-N 3.23Å; Q698-R701 VanDerWaalsContact O-N 3.1Å; L699-R701 VanDerWaalsContact C-N 3.31Å; L699-R701 PolarHBondContact O-N 3.05Å; R701-R703 VanDerWaalsContact C-N 3.27Å; R701-R703 PolarHBondContact O-N 3.46Å; R701-R704 PolarHBondContact O-N 3.25Å; R701-R704 VanDerWaalsContact O-N 3.08Å
702	N	72.6	Confident	69.3	Low	92 Å²	92	132.4 Å²	132.4	49%	0.492	65%	0.65	S	S	.	*	H	α-helix	trans	-65.2	-30.8	-179.4	-68.5	-13.3	0	0	0	112.7	Q698 L699 R704 V705	Q698-N702 PolarHBondContact O-N 2.92Å; Q698-N702 VanDerWaalsContact O-N 3.09Å; Q698-N702 PolarHBondContact OE1-ND2 3.32Å; L699-N702 PolarHBondContact O-N 3.44Å; N702-R704 VanDerWaalsContact C-N 3.28Å; N702-R704 PolarHBondContact O-N 3.15Å; N702-V705 PolarHBondContact O-N 2.91Å
703	R	68.3	Low	68.5	Low	215 Å²	215	131.4 Å²	131.4	81%	0.811	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-18.5	174	-78.2	-173.5	176.6	-175.9	-0.8	114.8	L699 R701	L699-R703 PolarHBondContact O-N 3.03Å; R701-R703 VanDerWaalsContact C-N 3.27Å; R701-R703 PolarHBondContact O-N 3.46Å
704	R	54.6	Low	68.1	Low	205 Å²	205	133.5 Å²	133.5	77%	0.774	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-6.5	177.3	-72.2	-173.9	-171.6	178	1.5	114	R701 N702	R701-R704 PolarHBondContact O-N 3.25Å; R701-R704 VanDerWaalsContact O-N 3.08Å; N702-R704 VanDerWaalsContact C-N 3.28Å; N702-R704 PolarHBondContact O-N 3.15Å
705	V	51.7	Low	67.2	Low	115 Å²	115	131.3 Å²	131.3	70%	0.697	66%	0.66	S	S	*	*	S	Bend	trans	-89.5	-9.8	-179.9	-175.7	0	0	0	0	111.7	N702	N702-V705 PolarHBondContact O-N 2.91Å
706	H	48	Very low	66.1	Low	183 Å²	183	135.5 Å²	135.5	85%	0.847	67%	0.674	S	S	*	*			trans	-112.4	11	-179.9	-79.6	-65.3	0	0	0	114.9
707	A	40.9	Very low	65	Low	146 Å²	146	142.5 Å²	142.5	100%	1.207	69%	0.692	S	S	*	*			trans	-126.6	0	171.4	0	0	0	0	0	108.7

Retrieved 707 of 707 residues in 342.7 ms (Link to these results)

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