A0A077ZD09_TRITR Loading...

Tub family protein

AlphaFold DB , UniProt , Accession A0A077ZD09, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 431 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27	Very low	24.3	Very low	244 Å²	244	180.6 Å²	180.6	100%	1.202	86%	0.864	S	S	*	*				0	123.6	0	-93.5	172.2	156.2	0	0	108.8
2	K	21.5	Very low	24.6	Very low	208 Å²	208	175.9 Å²	175.9	90%	0.904	87%	0.865	S	S	*	*			trans	-73.3	120.6	178.7	-75	176.4	175.1	177	0	109.3	Y4	K2-Y4 PolarHBondContact O-N 3.28Å
3	L	22.8	Very low	24.7	Very low	173 Å²	173	176.5 Å²	176.5	91%	0.906	86%	0.864	S	S	*	*			trans	-74.9	118	178.4	-82.6	150.8	0	0	0	110	K5	L3-K5 PolarHBondContact O-N 3.49Å
4	Y	21.4	Very low	24.9	Very low	230 Å²	230	173.6 Å²	173.6	90%	0.902	85%	0.845	S	S	*	*			trans	-69.6	114.5	169.2	-99.5	-96.6	0	0	0	109.3	K2 R6	K2-Y4 PolarHBondContact O-N 3.28Å; Y4-R6 PolarHBondContact O-N 3.11Å; Y4-R6 VanDerWaalsContact O-N 3.11Å
5	K	21.9	Very low	25	Very low	215 Å²	215	167.5 Å²	167.5	94%	0.935	82%	0.822	S	S	*	*			trans	-75.5	87.3	177	-154.4	179.3	-169.9	-176.5	0	108	L3	L3-K5 PolarHBondContact O-N 3.49Å
6	R	23.7	Very low	25.2	Very low	241 Å²	241	167.5 Å²	167.5	91%	0.909	82%	0.819	S	S	*	*			trans	-85.6	125.9	173.6	-134.1	176.5	-171.8	174.6	1.2	109.1	Y4 T8	Y4-R6 PolarHBondContact O-N 3.11Å; Y4-R6 VanDerWaalsContact O-N 3.11Å; R6-T8 PolarHBondContact O-N 3.35Å
7	S	25	Very low	25.3	Very low	106 Å²	106	164.5 Å²	164.5	74%	0.741	81%	0.808	S	S	*	*			trans	-41.8	121.5	-176.5	-178.9	0	0	0	0	113.3	N9	S7-N9 PolarHBondContact O-N 3.39Å
8	T	25.6	Very low	25.4	Very low	126 Å²	126	159.8 Å²	159.8	77%	0.773	79%	0.79	S	S	*	*	S	Bend	trans	-71.8	103.6	170.7	45.8	0	0	0	0	108.5	R6	R6-T8 PolarHBondContact O-N 3.35Å
9	N	27.5	Very low	25.4	Very low	154 Å²	154	159.4 Å²	159.4	82%	0.824	78%	0.783	S	S	*	*	S	Bend	trans	-162.3	-0.2	157.8	-95.7	-15.5	0	0	0	116.2	S7	S7-N9 PolarHBondContact O-N 3.39Å
10	E	27	Very low	25.4	Very low	189 Å²	189	158.2 Å²	158.2	88%	0.883	77%	0.773	S	S	*	*	S	Bend	trans	-131.9	20.9	-180	-72.8	-173.9	161.3	0	0	114.9
11	L	24.2	Very low	25.6	Very low	101 Å²	101	154.5 Å²	154.5	53%	0.529	76%	0.76	S	S	.	*			trans	-125	35.6	-171.8	-111.3	95.9	0	0	0	115.1	E13 K14 V15	L11-E13 VanDerWaalsContact C-N 3.26Å; L11-E13 PolarHBondContact O-N 3.28Å; L11-K14 HydrophobicContact CD2-CB 3.69Å; L11-K14 HydrophobicContact CD2-CD 4.38Å; L11-K14 HydrophobicContact CG-CB 3.97Å; L11-K14 HydrophobicContact CG-CD 4.38Å; L11-V15 WeakPolarHBondContact O-CG2 3.07Å
12	S	27.4	Very low	25.5	Very low	124 Å²	124	149.8 Å²	149.8	87%	0.867	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-17.8	174.1	58.6	0	0	0	0	114
13	E	26.4	Very low	26	Very low	183 Å²	183	144.5 Å²	144.5	86%	0.855	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-9.1	179.2	-84.5	-174.3	152.9	0	0	115.3	L11	L11-E13 VanDerWaalsContact C-N 3.26Å; L11-E13 PolarHBondContact O-N 3.28Å
14	K	26.8	Very low	26.5	Very low	137 Å²	137	141.9 Å²	141.9	60%	0.596	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-5.7	-176.5	-77.4	-178.6	177	173.8	0	114.9	L11 V18	L11-K14 HydrophobicContact CD2-CB 3.69Å; L11-K14 HydrophobicContact CD2-CD 4.38Å; L11-K14 HydrophobicContact CG-CB 3.97Å; L11-K14 HydrophobicContact CG-CD 4.38Å; K14-V18 WeakPolarHBondContact O-CG2 3.44Å; K14-V18 PolarHBondContact O-N 3.36Å
15	V	27.2	Very low	27.1	Very low	82 Å²	82	136.1 Å²	136.1	50%	0.497	68%	0.677	S	S	.	*	H	α-helix	trans	-74.6	-28.8	-173.2	176.9	0	0	0	0	112.6	L11 N17 V18 F19	L11-V15 WeakPolarHBondContact O-CG2 3.07Å; V15-N17 VanDerWaalsContact C-N 3.33Å; V15-N17 PolarHBondContact O-N 3.35Å; V15-V18 PolarHBondContact O-N 3.46Å; V15-F19 HydrophobicContact CG1-CD2 4.37Å; V15-F19 PolarHBondContact O-N 2.75Å
16	E	27.2	Very low	27.8	Very low	167 Å²	167	130.1 Å²	130.1	78%	0.78	66%	0.659	S	S	*	*	H	α-helix	trans	-65.9	-36.2	177.4	-69	-168.9	156.6	0	0	112.5
17	N	27.3	Very low	28.4	Very low	117 Å²	117	123.8 Å²	123.8	63%	0.626	64%	0.638	S	S	*	*	H	α-helix	trans	-80.6	-30	-179.5	-74.5	-31.6	0	0	0	113.4	V15 F20 V21	V15-N17 VanDerWaalsContact C-N 3.33Å; V15-N17 PolarHBondContact O-N 3.35Å; N17-F20 PolarHBondContact O-N 2.92Å; N17-V21 WeakPolarHBondContact O-CG2 3.41Å; N17-V21 PolarHBondContact O-N 2.93Å; N17-V21 VanDerWaalsContact O-N 3.07Å
18	V	26.8	Very low	29	Very low	80 Å²	80	121.4 Å²	121.4	49%	0.485	62%	0.617	S	S	.	*	H	α-helix	trans	-72	-35.8	-180	177.2	0	0	0	0	111.4	K14 V15 F20 V21 F22	K14-V18 WeakPolarHBondContact O-CG2 3.44Å; K14-V18 PolarHBondContact O-N 3.36Å; V15-V18 PolarHBondContact O-N 3.46Å; V18-F20 VanDerWaalsContact C-N 3.29Å; V18-F20 PolarHBondContact O-N 2.91Å; V18-V21 PolarHBondContact O-N 2.95Å; V18-F22 HydrophobicContact CG1-CD2 4.42Å; V18-F22 PolarHBondContact O-N 2.97Å
19	F	25.2	Very low	29.5	Very low	152 Å²	152	119.2 Å²	119.2	67%	0.667	60%	0.6	S	S	*	*	H	α-helix	trans	-63.1	-37.3	174.8	-109.8	-84.6	0	0	0	112.1	V15 L23	V15-F19 HydrophobicContact CG1-CD2 4.37Å; V15-F19 PolarHBondContact O-N 2.75Å; F19-L23 PolarHBondContact O-N 3.31Å
20	F	26.6	Very low	29.8	Very low	134 Å²	134	121.3 Å²	121.3	59%	0.588	61%	0.605	S	S	*	*	H	α-helix	trans	-69.3	-40.2	175.7	-100.4	-87.4	0	0	0	113	N17 V18 W24	N17-F20 PolarHBondContact O-N 2.92Å; V18-F20 VanDerWaalsContact C-N 3.29Å; V18-F20 PolarHBondContact O-N 2.91Å; F20-W24 PolarHBondContact O-N 3.37Å
21	V	28.5	Very low	30.1	Very low	82 Å²	82	114.6 Å²	114.6	50%	0.497	58%	0.579	S	S	.	*	H	α-helix	trans	-70.9	-33.9	179.2	175.1	0	0	0	0	111.9	N17 V18 W24 N25	N17-V21 WeakPolarHBondContact O-CG2 3.41Å; N17-V21 PolarHBondContact O-N 2.93Å; N17-V21 VanDerWaalsContact O-N 3.07Å; V18-V21 PolarHBondContact O-N 2.95Å; V21-W24 WeakPolarHBondContact O-CB 3.33Å; V21-W24 PolarHBondContact O-N 2.73Å; V21-N25 PolarHBondContact O-N 2.84Å; V21-N25 VanDerWaalsContact O-N 3.12Å
22	F	26	Very low	30.6	Very low	145 Å²	145	111 Å²	111	64%	0.636	56%	0.563	S	S	*	*	H	α-helix	trans	-66.4	-39.6	179.5	-123.2	-86.4	0	0	0	112.6	V18 W24 T26	V18-F22 HydrophobicContact CG1-CD2 4.42Å; V18-F22 PolarHBondContact O-N 2.97Å; F22-W24 VanDerWaalsContact C-N 3.33Å; F22-T26 PolarHBondContact O-N 3.06Å; F22-T26 PolarHBondContact O-OG1 2.76Å
23	L	31.1	Very low	30.6	Very low	97 Å²	97	112 Å²	112	51%	0.508	56%	0.556	S	S	.	*	H	α-helix	trans	-67.2	-33.6	173	-96.3	146.5	0	0	0	112.4	F19	F19-L23 PolarHBondContact O-N 3.31Å
24	W	33.8	Very low	30.8	Very low	117 Å²	117	108 Å²	108	44%	0.443	54%	0.54	S	S	.	.	I	π-helix	trans	-67.5	-46.5	-179.4	-160.2	-88.3	0	0	0	112.8	F20 V21 F22 L79	F20-W24 PolarHBondContact O-N 3.37Å; V21-W24 WeakPolarHBondContact O-CB 3.33Å; V21-W24 PolarHBondContact O-N 2.73Å; F22-W24 VanDerWaalsContact C-N 3.33Å; W24-L79 HydrophobicContact CH2-CD2 4.29Å
25	N	34.1	Very low	30.8	Very low	109 Å²	109	105.4 Å²	105.4	58%	0.583	54%	0.535	S	S	*	.	I	π-helix	trans	-85.4	-22.6	-170.3	-80.6	-17.6	0	0	0	114.8	V21	V21-N25 PolarHBondContact O-N 2.84Å; V21-N25 VanDerWaalsContact O-N 3.12Å
26	T	36.1	Very low	30.8	Very low	90 Å²	90	104.9 Å²	104.9	55%	0.552	54%	0.535	S	S	*	.	I	π-helix	trans	-94.6	-20.4	-172.3	46.9	0	0	0	0	115.6	F22	F22-T26 PolarHBondContact O-N 3.06Å; F22-T26 PolarHBondContact O-OG1 2.76Å
27	F	36.1	Very low	30.8	Very low	107 Å²	107	101.2 Å²	101.2	47%	0.469	53%	0.528	S	S	.	.	I	π-helix	trans	-134.4	-31.6	-172.5	-101.7	-86.4	0	0	0	117.5	Q56	F27-Q56 HydrophobicContact CD1-CB 4.42Å; F27-Q56 HydrophobicContact CE1-CB 4.07Å
28	I	37.6	Very low	30.9	Very low	57 Å²	57	101.1 Å²	101.1	29%	0.292	53%	0.534	S	S	.	.	I	π-helix	trans	-81.2	-34.4	-171.9	-67.3	178.5	0	0	0	112.3	Q30 V52	I28-Q30 PolarHBondContact O-N 2.75Å; I28-V52 HydrophobicContact CG1-CG1 4.33Å; I28-V52 HydrophobicContact CG2-CG1 4.02Å
29	L	37.9	Very low	30.9	Very low	80 Å²	80	106.4 Å²	106.4	42%	0.419	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	-15.3	-164.3	-78.5	163.8	0	0	0	116
30	Q	33.1	Very low	31	Very low	198 Å²	198	103.2 Å²	103.2	93%	0.925	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-5	-177.8	-84.2	-168.4	-15.6	0	0	115.4	I28	I28-Q30 PolarHBondContact O-N 2.75Å
31	S	33.4	Very low	31.1	Very low	48 Å²	48	104.3 Å²	104.3	34%	0.336	57%	0.565	S	S	.	*			trans	-149.4	17.1	-170	53.4	0	0	0	0	116.9	M33 P53	S31-M33 VanDerWaalsContact C-N 3.34Å; S31-M33 PolarHBondContact O-N 3.48Å; S31-P53 VanDerWaalsContact O-CD 3.32Å; S31-P53 WeakPolarHBondContact O-CD 3.42Å; S31-P53 WeakPolarHBondContact O-CG 3.45Å; S31-P53 WeakPolarHBondContact OG-CG 3.44Å
32	A	33.6	Very low	31	Very low	24 Å²	24	104.4 Å²	104.4	20%	0.198	57%	0.565	C	S	.	*			trans	-64.7	93.3	170	0	0	0	0	0	110.4
33	M	28.2	Very low	31.2	Very low	145 Å²	145	104.7 Å²	104.7	71%	0.714	58%	0.58	S	S	*	*			trans	-92.8	123.5	170.2	-85.2	-165.3	165.1	0	0	109.3	S31 V35	S31-M33 VanDerWaalsContact C-N 3.34Å; S31-M33 PolarHBondContact O-N 3.48Å; M33-V35 HydrophobicContact CB-CG2 4.39Å; M33-V35 PolarHBondContact O-N 2.99Å
34	L	30.5	Very low	31.1	Very low	101 Å²	101	107.8 Å²	107.8	53%	0.529	59%	0.591	S	S	.	*			trans	-77.1	99.7	168.5	-145.3	112.3	0	0	0	108.2
35	V	26.9	Very low	30.8	Very low	81 Å²	81	108.9 Å²	108.9	49%	0.491	61%	0.605	S	S	.	*			trans	-93.7	115.1	173.4	-174.2	0	0	0	0	108.6	M33 S37 I51	M33-V35 HydrophobicContact CB-CG2 4.39Å; M33-V35 PolarHBondContact O-N 2.99Å; V35-S37 PolarHBondContact O-N 3.42Å; V35-I51 HydrophobicContact CB-CD1 3.75Å; V35-I51 HydrophobicContact CG2-CD1 4.24Å
36	S	27.6	Very low	30.6	Very low	72 Å²	72	110.6 Å²	110.6	50%	0.503	61%	0.614	S	S	.	*			trans	-65.3	115.8	162.4	61.7	0	0	0	0	108.1	P38	S36-P38 WeakPolarHBondContact O-CD 3.49Å
37	S	27	Very low	30.2	Very low	89 Å²	89	114.8 Å²	114.8	62%	0.622	62%	0.62	S	S	*	*			trans	-52.5	120.6	172.9	172.6	0	0	0	0	109.8	V35 K39	V35-S37 PolarHBondContact O-N 3.42Å; S37-K39 VanDerWaalsContact C-N 3.34Å
38	P	28.1	Very low	30	Very low	116 Å²	116	113 Å²	113	75%	0.753	62%	0.62	S	S	*	*			trans	-83.3	-1.9	-179.5	-13.2	29.9	0	0	0	114.6	S36	S36-P38 WeakPolarHBondContact O-CD 3.49Å
39	K	27.6	Very low	29.8	Very low	190 Å²	190	117.2 Å²	117.2	83%	0.826	63%	0.633	S	S	*	*			trans	-153.1	89	-169.8	-64.8	-174.5	-179	-179.5	0	113.2	S37	S37-K39 VanDerWaalsContact C-N 3.34Å
40	S	27.1	Very low	29.6	Very low	86 Å²	86	116 Å²	116	60%	0.601	63%	0.626	S	S	*	*			trans	-150.6	111.3	148.4	59.5	0	0	0	0	109.3	T42	S40-T42 PolarHBondContact O-N 3.33Å
41	T	29.5	Very low	29.5	Very low	157 Å²	157	110.1 Å²	110.1	96%	0.963	60%	0.601	S	S	*	*			trans	-76.4	34.7	178.9	44.7	0	0	0	0	112.6
42	T	26.3	Very low	29.6	Very low	83 Å²	83	110.5 Å²	110.5	51%	0.509	60%	0.601	S	S	.	*	S	Bend	trans	-120	132.9	-180	49.7	0	0	0	0	108.9	S40 E44	S40-T42 PolarHBondContact O-N 3.33Å; T42-E44 PolarHBondContact O-N 3.38Å
43	T	29.8	Very low	29.5	Very low	152 Å²	152	111.7 Å²	111.7	93%	0.933	61%	0.607	S	S	*	*			trans	-63.6	19.6	-177.8	39.9	0	0	0	0	114.5	L45	T43-L45 PolarHBondContact O-N 3.2Å; T43-L45 VanDerWaalsContact O-N 3.13Å
44	E	28.3	Very low	29.7	Very low	162 Å²	162	108.1 Å²	108.1	76%	0.757	60%	0.595	S	S	*	*			trans	-83.9	87.8	175.2	-73	-171.7	152	0	0	110.2	T42	T42-E44 PolarHBondContact O-N 3.38Å
45	L	28.1	Very low	29.8	Very low	140 Å²	140	115.3 Å²	115.3	73%	0.733	62%	0.615	S	S	*	*			trans	34.3	103.8	144.4	-73.9	152.1	0	0	0	115.8	T43 R47	T43-L45 PolarHBondContact O-N 3.2Å; T43-L45 VanDerWaalsContact O-N 3.13Å; L45-R47 VanDerWaalsContact C-N 3.26Å; L45-R47 PolarHBondContact O-N 3.21Å
46	D	29.1	Very low	30.2	Very low	144 Å²	144	118.4 Å²	118.4	77%	0.77	63%	0.625	S	S	*	*			trans	-42.2	82.5	164.9	-72.3	-49	0	0	0	112.8	C48	D46-C48 PolarHBondContact O-N 3.31Å
47	R	28.3	Very low	30.7	Very low	179 Å²	179	116.8 Å²	116.8	68%	0.675	61%	0.61	S	S	*	*			trans	-81.4	111.6	167.2	-76.4	178	-179.6	-177.6	4.4	106.2	L45 Y49	L45-R47 VanDerWaalsContact C-N 3.26Å; L45-R47 PolarHBondContact O-N 3.21Å; R47-Y49 HydrophobicContact CB-CD2 4.14Å; R47-Y49 HydrophobicContact CB-CE1 4.24Å; R47-Y49 HydrophobicContact CB-CE2 3.53Å; R47-Y49 WeakPolarHBondContact CD-OH 3.35Å; R47-Y49 WeakPolarHBondContact O-CD2 3.24Å; R47-Y49 WeakPolarHBondContact O-CE2 3.42Å; R47-Y49 PolarHBondContact O-N 2.77Å; R47-Y49 VanDerWaalsContact O-N 3.08Å
48	C	32.6	Very low	31.1	Very low	70 Å²	70	116.3 Å²	116.3	47%	0.473	62%	0.619	S	S	.	*			trans	-66.2	106.6	165.9	-70.1	0	0	0	0	107.7	D46	D46-C48 PolarHBondContact O-N 3.31Å
49	Y	32.1	Very low	31.6	Very low	144 Å²	144	116 Å²	116	57%	0.565	60%	0.603	S	S	*	*			trans	-91.2	128.9	172.6	-63.6	-82.4	0	0	0	109.2	R47 I51	R47-Y49 HydrophobicContact CB-CD2 4.14Å; R47-Y49 HydrophobicContact CB-CE1 4.24Å; R47-Y49 HydrophobicContact CB-CE2 3.53Å; R47-Y49 WeakPolarHBondContact CD-OH 3.35Å; R47-Y49 WeakPolarHBondContact O-CD2 3.24Å; R47-Y49 WeakPolarHBondContact O-CE2 3.42Å; R47-Y49 PolarHBondContact O-N 2.77Å; R47-Y49 VanDerWaalsContact O-N 3.08Å; Y49-I51 PolarHBondContact O-N 3.42Å
50	I	34.1	Very low	32.1	Very low	54 Å²	54	110.4 Å²	110.4	28%	0.277	59%	0.586	S	S	.	*			trans	-77.9	107	159.4	-62.9	160.2	0	0	0	105.6	V52 A124	I50-V52 HydrophobicContact CG2-CG2 4.15Å; I50-V52 PolarHBondContact O-N 2.78Å; I50-A124 HydrophobicContact CD1-CB 3.44Å; I50-A124 VanDerWaalsContact CD1-CB 3.44Å; I50-A124 HydrophobicContact CG1-CB 4.21Å; I50-A124 HydrophobicContact CG2-CB 4.5Å
51	I	31.7	Very low	32.7	Very low	75 Å²	75	117 Å²	117	39%	0.385	60%	0.598	S	S	.	*			trans	-83	103.9	173.2	-63.3	165.6	0	0	0	107	V35 Y49 P53	V35-I51 HydrophobicContact CB-CD1 3.75Å; V35-I51 HydrophobicContact CG2-CD1 4.24Å; Y49-I51 PolarHBondContact O-N 3.42Å; I51-P53 WeakPolarHBondContact O-CD 3.35Å
52	V	35.3	Very low	33.3	Very low	57 Å²	57	114 Å²	114	35%	0.345	58%	0.582	S	S	.	*			trans	-81.2	115.5	165.4	-176	0	0	0	0	106.9	I28 I50 C54	I28-V52 HydrophobicContact CG1-CG1 4.33Å; I28-V52 HydrophobicContact CG2-CG1 4.02Å; I50-V52 HydrophobicContact CG2-CG2 4.15Å; I50-V52 PolarHBondContact O-N 2.78Å; V52-C54 PolarHBondContact O-N 3.05Å
53	P	32.3	Very low	33.9	Very low	49 Å²	49	111.8 Å²	111.8	32%	0.318	57%	0.567	S	S	.	*			trans	-64.7	102.9	-178.7	26.5	-34.9	0	0	0	110.5	S31 I51 R55	S31-P53 VanDerWaalsContact O-CD 3.32Å; S31-P53 WeakPolarHBondContact O-CD 3.42Å; S31-P53 WeakPolarHBondContact O-CG 3.45Å; S31-P53 WeakPolarHBondContact OG-CG 3.44Å; I51-P53 WeakPolarHBondContact O-CD 3.35Å; P53-R55 VanDerWaalsContact C-N 3.27Å; P53-R55 PolarHBondContact O-N 3.07Å
54	C	30.5	Very low	34.5	Very low	70 Å²	70	109 Å²	109	47%	0.473	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-74.6	-11.1	-174.4	-174.4	0	0	0	0	113.8	V52 Q56 L57 W59	V52-C54 PolarHBondContact O-N 3.05Å; C54-Q56 VanDerWaalsContact C-N 3.33Å; C54-Q56 PolarHBondContact O-N 2.91Å; C54-L57 PolarHBondContact O-N 2.87Å; C54-W59 PolarHBondContact SG-NE1 2.89Å
55	R	32.7	Very low	35	Very low	252 Å²	252	105.9 Å²	105.9	95%	0.951	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-76.1	-9.6	-168.7	-76.5	-168.8	178.3	-178	0.1	116.1	P53	P53-R55 VanDerWaalsContact C-N 3.27Å; P53-R55 PolarHBondContact O-N 3.07Å
56	Q	35.9	Very low	35.6	Very low	146 Å²	146	103 Å²	103	68%	0.682	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-104.7	-4	172.6	-79.4	-173.8	-13.3	0	0	114	F27 C54 G58	F27-Q56 HydrophobicContact CD1-CB 4.42Å; F27-Q56 HydrophobicContact CE1-CB 4.07Å; C54-Q56 VanDerWaalsContact C-N 3.33Å; C54-Q56 PolarHBondContact O-N 2.91Å; Q56-G58 PolarHBondContact O-N 3.14Å
57	L	37.6	Very low	36.3	Very low	37 Å²	37	102.4 Å²	102.4	19%	0.194	53%	0.525	C	S	.	.			trans	-79.6	104.5	173.4	-79.3	112.3	0	0	0	108.4	C54 W59	C54-L57 PolarHBondContact O-N 2.87Å; L57-W59 HydrophobicContact CB-CD2 4.08Å; L57-W59 HydrophobicContact CB-CG 4.09Å; L57-W59 HydrophobicContact CB-CZ2 4.11Å; L57-W59 HydrophobicContact CD1-CZ2 4.09Å; L57-W59 HydrophobicContact CD2-CD2 4.31Å; L57-W59 HydrophobicContact CD2-CH2 4.13Å; L57-W59 HydrophobicContact CD2-CZ2 3.84Å; L57-W59 HydrophobicContact CD2-CZ3 4.47Å; L57-W59 HydrophobicContact CG-CZ2 4.24Å; L57-W59 PolarHBondContact O-N 3.2Å
58	G	36.5	Very low	36.9	Very low	79 Å²	79	104.2 Å²	104.2	81%	0.814	53%	0.532	S	S	*	.			trans	-67.8	76.8	161	0	0	0	0	0	108.9	Q56 P60	Q56-G58 PolarHBondContact O-N 3.14Å; G58-P60 WeakPolarHBondContact O-CD 3.29Å
59	W	39.4	Very low	37.5	Very low	109 Å²	109	108.7 Å²	108.7	41%	0.413	54%	0.544	S	S	.	.			trans	-62	125.5	-175.6	-62.5	85.6	0	0	0	110.2	C54 L57 R61 L63	C54-W59 PolarHBondContact SG-NE1 2.89Å; L57-W59 HydrophobicContact CB-CD2 4.08Å; L57-W59 HydrophobicContact CB-CG 4.09Å; L57-W59 HydrophobicContact CB-CZ2 4.11Å; L57-W59 HydrophobicContact CD1-CZ2 4.09Å; L57-W59 HydrophobicContact CD2-CD2 4.31Å; L57-W59 HydrophobicContact CD2-CH2 4.13Å; L57-W59 HydrophobicContact CD2-CZ2 3.84Å; L57-W59 HydrophobicContact CD2-CZ3 4.47Å; L57-W59 HydrophobicContact CG-CZ2 4.24Å; L57-W59 PolarHBondContact O-N 3.2Å; W59-R61 PolarHBondContact O-N 3.05Å; W59-L63 HydrophobicContact CE3-CB 3.62Å; W59-L63 HydrophobicContact CE3-CD1 4.23Å; W59-L63 HydrophobicContact CE3-CD2 4.22Å; W59-L63 HydrophobicContact CE3-CG 4.24Å; W59-L63 HydrophobicContact CZ3-CB 4.17Å; W59-L63 HydrophobicContact CZ3-CD2 4.03Å
60	P	37.7	Very low	38	Very low	74 Å²	74	109.7 Å²	109.7	48%	0.481	55%	0.547	S	S	.	.			trans	-56.3	133.4	160.4	-19.9	31.1	0	0	0	108.5	G58 C62 L63	G58-P60 WeakPolarHBondContact O-CD 3.29Å; P60-C62 PolarHBondContact O-N 3.05Å; P60-L63 HydrophobicContact CG-CD1 4.14Å; P60-L63 PolarHBondContact O-N 2.9Å
61	R	39.6	Very low	38.6	Very low	224 Å²	224	110.4 Å²	110.4	85%	0.845	55%	0.547	S	S	*	.	H	α-helix	trans	-51.4	-20.1	178.9	-82.9	-178.2	172.9	-166.9	-1.7	114	W59 L63 S64	W59-R61 PolarHBondContact O-N 3.05Å; R61-L63 VanDerWaalsContact C-N 3.29Å; R61-L63 PolarHBondContact O-N 3.08Å; R61-S64 PolarHBondContact O-N 2.77Å; R61-S64 PolarHBondContact O-OG 2.83Å
62	C	41.1	Very low	39.5	Very low	93 Å²	93	112.1 Å²	112.1	63%	0.628	56%	0.556	S	S	*	*	H	α-helix	trans	-66.7	-27.5	174.8	61.2	0	0	0	0	113.5	P60 C65 M66	P60-C62 PolarHBondContact O-N 3.05Å; C62-C65 WeakPolarHBondContact O-CB 3.39Å; C62-C65 PolarHBondContact O-N 2.79Å; C62-M66 PolarHBondContact O-N 3.17Å
63	L	38.7	Very low	40.1	Very low	37 Å²	37	113 Å²	113	19%	0.194	56%	0.557	C	S	.	*	H	α-helix	trans	-79.5	-26.9	178.6	-85.1	141.9	0	0	0	113.5	W59 P60 R61 C65 M66 W71	W59-L63 HydrophobicContact CE3-CB 3.62Å; W59-L63 HydrophobicContact CE3-CD1 4.23Å; W59-L63 HydrophobicContact CE3-CD2 4.22Å; W59-L63 HydrophobicContact CE3-CG 4.24Å; W59-L63 HydrophobicContact CZ3-CB 4.17Å; W59-L63 HydrophobicContact CZ3-CD2 4.03Å; P60-L63 HydrophobicContact CG-CD1 4.14Å; P60-L63 PolarHBondContact O-N 2.9Å; R61-L63 VanDerWaalsContact C-N 3.29Å; R61-L63 PolarHBondContact O-N 3.08Å; L63-C65 PolarHBondContact O-N 3.09Å; L63-M66 HydrophobicContact CD2-CE 3.38Å; L63-M66 HydrophobicContact CG-CE 4.32Å; L63-M66 PolarHBondContact O-N 3.29Å; L63-W71 HydrophobicContact CD2-CH2 4.46Å; L63-W71 HydrophobicContact CD2-CZ2 3.3Å
64	S	42.4	Very low	40.9	Very low	93 Å²	93	114 Å²	114	65%	0.65	56%	0.558	S	S	*	*	H	α-helix	trans	-65.6	-22.7	167.2	37.9	0	0	0	0	112.7	R61	R61-S64 PolarHBondContact O-N 2.77Å; R61-S64 PolarHBondContact O-OG 2.83Å
65	C	40.4	Very low	41.8	Very low	98 Å²	98	114.1 Å²	114.1	66%	0.662	55%	0.554	S	S	*	*	H	α-helix	trans	-86.2	-16.8	176.1	-67.5	0	0	0	0	113.5	C62 L63 H67	C62-C65 WeakPolarHBondContact O-CB 3.39Å; C62-C65 PolarHBondContact O-N 2.79Å; L63-C65 PolarHBondContact O-N 3.09Å; C65-H67 VanDerWaalsContact C-N 3.34Å; C65-H67 PolarHBondContact O-N 3.29Å
66	M	40	Very low	42.4	Very low	78 Å²	78	110.1 Å²	110.1	38%	0.384	54%	0.539	S	S	.	.	S	Bend	trans	-62.8	105.6	166.6	-110.8	-157.6	-78.2	0	0	106.3	C62 L63 R68 W71	C62-M66 PolarHBondContact O-N 3.17Å; L63-M66 HydrophobicContact CD2-CE 3.38Å; L63-M66 HydrophobicContact CG-CE 4.32Å; L63-M66 PolarHBondContact O-N 3.29Å; M66-R68 PolarHBondContact O-N 2.9Å; M66-R68 VanDerWaalsContact O-N 3.16Å; M66-W71 VanDerWaalsContact CB-CD1 3.46Å; M66-W71 VanDerWaalsContact CE-CE2 3.41Å; M66-W71 HydrophobicContact CE-CZ2 3.43Å; M66-W71 VanDerWaalsContact CE-CZ2 3.43Å; M66-W71 HydrophobicContact SD-CZ2 4.42Å
67	H	43.8	Very low	43	Very low	133 Å²	133	108 Å²	108	62%	0.616	54%	0.536	S	S	*	.			trans	-41.5	129.4	-176.7	-87.2	-167.1	0	0	0	108.4	C65 F69 Y70 W71	C65-H67 VanDerWaalsContact C-N 3.34Å; C65-H67 PolarHBondContact O-N 3.29Å; H67-F69 HydrophobicContact CB-CB 4.35Å; H67-F69 CarbonylContact O-C 3.54Å; H67-F69 PolarHBondContact O-N 3.12Å; H67-Y70 HydrophobicContact CB-CD2 3.91Å; H67-Y70 HydrophobicContact CB-CE2 4.49Å; H67-Y70 PolarHBondContact O-N 3.39Å; H67-W71 PolarHBondContact O-N 2.81Å
68	R	41.1	Very low	43.5	Very low	217 Å²	217	111.4 Å²	111.4	82%	0.819	55%	0.554	S	S	*	*	H	α-helix	trans	-39.7	-31.8	173.3	-149.6	175.2	-171.5	-166.9	1.8	112.1	M66 L72	M66-R68 PolarHBondContact O-N 2.9Å; M66-R68 VanDerWaalsContact O-N 3.16Å; R68-L72 WeakPolarHBondContact O-CB 3.47Å; R68-L72 VanDerWaalsContact O-CD1 3.32Å; R68-L72 WeakPolarHBondContact O-CD1 3.07Å; R68-L72 WeakPolarHBondContact O-CG 3.41Å; R68-L72 PolarHBondContact O-N 3.46Å; R68-L72 VanDerWaalsContact O-N 3.12Å
69	F	44.6	Very low	44.4	Very low	164 Å²	164	110.3 Å²	110.3	72%	0.719	53%	0.529	S	S	*	.	H	α-helix	trans	-62.9	-51.7	171.9	-111.2	-87.3	0	0	0	115.8	H67 W71 L72 E73	H67-F69 HydrophobicContact CB-CB 4.35Å; H67-F69 CarbonylContact O-C 3.54Å; H67-F69 PolarHBondContact O-N 3.12Å; F69-W71 PolarHBondContact O-N 3.12Å; F69-L72 PolarHBondContact O-N 3.07Å; F69-E73 WeakPolarHBondContact O-CB 3.31Å; F69-E73 PolarHBondContact O-N 3.48Å
70	Y	43	Very low	45.4	Very low	164 Å²	164	110.9 Å²	110.9	64%	0.643	54%	0.536	S	S	*	.	H	α-helix	trans	-65.5	-40	-179.4	-74.7	-67.4	0	0	0	111.4	H67 E73 L74	H67-Y70 HydrophobicContact CB-CD2 3.91Å; H67-Y70 HydrophobicContact CB-CE2 4.49Å; H67-Y70 PolarHBondContact O-N 3.39Å; Y70-E73 PolarHBondContact O-N 3.38Å; Y70-L74 WeakPolarHBondContact O-CB 3.45Å; Y70-L74 PolarHBondContact O-N 3.4Å
71	W	47.1	Very low	46.7	Very low	69 Å²	69	110.3 Å²	110.3	26%	0.261	53%	0.533	S	S	.	.	H	α-helix	trans	-63.2	-43.3	174.8	-95	115.3	0	0	0	112.6	L63 M66 H67 F69 L74 I75	L63-W71 HydrophobicContact CD2-CH2 4.46Å; L63-W71 HydrophobicContact CD2-CZ2 3.3Å; M66-W71 VanDerWaalsContact CB-CD1 3.46Å; M66-W71 VanDerWaalsContact CE-CE2 3.41Å; M66-W71 HydrophobicContact CE-CZ2 3.43Å; M66-W71 VanDerWaalsContact CE-CZ2 3.43Å; M66-W71 HydrophobicContact SD-CZ2 4.42Å; H67-W71 PolarHBondContact O-N 2.81Å; F69-W71 PolarHBondContact O-N 3.12Å; W71-L74 HydrophobicContact CE3-CD2 4.2Å; W71-L74 HydrophobicContact CZ3-CD2 3.95Å; W71-L74 PolarHBondContact O-N 3.21Å; W71-I75 HydrophobicContact CE3-CD1 4.16Å; W71-I75 HydrophobicContact CE3-CG1 4.25Å; W71-I75 WeakPolarHBondContact O-CB 3.31Å; W71-I75 WeakPolarHBondContact O-CG1 3.23Å; W71-I75 PolarHBondContact O-N 3.21Å
72	L	49	Very low	48	Very low	111 Å²	111	102.2 Å²	102.2	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-42.4	177.1	-76.7	169	0	0	0	111.2	R68 F69 R76	R68-L72 WeakPolarHBondContact O-CB 3.47Å; R68-L72 VanDerWaalsContact O-CD1 3.32Å; R68-L72 WeakPolarHBondContact O-CD1 3.07Å; R68-L72 WeakPolarHBondContact O-CG 3.41Å; R68-L72 PolarHBondContact O-N 3.46Å; R68-L72 VanDerWaalsContact O-N 3.12Å; F69-L72 PolarHBondContact O-N 3.07Å; L72-R76 WeakPolarHBondContact O-CB 3.36Å; L72-R76 PolarHBondContact O-N 3.42Å
73	E	49.6	Very low	49.5	Very low	77 Å²	77	100.1 Å²	100.1	36%	0.36	49%	0.486	S	S	.	.	H	α-helix	trans	-72.6	-36.1	179.4	-161.1	59.7	-158.3	0	0	111.9	F69 Y70 R76 T77	F69-E73 WeakPolarHBondContact O-CB 3.31Å; F69-E73 PolarHBondContact O-N 3.48Å; Y70-E73 PolarHBondContact O-N 3.38Å; E73-R76 PolarHBondContact O-N 3.31Å; E73-R76 IonicContact OE1-CZ 2.79Å; E73-R76 VanDerWaalsContact OE1-CZ 3.29Å; E73-R76 IonicContact OE1-NE 3.34Å; E73-R76 PolarHBondContact OE1-NE 3.36Å; E73-R76 IonicContact OE1-NH2 2.88Å; E73-R76 PolarHBondContact OE1-NH2 3.29Å; E73-R76 IonicContact OE2-CZ 2.68Å; E73-R76 IonicContact OE2-NE 2.71Å; E73-R76 PolarHBondContact OE2-NE 3.27Å; E73-T77 WeakPolarHBondContact O-CB 3.29Å; E73-T77 PolarHBondContact O-N 3.03Å; E73-T77 PolarHBondContact O-OG1 3.38Å
74	L	48.2	Very low	51	Low	68 Å²	68	99 Å²	99	36%	0.356	48%	0.48	S	S	.	.	H	α-helix	trans	-64.9	-44.4	174.2	-167.8	117.2	0	0	0	110.5	Y70 W71 T77 L78	Y70-L74 WeakPolarHBondContact O-CB 3.45Å; Y70-L74 PolarHBondContact O-N 3.4Å; W71-L74 HydrophobicContact CE3-CD2 4.2Å; W71-L74 HydrophobicContact CZ3-CD2 3.95Å; W71-L74 PolarHBondContact O-N 3.21Å; L74-T77 PolarHBondContact O-N 2.85Å; L74-L78 HydrophobicContact CD1-CD1 4.32Å; L74-L78 HydrophobicContact CD2-CD1 3.41Å; L74-L78 VanDerWaalsContact CD2-CD1 3.41Å; L74-L78 HydrophobicContact CD2-CG 4.48Å; L74-L78 HydrophobicContact CG-CD1 3.51Å; L74-L78 HydrophobicContact CG-CG 4.13Å; L74-L78 WeakPolarHBondContact O-CA 3.32Å; L74-L78 WeakPolarHBondContact O-CB 3.3Å; L74-L78 WeakPolarHBondContact O-CG 3.4Å; L74-L78 PolarHBondContact O-N 2.89Å
75	I	49.8	Very low	52.2	Low	74 Å²	74	100.9 Å²	100.9	38%	0.379	48%	0.477	S	S	.	.	H	α-helix	trans	-63.6	-42.2	172.3	-70.6	167.7	0	0	0	110.5	W71 T77 L79	W71-I75 HydrophobicContact CE3-CD1 4.16Å; W71-I75 HydrophobicContact CE3-CG1 4.25Å; W71-I75 WeakPolarHBondContact O-CB 3.31Å; W71-I75 WeakPolarHBondContact O-CG1 3.23Å; W71-I75 PolarHBondContact O-N 3.21Å; I75-T77 VanDerWaalsContact C-N 3.33Å; I75-T77 PolarHBondContact O-N 2.88Å; I75-L79 HydrophobicContact CG2-CB 4.45Å; I75-L79 HydrophobicContact CG2-CD1 4.35Å; I75-L79 CarbonylContact O-C 3.5Å; I75-L79 VanDerWaalsContact O-CA 3.26Å; I75-L79 WeakPolarHBondContact O-CA 3.39Å; I75-L79 VanDerWaalsContact O-CB 3.27Å; I75-L79 WeakPolarHBondContact O-CB 3.43Å; I75-L79 PolarHBondContact O-N 3.28Å
76	R	46.1	Very low	53.4	Low	167 Å²	167	100.4 Å²	100.4	63%	0.63	47%	0.465	S	S	*	.	H	α-helix	trans	-65.5	-37.2	179.6	-162	-178.9	84	86.7	5.1	112.3	L72 E73	L72-R76 WeakPolarHBondContact O-CB 3.36Å; L72-R76 PolarHBondContact O-N 3.42Å; E73-R76 PolarHBondContact O-N 3.31Å; E73-R76 IonicContact OE1-CZ 2.79Å; E73-R76 VanDerWaalsContact OE1-CZ 3.29Å; E73-R76 IonicContact OE1-NE 3.34Å; E73-R76 PolarHBondContact OE1-NE 3.36Å; E73-R76 IonicContact OE1-NH2 2.88Å; E73-R76 PolarHBondContact OE1-NH2 3.29Å; E73-R76 IonicContact OE2-CZ 2.68Å; E73-R76 IonicContact OE2-NE 2.71Å; E73-R76 PolarHBondContact OE2-NE 3.27Å
77	T	46.9	Very low	54.8	Low	101 Å²	101	104.4 Å²	104.4	62%	0.62	48%	0.482	S	S	*	.	H	α-helix	trans	-80.9	-41.8	-178.9	-51.3	0	0	0	0	111.1	E73 L74 I75	E73-T77 WeakPolarHBondContact O-CB 3.29Å; E73-T77 PolarHBondContact O-N 3.03Å; E73-T77 PolarHBondContact O-OG1 3.38Å; L74-T77 PolarHBondContact O-N 2.85Å; I75-T77 VanDerWaalsContact C-N 3.33Å; I75-T77 PolarHBondContact O-N 2.88Å
78	L	49	Very low	56.3	Low	109 Å²	109	99.5 Å²	99.5	57%	0.571	46%	0.463	S	S	*	.	H	α-helix	trans	-80.6	-39.2	-179.2	-67	176.8	0	0	0	112.8	L74	L74-L78 HydrophobicContact CD1-CD1 4.32Å; L74-L78 HydrophobicContact CD2-CD1 3.41Å; L74-L78 VanDerWaalsContact CD2-CD1 3.41Å; L74-L78 HydrophobicContact CD2-CG 4.48Å; L74-L78 HydrophobicContact CG-CD1 3.51Å; L74-L78 HydrophobicContact CG-CG 4.13Å; L74-L78 WeakPolarHBondContact O-CA 3.32Å; L74-L78 WeakPolarHBondContact O-CB 3.3Å; L74-L78 WeakPolarHBondContact O-CG 3.4Å; L74-L78 PolarHBondContact O-N 2.89Å
79	L	55.3	Low	58.1	Low	56 Å²	56	89.6 Å²	89.6	29%	0.293	43%	0.426	S	S	.	.	S	Bend	trans	-115.6	66.1	-176.7	-61.1	172.9	0	0	0	109.4	W24 I75 C81	W24-L79 HydrophobicContact CH2-CD2 4.29Å; I75-L79 HydrophobicContact CG2-CB 4.45Å; I75-L79 HydrophobicContact CG2-CD1 4.35Å; I75-L79 CarbonylContact O-C 3.5Å; I75-L79 VanDerWaalsContact O-CA 3.26Å; I75-L79 WeakPolarHBondContact O-CA 3.39Å; I75-L79 VanDerWaalsContact O-CB 3.27Å; I75-L79 WeakPolarHBondContact O-CB 3.43Å; I75-L79 PolarHBondContact O-N 3.28Å; L79-C81 PolarHBondContact O-N 3.18Å; L79-C81 VanDerWaalsContact O-N 3.1Å
80	Q	60.9	Low	60	Low	121 Å²	121	83.9 Å²	83.9	57%	0.565	40%	0.403	S	S	*	.			trans	-51.8	125.2	166.1	-168	-175.4	36.2	0	0	108	L82 H123	Q80-L82 HydrophobicContact CB-CD2 4.02Å; Q80-L82 HydrophobicContact CG-CD2 4.36Å; Q80-L82 WeakPolarHBondContact O-CD2 3.15Å; Q80-L82 PolarHBondContact O-N 3.45Å; Q80-L82 VanDerWaalsContact O-N 3.12Å; Q80-H123 PolarHBondContact O-NE2 3.11Å
81	C	63.9	Low	62	Low	62 Å²	62	80.5 Å²	80.5	42%	0.419	39%	0.393	S	S	.	.			trans	-68.1	114.8	173.8	-172.8	0	0	0	0	107.8	L79	L79-C81 PolarHBondContact O-N 3.18Å; L79-C81 VanDerWaalsContact O-N 3.1Å
82	L	67.6	Low	63.8	Low	54 Å²	54	80 Å²	80	28%	0.283	39%	0.393	S	S	.	.			trans	-88.6	-13.3	-179.8	-42.3	-173.8	0	0	0	111.7	Q80 H123	Q80-L82 HydrophobicContact CB-CD2 4.02Å; Q80-L82 HydrophobicContact CG-CD2 4.36Å; Q80-L82 WeakPolarHBondContact O-CD2 3.15Å; Q80-L82 PolarHBondContact O-N 3.45Å; Q80-L82 VanDerWaalsContact O-N 3.12Å; L82-H123 VanDerWaalsContact CG-CD2 3.42Å; L82-H123 WeakPolarHBondContact CG-CD2 3.37Å; L82-H123 PolarHBondContact N-NE2 3.46Å
83	Y	72.2	Confident	65.8	Low	50 Å²	50	74.8 Å²	74.8	20%	0.196	37%	0.366	C	S	.	.	S	Bend	trans	-70.2	130.3	-179.7	-176.1	-104.5	0	0	0	110.4	M121 I128 L130	Y83-M121 HydrophobicContact CD2-SD 4.47Å; Y83-I128 HydrophobicContact CD2-CB 3.96Å; Y83-I128 HydrophobicContact CD2-CD1 3.74Å; Y83-I128 HydrophobicContact CD2-CG1 4.46Å; Y83-I128 HydrophobicContact CD2-CG2 3.5Å; Y83-I128 VanDerWaalsContact CD2-CG2 3.5Å; Y83-I128 HydrophobicContact CE1-CG2 4.44Å; Y83-I128 HydrophobicContact CE2-CB 4.05Å; Y83-I128 HydrophobicContact CE2-CG2 3.17Å; Y83-I128 HydrophobicContact CG-CD1 3.85Å; Y83-I128 HydrophobicContact CG-CG2 4.28Å; Y83-L130 HydrophobicContact CD2-CD2 4.16Å; Y83-L130 HydrophobicContact CE2-CD2 3.62Å
84	P	71.1	Confident	67.8	Low	12 Å²	12	71.1 Å²	71.1	8%	0.078	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-65.9	153.4	178.5	30.4	-39.1	0	0	0	111.6	L89 F92	P84-L89 HydrophobicContact CG-CB 4.5Å; P84-L89 HydrophobicContact CG-CD1 3.61Å; P84-F92 HydrophobicContact CB-CB 3.62Å; P84-F92 HydrophobicContact CB-CD1 4.35Å; P84-F92 HydrophobicContact CB-CD2 3.96Å; P84-F92 HydrophobicContact CB-CG 3.7Å; P84-F92 HydrophobicContact CG-CB 3.77Å; P84-F92 HydrophobicContact CG-CD1 3.66Å; P84-F92 HydrophobicContact CG-CD2 4.07Å; P84-F92 HydrophobicContact CG-CE1 4.33Å; P84-F92 HydrophobicContact CG-CG 3.53Å
85	K	67.1	Low	69.7	Low	133 Å²	133	74 Å²	74	58%	0.578	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-65	152.5	166.2	-61.3	-176.5	-177.6	177.3	0	109.6	H87 S88 L89	K85-H87 VanDerWaalsContact C-N 3.33Å; K85-H87 PolarHBondContact O-N 3.44Å; K85-S88 PolarHBondContact N-OG 3.26Å; K85-S88 CarbonylContact O-C 3.6Å; K85-S88 WeakPolarHBondContact O-CA 3.37Å; K85-S88 PolarHBondContact O-N 3.02Å; K85-S88 PolarHBondContact O-OG 2.7Å; K85-L89 PolarHBondContact O-N 2.93Å; K85-L89 VanDerWaalsContact O-N 3.1Å
86	E	65.8	Low	71.7	Confident	89 Å²	89	71.9 Å²	71.9	42%	0.416	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-52.8	-47.2	-175.4	-167.3	-174.9	-176.2	0	0	112.6	S88 L89 K153	E86-S88 PolarHBondContact O-N 3.13Å; E86-L89 VanDerWaalsContact O-CB 3.31Å; E86-L89 WeakPolarHBondContact O-CB 3.47Å; E86-L89 PolarHBondContact O-N 3.4Å; E86-L89 VanDerWaalsContact O-N 3.15Å; E86-K153 WeakPolarHBondContact OE1-CE 3.45Å; E86-K153 IonicContact OE1-NZ 2.83Å; E86-K153 PolarHBondContact OE1-NZ 3.07Å; E86-K153 IonicContact OE2-NZ 2.97Å; E86-K153 PolarHBondContact OE2-NZ 2.83Å
87	H	69	Low	73.8	Confident	161 Å²	161	64.6 Å²	64.6	75%	0.745	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-66.7	-19	178.6	60.5	-95.1	0	0	0	114.1	K85	K85-H87 VanDerWaalsContact C-N 3.33Å; K85-H87 PolarHBondContact O-N 3.44Å
88	S	75	Confident	75.4	Confident	31 Å²	31	66.4 Å²	66.4	22%	0.217	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-98.6	-2.3	177.4	63.2	0	0	0	0	113.3	K85 E86 L90 Q91 F92	K85-S88 PolarHBondContact N-OG 3.26Å; K85-S88 CarbonylContact O-C 3.6Å; K85-S88 WeakPolarHBondContact O-CA 3.37Å; K85-S88 PolarHBondContact O-N 3.02Å; K85-S88 PolarHBondContact O-OG 2.7Å; E86-S88 PolarHBondContact O-N 3.13Å; S88-L90 PolarHBondContact O-N 3.42Å; S88-Q91 PolarHBondContact O-N 3.01Å; S88-F92 WeakPolarHBondContact O-CB 3.37Å; S88-F92 PolarHBondContact O-N 3.15Å
89	L	79.3	Confident	77.1	Confident	8 Å²	8	66.3 Å²	66.3	4%	0.042	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-43.5	-173.7	179.2	63.2	0	0	0	111.9	P84 K85 E86 Q91 F92 V93 L130 L147	P84-L89 HydrophobicContact CG-CB 4.5Å; P84-L89 HydrophobicContact CG-CD1 3.61Å; K85-L89 PolarHBondContact O-N 2.93Å; K85-L89 VanDerWaalsContact O-N 3.1Å; E86-L89 VanDerWaalsContact O-CB 3.31Å; E86-L89 WeakPolarHBondContact O-CB 3.47Å; E86-L89 PolarHBondContact O-N 3.4Å; E86-L89 VanDerWaalsContact O-N 3.15Å; L89-Q91 PolarHBondContact O-N 2.9Å; L89-F92 WeakPolarHBondContact O-CB 3.02Å; L89-F92 PolarHBondContact O-N 2.99Å; L89-V93 HydrophobicContact CD1-CG1 4.14Å; L89-V93 PolarHBondContact O-N 2.72Å; L89-L130 HydrophobicContact CD1-CD2 3.67Å; L89-L147 HydrophobicContact CD2-CD2 4.27Å; L89-L147 HydrophobicContact CG-CD2 4.03Å
90	L	84	Confident	78.8	Confident	44 Å²	44	66.4 Å²	66.4	23%	0.23	32%	0.321	C	S	.	.	H	α-helix	trans	-57	-50.5	176.2	178.8	62.9	0	0	0	111	S88 F92 V93 C94 L147 V192 Q210 A213	S88-L90 PolarHBondContact O-N 3.42Å; L90-F92 VanDerWaalsContact C-N 3.29Å; L90-F92 PolarHBondContact O-N 2.93Å; L90-V93 VanDerWaalsContact O-CG2 3.26Å; L90-V93 WeakPolarHBondContact O-CG2 3.14Å; L90-V93 PolarHBondContact O-N 3.44Å; L90-C94 WeakPolarHBondContact O-CB 3.32Å; L90-C94 PolarHBondContact O-N 2.81Å; L90-C94 VanDerWaalsContact O-N 3.08Å; L90-C94 PolarHBondContact O-SG 2.95Å; L90-L147 HydrophobicContact CB-CD1 3.86Å; L90-L147 HydrophobicContact CD1-CD1 3.85Å; L90-L147 HydrophobicContact CD1-CG 4.48Å; L90-L147 HydrophobicContact CG-CD1 4.41Å; L90-V192 HydrophobicContact CD1-CG1 4.49Å; L90-V192 HydrophobicContact CD1-CG2 4.38Å; L90-Q210 HydrophobicContact CD1-CG 4Å; L90-A213 HydrophobicContact CG-CB 4.45Å
91	Q	85	Confident	80.4	Confident	93 Å²	93	61.2 Å²	61.2	44%	0.435	30%	0.296	S	S	.	.	H	α-helix	trans	-64.4	-36.3	-179.6	-170.6	166	50.8	0	0	111.9	S88 L89 C94 R95	S88-Q91 PolarHBondContact O-N 3.01Å; L89-Q91 PolarHBondContact O-N 2.9Å; Q91-C94 PolarHBondContact O-N 2.98Å; Q91-R95 VanDerWaalsContact CD-CZ 3.46Å; Q91-R95 VanDerWaalsContact CD-NH1 3.27Å; Q91-R95 HydrophobicContact CG-CG 4.37Å; Q91-R95 VanDerWaalsContact NE2-NH1 3.19Å; Q91-R95 WeakPolarHBondContact O-CB 3.22Å; Q91-R95 WeakPolarHBondContact O-CG 3.49Å; Q91-R95 PolarHBondContact O-N 2.72Å; Q91-R95 VanDerWaalsContact O-N 3.16Å
92	F	84.9	Confident	81.8	Confident	60 Å²	60	63.6 Å²	63.6	26%	0.263	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-43.8	175.8	177.2	-91.9	0	0	0	112.5	P84 S88 L89 L90 F101 M121 L130 P415	P84-F92 HydrophobicContact CB-CB 3.62Å; P84-F92 HydrophobicContact CB-CD1 4.35Å; P84-F92 HydrophobicContact CB-CD2 3.96Å; P84-F92 HydrophobicContact CB-CG 3.7Å; P84-F92 HydrophobicContact CG-CB 3.77Å; P84-F92 HydrophobicContact CG-CD1 3.66Å; P84-F92 HydrophobicContact CG-CD2 4.07Å; P84-F92 HydrophobicContact CG-CE1 4.33Å; P84-F92 HydrophobicContact CG-CG 3.53Å; S88-F92 WeakPolarHBondContact O-CB 3.37Å; S88-F92 PolarHBondContact O-N 3.15Å; L89-F92 WeakPolarHBondContact O-CB 3.02Å; L89-F92 PolarHBondContact O-N 2.99Å; L90-F92 VanDerWaalsContact C-N 3.29Å; L90-F92 PolarHBondContact O-N 2.93Å; F92-F101 HydrophobicContact CE1-CE2 4.16Å; F92-F101 HydrophobicContact CZ-CD2 4.33Å; F92-F101 HydrophobicContact CZ-CE2 4.27Å; F92-M121 HydrophobicContact CE1-CE 3.48Å; F92-M121 VanDerWaalsContact CE1-CE 3.48Å; F92-M121 HydrophobicContact CE2-CE 4.16Å; F92-M121 HydrophobicContact CZ-CE 3.17Å; F92-L130 HydrophobicContact CE1-CD1 3.88Å; F92-P415 HydrophobicContact CE1-CG 4.25Å
93	V	91.6	Very high	83.1	Confident	0 Å²	0	61 Å²	61	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-78.4	-21.3	-178.9	-57.8	0	0	0	0	113.6	L89 L90 L130 L131 L147 P415 V416	L89-V93 HydrophobicContact CD1-CG1 4.14Å; L89-V93 PolarHBondContact O-N 2.72Å; L90-V93 VanDerWaalsContact O-CG2 3.26Å; L90-V93 WeakPolarHBondContact O-CG2 3.14Å; L90-V93 PolarHBondContact O-N 3.44Å; V93-L130 HydrophobicContact CG1-CB 4.34Å; V93-L131 HydrophobicContact CB-CD1 4.44Å; V93-L131 HydrophobicContact CB-CD2 4.21Å; V93-L131 HydrophobicContact CB-CG 4.5Å; V93-L131 HydrophobicContact CG1-CD2 4.21Å; V93-L131 HydrophobicContact CG1-CG 4.26Å; V93-L131 HydrophobicContact CG2-CD2 4.13Å; V93-L147 HydrophobicContact CB-CD2 4.45Å; V93-L147 HydrophobicContact CG1-CD2 4.18Å; V93-L147 HydrophobicContact CG2-CD2 3.49Å; V93-L147 VanDerWaalsContact CG2-CD2 3.49Å; V93-P415 HydrophobicContact CB-CB 4.15Å; V93-P415 HydrophobicContact CG1-CB 4.39Å; V93-P415 VanDerWaalsContact O-CD 3.31Å; V93-P415 WeakPolarHBondContact O-CD 3.41Å; V93-V416 HydrophobicContact CB-CG2 3.95Å; V93-V416 HydrophobicContact CG2-CG2 3.86Å; V93-V416 VanDerWaalsContact O-CG2 3.22Å; V93-V416 WeakPolarHBondContact O-CG2 3.18Å; V93-V416 PolarHBondContact O-N 2.81Å
94	C	90.6	Very high	84.2	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.007	28%	0.276	C	S	.	.	H	α-helix	trans	-89.9	-25.3	-177.3	-64.4	0	0	0	0	113.4	L90 Q91 A213 L214 P242 S414	L90-C94 WeakPolarHBondContact O-CB 3.32Å; L90-C94 PolarHBondContact O-N 2.81Å; L90-C94 VanDerWaalsContact O-N 3.08Å; L90-C94 PolarHBondContact O-SG 2.95Å; Q91-C94 PolarHBondContact O-N 2.98Å; C94-A213 HydrophobicContact CB-CB 4.09Å; C94-L214 HydrophobicContact CB-CD1 4.29Å; C94-L214 HydrophobicContact CB-CD2 3.65Å; C94-L214 HydrophobicContact CB-CG 3.76Å; C94-L214 VanDerWaalsContact SG-CD1 3.55Å; C94-L214 VanDerWaalsContact SG-CG 3.59Å; C94-P242 VanDerWaalsContact O-CB 3.31Å; C94-P242 WeakPolarHBondContact O-CB 3.22Å; C94-S414 VanDerWaalsContact O-CB 3.31Å; C94-S414 WeakPolarHBondContact O-CB 3.28Å
95	R	89.4	Confident	85.4	Confident	129 Å²	129	58.2 Å²	58.2	49%	0.487	27%	0.272	S	S	.	.	S	Bend	trans	-89.7	156.2	-178.9	-74.1	-175.6	172	167.4	-4.9	113	Q91 S414 P415	Q91-R95 VanDerWaalsContact CD-CZ 3.46Å; Q91-R95 VanDerWaalsContact CD-NH1 3.27Å; Q91-R95 HydrophobicContact CG-CG 4.37Å; Q91-R95 VanDerWaalsContact NE2-NH1 3.19Å; Q91-R95 WeakPolarHBondContact O-CB 3.22Å; Q91-R95 WeakPolarHBondContact O-CG 3.49Å; Q91-R95 PolarHBondContact O-N 2.72Å; Q91-R95 VanDerWaalsContact O-N 3.16Å; R95-S414 VanDerWaalsContact O-CA 3.26Å; R95-S414 WeakPolarHBondContact O-CA 3.44Å; R95-S414 WeakPolarHBondContact O-CB 3.46Å; R95-P415 WeakPolarHBondContact O-CD 3.19Å
96	P	92.1	Very high	86.6	Confident	29 Å²	29	53.4 Å²	53.4	19%	0.188	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-57	142	174.1	-20.5	34.2	0	0	0	110.4	T98 P242 A411 F413	P96-T98 PolarHBondContact O-N 2.81Å; P96-P242 VanDerWaalsContact CD-CG 3.49Å; P96-P242 HydrophobicContact CG-CG 3.48Å; P96-P242 VanDerWaalsContact CG-CG 3.48Å; P96-A411 HydrophobicContact CB-CB 4.4Å; P96-F413 WeakPolarHBondContact CA-O 3.41Å
97	A	89	Confident	88	Confident	14 Å²	14	51.1 Å²	51.1	12%	0.116	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-65.3	120.7	177.8	0	0	0	0	0	110.2	R99 F409 A411 F413	A97-R99 WeakPolarHBondContact CB-O 3.34Å; A97-R99 PolarHBondContact O-N 2.78Å; A97-F409 HydrophobicContact CB-CD2 4.12Å; A97-F409 HydrophobicContact CB-CE2 3.9Å; A97-A411 PolarHBondContact O-N 3.39Å; A97-F413 PolarHBondContact N-O 3.33Å
98	T	81.8	Confident	88.8	Confident	138 Å²	138	45.7 Å²	45.7	85%	0.847	22%	0.22	S	C	*	.	S	Bend	trans	-68.8	-12.9	-179	55.2	0	0	0	0	113.7	P96	P96-T98 PolarHBondContact O-N 2.81Å
99	R	83.7	Confident	89.1	Confident	107 Å²	107	46.7 Å²	46.7	40%	0.404	24%	0.236	S	C	.	.	S	Bend	trans	-154.2	171.2	176.7	55.6	177.5	164.1	-145.9	-11	108.5	A97 F101	A97-R99 WeakPolarHBondContact CB-O 3.34Å; A97-R99 PolarHBondContact O-N 2.78Å; R99-F101 PolarHBondContact O-N 2.62Å; R99-F101 VanDerWaalsContact O-N 3.12Å
100	R	91.4	Very high	89	Confident	58 Å²	58	50.1 Å²	50.1	22%	0.219	26%	0.258	C	S	.	.			trans	-59.1	119.7	173.5	-178.8	147.6	-91.2	-165.5	-6.5	111.2	Y102 Q393 V394 F409 E410	R100-Y102 HydrophobicContact CB-CE2 4.44Å; R100-Y102 HydrophobicContact CG-CE1 4.12Å; R100-Y102 HydrophobicContact CG-CE2 4.03Å; R100-Q393 PolarHBondContact NH2-O 3.18Å; R100-V394 VanDerWaalsContact NH2-C 3.28Å; R100-V394 PolarHBondContact NH2-O 3.13Å; R100-F409 CarbonylContact C-O 3.49Å; R100-F409 WeakPolarHBondContact CA-O 3.45Å; R100-E410 HydrophobicContact CB-CB 4.34Å
101	F	93.2	Very high	88.5	Confident	13 Å²	13	57 Å²	57	6%	0.057	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-84.7	135.4	171.3	-176	-81.2	0	0	0	109	F92 R99 L119 M121 L130 D408 F409	F92-F101 HydrophobicContact CE1-CE2 4.16Å; F92-F101 HydrophobicContact CZ-CD2 4.33Å; F92-F101 HydrophobicContact CZ-CE2 4.27Å; R99-F101 PolarHBondContact O-N 2.62Å; R99-F101 VanDerWaalsContact O-N 3.12Å; F101-L119 HydrophobicContact CE1-CD1 4.47Å; F101-L119 HydrophobicContact CE1-CD2 4.49Å; F101-L119 HydrophobicContact CZ-CD2 4.47Å; F101-M121 HydrophobicContact CD2-CE 4.03Å; F101-M121 HydrophobicContact CE2-CB 3.98Å; F101-M121 HydrophobicContact CE2-CE 3.47Å; F101-M121 VanDerWaalsContact CE2-CE 3.47Å; F101-M121 HydrophobicContact CE2-CG 3.91Å; F101-M121 HydrophobicContact CZ-CB 3.69Å; F101-M121 HydrophobicContact CZ-CE 4.39Å; F101-M121 HydrophobicContact CZ-CG 4Å; F101-L130 HydrophobicContact CE2-CD1 3.49Å; F101-L130 VanDerWaalsContact CE2-CD1 3.49Å; F101-L130 HydrophobicContact CZ-CD1 3.5Å; F101-D408 CarbonylContact O-C 3.47Å; F101-D408 WeakPolarHBondContact O-CA 3.47Å; F101-D408 WeakPolarHBondContact O-CB 3.37Å; F101-F409 HydrophobicContact CB-CD1 4.17Å; F101-F409 HydrophobicContact CB-CD2 4.11Å; F101-F409 HydrophobicContact CB-CE1 3.86Å; F101-F409 HydrophobicContact CB-CE2 3.78Å; F101-F409 HydrophobicContact CB-CG 4.29Å; F101-F409 HydrophobicContact CB-CZ 3.61Å; F101-F409 WeakPolarHBondContact CB-O 3.26Å; F101-F409 AromaticContact CD1-CD1 3.85Å; F101-F409 HydrophobicContact CD1-CD1 3.85Å; F101-F409 AromaticContact CD1-CE1 3.11Å; F101-F409 HydrophobicContact CD1-CE1 3.11Å; F101-F409 HydrophobicContact CD1-CE2 4.44Å; F101-F409 AromaticContact CD1-CZ 3.44Å; F101-F409 HydrophobicContact CD1-CZ 3.44Å; F101-F409 VanDerWaalsContact CD1-CZ 3.44Å; F101-F409 HydrophobicContact CD2-CE1 4.36Å; F101-F409 HydrophobicContact CD2-CE2 4.49Å; F101-F409 AromaticContact CD2-CZ 3.82Å; F101-F409 HydrophobicContact CD2-CZ 3.82Å; F101-F409 AromaticContact CE1-CE1 3.67Å; F101-F409 HydrophobicContact CE1-CE1 3.67Å; F101-F409 HydrophobicContact CE1-CZ 4.02Å; F101-F409 HydrophobicContact CE2-CZ 4.35Å; F101-F409 HydrophobicContact CG-CD1 4.27Å; F101-F409 AromaticContact CG-CE1 3.53Å; F101-F409 HydrophobicContact CG-CE1 3.53Å; F101-F409 HydrophobicContact CG-CE2 4.01Å; F101-F409 AromaticContact CG-CZ 3.33Å; F101-F409 HydrophobicContact CG-CZ 3.33Å; F101-F409 HydrophobicContact CZ-CE1 4.49Å; F101-F409 HydrophobicContact CZ-CZ 4.45Å; F101-F409 PolarHBondContact N-O 3.01Å; F101-F409 PolarHBondContact O-N 3.19Å
102	Y	93.8	Very high	88	Confident	112 Å²	112	64.4 Å²	64.4	44%	0.439	32%	0.316	S	S	.	.			trans	-113.3	126.6	172.8	-64	-81.6	0	0	0	109.2	R100 E122 D408	R100-Y102 HydrophobicContact CB-CE2 4.44Å; R100-Y102 HydrophobicContact CG-CE1 4.12Å; R100-Y102 HydrophobicContact CG-CE2 4.03Å; Y102-E122 PolarHBondContact O-N 3.46Å; Y102-D408 WeakPolarHBondContact CA-OD1 3.38Å; Y102-D408 HydrophobicContact CD1-CB 4.22Å
103	G	94.7	Very high	87.7	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	148	-169.3	0	0	0	0	0	113.7	L120 V406 L407 D408	G103-L120 CarbonylContact C-O 3.46Å; G103-L120 WeakPolarHBondContact CA-O 3.33Å; G103-V406 CarbonylContact O-C 3.42Å; G103-V406 VanDerWaalsContact O-CA 3.26Å; G103-V406 WeakPolarHBondContact O-CA 3.42Å; G103-L407 VanDerWaalsContact CA-O 3.28Å; G103-L407 WeakPolarHBondContact CA-O 3.39Å; G103-L407 PolarHBondContact N-O 3.45Å; G103-L407 VanDerWaalsContact N-O 3.15Å; G103-L407 PolarHBondContact O-N 3.3Å; G103-D408 PolarHBondContact N-OD1 2.84Å; G103-D408 VanDerWaalsContact N-OD1 3.08Å
104	T	95.3	Very high	87.2	Confident	3 Å²	3	67.2 Å²	67.2	2%	0.018	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.8	165.4	-65.3	0	0	0	0	109.2	V106 L120 E122 Q127 I400 Y405	T104-V106 HydrophobicContact CG2-CG1 3.84Å; T104-L120 HydrophobicContact CG2-CD1 4.43Å; T104-L120 PolarHBondContact N-O 3.28Å; T104-L120 WeakPolarHBondContact O-CB 3.49Å; T104-L120 PolarHBondContact O-N 2.77Å; T104-E122 PolarHBondContact OG1-OE1 2.86Å; T104-Q127 PolarHBondContact OG1-NE2 2.76Å; T104-Q127 VanDerWaalsContact OG1-NE2 3.13Å; T104-I400 HydrophobicContact CG2-CD1 4.42Å; T104-Y405 CarbonylContact C-O 3.58Å; T104-Y405 WeakPolarHBondContact CA-O 3.24Å
105	M	96.8	Very high	86.8	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	128.5	167.2	-72.6	174.1	66.6	0	0	110.5	E118 L119 F397 S404 Y405 L407 F419 A422 L423 F426	M105-E118 VanDerWaalsContact CA-O 3.31Å; M105-E118 WeakPolarHBondContact CA-O 3.33Å; M105-L119 HydrophobicContact CG-CD1 3.77Å; M105-F397 HydrophobicContact CE-CE2 4.36Å; M105-F397 HydrophobicContact SD-CD2 4.18Å; M105-F397 HydrophobicContact SD-CE2 3.7Å; M105-S404 WeakPolarHBondContact O-CA 3.31Å; M105-Y405 PolarHBondContact N-O 3.12Å; M105-Y405 PolarHBondContact O-N 2.97Å; M105-L407 HydrophobicContact CG-CB 4.16Å; M105-L407 HydrophobicContact CG-CD2 4.34Å; M105-L407 HydrophobicContact SD-CB 3.95Å; M105-L407 HydrophobicContact SD-CD2 3.66Å; M105-L407 HydrophobicContact SD-CG 4.35Å; M105-F419 HydrophobicContact CE-CD2 3.65Å; M105-F419 HydrophobicContact CE-CE2 3.48Å; M105-F419 VanDerWaalsContact CE-CE2 3.48Å; M105-F419 HydrophobicContact CG-CD2 4.11Å; M105-F419 HydrophobicContact CG-CE2 3.99Å; M105-F419 HydrophobicContact SD-CD2 3.85Å; M105-F419 HydrophobicContact SD-CE2 4.07Å; M105-A422 HydrophobicContact CE-CB 3.75Å; M105-A422 HydrophobicContact SD-CB 3.42Å; M105-A422 WeakPolarHBondContact SD-CB 3.28Å; M105-L423 HydrophobicContact CE-CD2 4.33Å; M105-L423 HydrophobicContact CE-CG 4.38Å; M105-F426 HydrophobicContact CE-CD2 4.5Å; M105-F426 HydrophobicContact CE-CE2 3.73Å
106	V	93.4	Very high	86.8	Confident	32 Å²	32	64.2 Å²	64.2	19%	0.194	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	144.2	176.2	-60.4	0	0	0	0	111	T104 W117 E118 L120	T104-V106 HydrophobicContact CG2-CG1 3.84Å; V106-W117 CarbonylContact O-C 3.2Å; V106-W117 WeakPolarHBondContact O-CA 3.22Å; V106-E118 HydrophobicContact CG2-CB 4.11Å; V106-E118 PolarHBondContact N-O 2.86Å; V106-E118 PolarHBondContact O-N 3.39Å; V106-L120 HydrophobicContact CB-CD1 4.33Å; V106-L120 HydrophobicContact CG1-CD1 3.78Å; V106-L120 HydrophobicContact CG2-CD1 3.61Å
107	P	93.7	Very high	86.9	Confident	41 Å²	41	63.5 Å²	63.5	27%	0.266	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	154.1	173.1	31.9	-33.7	0	0	0	110.9	P114 G116 W117 S403	P107-P114 HydrophobicContact CB-CB 3.67Å; P107-P114 HydrophobicContact CB-CG 3.6Å; P107-G116 WeakPolarHBondContact CA-O 3.42Å; P107-W117 HydrophobicContact CB-CD2 4.41Å; P107-W117 HydrophobicContact CB-CE3 4.09Å; P107-W117 HydrophobicContact CB-CH2 4.08Å; P107-W117 HydrophobicContact CB-CZ2 4.41Å; P107-W117 HydrophobicContact CB-CZ3 3.93Å; P107-W117 HydrophobicContact CG-CH2 4.45Å; P107-W117 HydrophobicContact CG-CZ3 4.2Å; P107-S403 VanDerWaalsContact CD-O 3.29Å; P107-S403 WeakPolarHBondContact CD-O 3.43Å
108	F	86	Confident	87.2	Confident	46 Å²	46	64 Å²	64	20%	0.202	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	157.9	165.1	61.5	-99.3	0	0	0	111	P114 T115 G116 W117 E118 R132 Y134	F108-P114 WeakPolarHBondContact O-CA 3.35Å; F108-T115 VanDerWaalsContact CD2-OG1 3.22Å; F108-T115 WeakPolarHBondContact CD2-OG1 3.41Å; F108-T115 WeakPolarHBondContact CE2-OG1 3.22Å; F108-T115 PolarHBondContact O-N 3.27Å; F108-T115 PolarHBondContact O-OG1 3.28Å; F108-G116 VanDerWaalsContact CE1-C 3.5Å; F108-G116 PolarHBondContact N-O 3.43Å; F108-G116 PolarHBondContact O-N 3.1Å; F108-W117 VanDerWaalsContact CE1-N 3.31Å; F108-W117 WeakPolarHBondContact CE1-O 3.43Å; F108-E118 HydrophobicContact CD1-CB 4.31Å; F108-R132 HydrophobicContact CE1-CB 4.34Å; F108-R132 HydrophobicContact CE1-CG 4.19Å; F108-Y134 AromaticContact CE2-CD1 3.71Å; F108-Y134 HydrophobicContact CE2-CD1 3.71Å; F108-Y134 AromaticContact CE2-CE1 3.54Å; F108-Y134 HydrophobicContact CE2-CE1 3.54Å; F108-Y134 AromaticContact CZ-CD1 3.63Å; F108-Y134 HydrophobicContact CZ-CD1 3.63Å; F108-Y134 AromaticContact CZ-CE1 3.5Å; F108-Y134 HydrophobicContact CZ-CE1 3.5Å; F108-Y134 HydrophobicContact CZ-CG 4.24Å
109	G	81.4	Confident	87.8	Confident	52 Å²	52	57.4 Å²	57.4	54%	0.536	28%	0.283	S	S	.	.	S	Bend	trans	96.4	-158.1	-173.9	0	0	0	0	0	113.1	T115	G109-T115 WeakPolarHBondContact CA-OG1 3.25Å
110	P	76.8	Confident	88.2	Confident	80 Å²	80	53 Å²	53	52%	0.519	27%	0.268	S	S	.	.			trans	-62.1	136.8	-177.4	-20.1	31.7	0	0	0	112.3	R112 L113	P110-R112 VanDerWaalsContact C-N 3.27Å; P110-R112 PolarHBondContact O-N 3.18Å; P110-L113 CarbonylContact O-C 3.58Å; P110-L113 PolarHBondContact O-N 2.9Å
111	M	74.8	Confident	88	Confident	189 Å²	189	50.7 Å²	50.7	93%	0.931	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-37.8	-177.4	-79.3	-166.7	170.3	0	0	114.1
112	R	74.4	Confident	87.7	Confident	249 Å²	249	52.7 Å²	52.7	94%	0.94	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-32.6	-176.9	-68.9	-173.4	-179.2	177.2	0.6	113.2	P110	P110-R112 VanDerWaalsContact C-N 3.27Å; P110-R112 PolarHBondContact O-N 3.18Å
113	L	77.4	Confident	86.9	Confident	92 Å²	92	48.4 Å²	48.4	48%	0.482	25%	0.253	S	S	.	.	S	Bend	trans	-145.2	88.8	-177.2	-170.6	68.2	0	0	0	108.3	P110 T115	P110-L113 CarbonylContact O-C 3.58Å; P110-L113 PolarHBondContact O-N 2.9Å; L113-T115 PolarHBondContact O-N 3.47Å
114	P	82	Confident	85.6	Confident	26 Å²	26	50.1 Å²	50.1	17%	0.169	27%	0.267	C	S	.	.			trans	-54.6	137.5	179	-27.5	35.7	0	0	0	111.2	P107 F108 G116 W117	P107-P114 HydrophobicContact CB-CB 3.67Å; P107-P114 HydrophobicContact CB-CG 3.6Å; F108-P114 WeakPolarHBondContact O-CA 3.35Å; P114-G116 PolarHBondContact O-N 3.36Å; P114-W117 HydrophobicContact CG-CZ2 4.44Å
115	T	82.8	Confident	84.3	Confident	67 Å²	67	52.5 Å²	52.5	41%	0.411	29%	0.292	S	S	.	.	S	Bend	trans	-72.9	-17.3	171.7	47.3	0	0	0	0	111.6	F108 G109 L113 R135	F108-T115 VanDerWaalsContact CD2-OG1 3.22Å; F108-T115 WeakPolarHBondContact CD2-OG1 3.41Å; F108-T115 WeakPolarHBondContact CE2-OG1 3.22Å; F108-T115 PolarHBondContact O-N 3.27Å; F108-T115 PolarHBondContact O-OG1 3.28Å; G109-T115 WeakPolarHBondContact CA-OG1 3.25Å; L113-T115 PolarHBondContact O-N 3.47Å; T115-R135 WeakPolarHBondContact O-CB 3.33Å; T115-R135 PolarHBondContact O-N 3.12Å
116	G	89.5	Confident	83.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.6	-173	-177.1	0	0	0	0	0	113.3	P107 F108 P114 A133	P107-G116 WeakPolarHBondContact CA-O 3.42Å; F108-G116 VanDerWaalsContact CE1-C 3.5Å; F108-G116 PolarHBondContact N-O 3.43Å; F108-G116 PolarHBondContact O-N 3.1Å; P114-G116 PolarHBondContact O-N 3.36Å; G116-A133 CarbonylContact C-O 3.5Å; G116-A133 WeakPolarHBondContact CA-O 3.47Å
117	W	94.1	Very high	82.6	Confident	14 Å²	14	57.1 Å²	57.1	5%	0.053	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146.4	-177.3	-61.3	84.9	0	0	0	110.2	V106 P107 F108 P114 R132 A133 Y143 S403 Y405 F419 L423 F426	V106-W117 CarbonylContact O-C 3.2Å; V106-W117 WeakPolarHBondContact O-CA 3.22Å; P107-W117 HydrophobicContact CB-CD2 4.41Å; P107-W117 HydrophobicContact CB-CE3 4.09Å; P107-W117 HydrophobicContact CB-CH2 4.08Å; P107-W117 HydrophobicContact CB-CZ2 4.41Å; P107-W117 HydrophobicContact CB-CZ3 3.93Å; P107-W117 HydrophobicContact CG-CH2 4.45Å; P107-W117 HydrophobicContact CG-CZ3 4.2Å; F108-W117 VanDerWaalsContact CE1-N 3.31Å; F108-W117 WeakPolarHBondContact CE1-O 3.43Å; P114-W117 HydrophobicContact CG-CZ2 4.44Å; W117-R132 CarbonylContact O-C 3.57Å; W117-R132 WeakPolarHBondContact O-CA 3.48Å; W117-A133 PolarHBondContact N-O 3.2Å; W117-A133 PolarHBondContact O-N 3.44Å; W117-Y143 AromaticContact CD1-CE1 3.84Å; W117-Y143 PolarHBondContact NE1-OH 3.28Å; W117-S403 WeakPolarHBondContact CZ3-O 3.48Å; W117-Y405 HydrophobicContact CH2-CD2 4.43Å; W117-Y405 HydrophobicContact CH2-CE2 4.12Å; W117-Y405 HydrophobicContact CZ3-CD2 4.03Å; W117-Y405 HydrophobicContact CZ3-CE2 4.16Å; W117-F419 HydrophobicContact CB-CE2 4.24Å; W117-F419 HydrophobicContact CB-CZ 4.09Å; W117-F419 WeakPolarHBondContact O-CZ 3.37Å; W117-L423 HydrophobicContact CB-CD2 3.85Å; W117-L423 VanDerWaalsContact CD1-CD2 3.49Å; W117-L423 HydrophobicContact CG-CD2 3.78Å; W117-F426 AromaticContact CD2-CD2 3.97Å; W117-F426 HydrophobicContact CD2-CD2 3.97Å; W117-F426 AromaticContact CD2-CE2 3.86Å; W117-F426 HydrophobicContact CD2-CE2 3.86Å; W117-F426 HydrophobicContact CD2-CG 4.43Å; W117-F426 HydrophobicContact CD2-CZ 4.21Å; W117-F426 AromaticContact CE2-CD1 3.88Å; W117-F426 AromaticContact CE2-CD2 3.57Å; W117-F426 AromaticContact CE2-CE2 3.83Å; W117-F426 AromaticContact CE2-CG 3.59Å; W117-F426 HydrophobicContact CE3-CD2 4.45Å; W117-F426 HydrophobicContact CE3-CE1 4.49Å; W117-F426 AromaticContact CE3-CE2 3.89Å; W117-F426 HydrophobicContact CE3-CE2 3.89Å; W117-F426 AromaticContact CE3-CZ 3.89Å; W117-F426 HydrophobicContact CE3-CZ 3.89Å; W117-F426 HydrophobicContact CG-CD2 4.46Å; W117-F426 AromaticContact CH2-CD1 3.54Å; W117-F426 HydrophobicContact CH2-CD1 3.54Å; W117-F426 HydrophobicContact CH2-CD2 4.3Å; W117-F426 AromaticContact CH2-CE1 3.13Å; W117-F426 HydrophobicContact CH2-CE1 3.13Å; W117-F426 AromaticContact CH2-CE2 3.96Å; W117-F426 HydrophobicContact CH2-CE2 3.96Å; W117-F426 HydrophobicContact CH2-CG 4.11Å; W117-F426 AromaticContact CH2-CZ 3.35Å; W117-F426 HydrophobicContact CH2-CZ 3.35Å; W117-F426 HydrophobicContact CZ2-CB 4.15Å; W117-F426 AromaticContact CZ2-CD1 3.2Å; W117-F426 HydrophobicContact CZ2-CD1 3.2Å; W117-F426 AromaticContact CZ2-CD2 3.78Å; W117-F426 HydrophobicContact CZ2-CD2 3.78Å; W117-F426 AromaticContact CZ2-CE1 3.36Å; W117-F426 HydrophobicContact CZ2-CE1 3.36Å; W117-F426 AromaticContact CZ2-CE2 3.92Å; W117-F426 HydrophobicContact CZ2-CE2 3.92Å; W117-F426 AromaticContact CZ2-CG 3.43Å; W117-F426 HydrophobicContact CZ2-CG 3.43Å; W117-F426 VanDerWaalsContact CZ2-CG 3.43Å; W117-F426 AromaticContact CZ2-CZ 3.7Å; W117-F426 HydrophobicContact CZ2-CZ 3.7Å; W117-F426 HydrophobicContact CZ3-CD1 4.43Å; W117-F426 AromaticContact CZ3-CE1 3.76Å; W117-F426 HydrophobicContact CZ3-CE1 3.76Å; W117-F426 AromaticContact CZ3-CE2 3.93Å; W117-F426 HydrophobicContact CZ3-CE2 3.93Å; W117-F426 AromaticContact CZ3-CZ 3.44Å; W117-F426 HydrophobicContact CZ3-CZ 3.44Å; W117-F426 VanDerWaalsContact CZ3-CZ 3.44Å; W117-F426 AromaticContact NE1-CD2 3.78Å; W117-F426 AromaticContact NE1-CG 3.81Å
118	E	93.7	Very high	82.1	Confident	24 Å²	24	55.9 Å²	55.9	11%	0.112	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.7	173.9	-174.8	164	-129.4	0	0	109.3	M105 V106 F108 L120 P129 L131 R132 T148	M105-E118 VanDerWaalsContact CA-O 3.31Å; M105-E118 WeakPolarHBondContact CA-O 3.33Å; V106-E118 HydrophobicContact CG2-CB 4.11Å; V106-E118 PolarHBondContact N-O 2.86Å; V106-E118 PolarHBondContact O-N 3.39Å; F108-E118 HydrophobicContact CD1-CB 4.31Å; E118-L120 HydrophobicContact CG-CG 4.49Å; E118-P129 HydrophobicContact CG-CB 4.18Å; E118-P129 WeakPolarHBondContact OE1-CB 3.18Å; E118-L131 CarbonylContact C-O 3.4Å; E118-L131 WeakPolarHBondContact CA-O 3.39Å; E118-R132 HydrophobicContact CB-CG 4.12Å; E118-R132 HydrophobicContact CG-CG 3.92Å; E118-R132 IonicContact OE1-CZ 2.86Å; E118-R132 VanDerWaalsContact OE1-CZ 3.25Å; E118-R132 IonicContact OE1-NE 3.91Å; E118-R132 PolarHBondContact OE1-NE 3.08Å; E118-R132 IonicContact OE1-NH2 3.43Å; E118-R132 PolarHBondContact OE1-NH2 2.92Å; E118-R132 IonicContact OE2-NE 2.92Å; E118-R132 IonicContact OE2-NH2 3.25Å; E118-R132 PolarHBondContact OE2-NH2 2.91Å; E118-T148 HydrophobicContact CG-CG2 4.46Å
119	L	95.7	Very high	82.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	123.9	170.5	-179.8	63.8	0	0	0	109.4	F101 M105 L130 L131 L407 F419	F101-L119 HydrophobicContact CE1-CD1 4.47Å; F101-L119 HydrophobicContact CE1-CD2 4.49Å; F101-L119 HydrophobicContact CZ-CD2 4.47Å; M105-L119 HydrophobicContact CG-CD1 3.77Å; L119-L130 PolarHBondContact O-N 2.7Å; L119-L131 HydrophobicContact CB-CB 4.23Å; L119-L131 HydrophobicContact CD2-CD1 4.29Å; L119-L131 PolarHBondContact N-O 3.38Å; L119-L131 PolarHBondContact O-N 2.59Å; L119-L407 HydrophobicContact CD1-CB 4.29Å; L119-L407 HydrophobicContact CD1-CD2 3.95Å; L119-F419 HydrophobicContact CB-CD2 3.75Å; L119-F419 HydrophobicContact CB-CE2 3.75Å; L119-F419 HydrophobicContact CB-CG 4.17Å; L119-F419 HydrophobicContact CB-CZ 4.19Å; L119-F419 HydrophobicContact CD2-CB 4.13Å; L119-F419 HydrophobicContact CD2-CD2 4.38Å; L119-F419 HydrophobicContact CD2-CG 4.33Å; L119-F419 HydrophobicContact CG-CD2 4.44Å
120	L	91.3	Very high	82.6	Confident	16 Å²	16	53.4 Å²	53.4	8%	0.084	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131	176.8	-55.7	140.5	0	0	0	108.8	G103 T104 V106 E118 Q127 I128 P129	G103-L120 CarbonylContact C-O 3.46Å; G103-L120 WeakPolarHBondContact CA-O 3.33Å; T104-L120 HydrophobicContact CG2-CD1 4.43Å; T104-L120 PolarHBondContact N-O 3.28Å; T104-L120 WeakPolarHBondContact O-CB 3.49Å; T104-L120 PolarHBondContact O-N 2.77Å; V106-L120 HydrophobicContact CB-CD1 4.33Å; V106-L120 HydrophobicContact CG1-CD1 3.78Å; V106-L120 HydrophobicContact CG2-CD1 3.61Å; E118-L120 HydrophobicContact CG-CG 4.49Å; L120-Q127 HydrophobicContact CB-CB 4.05Å; L120-Q127 HydrophobicContact CD2-CB 4.23Å; L120-I128 CarbonylContact C-O 3.51Å; L120-I128 VanDerWaalsContact CA-O 3.32Å; L120-I128 WeakPolarHBondContact CA-O 3.49Å; L120-P129 HydrophobicContact CD2-CB 3.95Å
121	M	87.7	Confident	83.4	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.039	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	132.1	166.2	179.9	-170.4	-79.2	0	0	109.6	Y83 F92 F101 H123 Q127 I128 L130	Y83-M121 HydrophobicContact CD2-SD 4.47Å; F92-M121 HydrophobicContact CE1-CE 3.48Å; F92-M121 VanDerWaalsContact CE1-CE 3.48Å; F92-M121 HydrophobicContact CE2-CE 4.16Å; F92-M121 HydrophobicContact CZ-CE 3.17Å; F101-M121 HydrophobicContact CD2-CE 4.03Å; F101-M121 HydrophobicContact CE2-CB 3.98Å; F101-M121 HydrophobicContact CE2-CE 3.47Å; F101-M121 VanDerWaalsContact CE2-CE 3.47Å; F101-M121 HydrophobicContact CE2-CG 3.91Å; F101-M121 HydrophobicContact CZ-CB 3.69Å; F101-M121 HydrophobicContact CZ-CE 4.39Å; F101-M121 HydrophobicContact CZ-CG 4Å; M121-H123 HydrophobicContact SD-CB 4.34Å; M121-Q127 CarbonylContact O-C 3.6Å; M121-Q127 WeakPolarHBondContact O-CA 3.47Å; M121-I128 PolarHBondContact N-O 3.19Å; M121-I128 PolarHBondContact O-N 2.91Å; M121-L130 HydrophobicContact CB-CD1 3.98Å; M121-L130 HydrophobicContact CB-CG 4.19Å; M121-L130 HydrophobicContact CE-CD1 4.21Å
122	E	86.1	Confident	84.2	Confident	55 Å²	55	44.3 Å²	44.3	26%	0.257	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	119.4	168.8	-67	178.7	-149.8	0	0	109.8	Y102 T104 G126 Q127 R376	Y102-E122 PolarHBondContact O-N 3.46Å; T104-E122 PolarHBondContact OG1-OE1 2.86Å; E122-G126 WeakPolarHBondContact CA-O 3.26Å; E122-Q127 HydrophobicContact CG-CG 4.33Å; E122-R376 IonicContact OE1-NH2 2.77Å; E122-R376 PolarHBondContact OE1-NH2 3.02Å; E122-R376 IonicContact OE2-CZ 3.56Å; E122-R376 IonicContact OE2-NH1 3.87Å; E122-R376 IonicContact OE2-NH2 3.66Å; E122-R376 PolarHBondContact OE2-NH2 3.01Å
123	H	76.7	Confident	85.1	Confident	23 Å²	23	32.4 Å²	32.4	11%	0.106	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	132	178.5	-175.9	-101.3	0	0	0	111.3	Q80 L82 M121 G125 G126 I128	Q80-H123 PolarHBondContact O-NE2 3.11Å; L82-H123 VanDerWaalsContact CG-CD2 3.42Å; L82-H123 WeakPolarHBondContact CG-CD2 3.37Å; L82-H123 PolarHBondContact N-NE2 3.46Å; M121-H123 HydrophobicContact SD-CB 4.34Å; H123-G125 PolarHBondContact O-N 2.94Å; H123-G125 VanDerWaalsContact O-N 3.1Å; H123-G126 PolarHBondContact N-O 2.78Å; H123-G126 WeakPolarHBondContact O-CA 3.31Å; H123-G126 PolarHBondContact O-N 2.83Å; H123-I128 HydrophobicContact CB-CD1 4.2Å
124	A	69	Low	85.6	Confident	35 Å²	35	31.6 Å²	31.6	29%	0.289	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	37.5	177.1	0	0	0	0	0	114.8	I50 G126	I50-A124 HydrophobicContact CD1-CB 3.44Å; I50-A124 VanDerWaalsContact CD1-CB 3.44Å; I50-A124 HydrophobicContact CG1-CB 4.21Å; I50-A124 HydrophobicContact CG2-CB 4.5Å; A124-G126 VanDerWaalsContact C-N 3.25Å; A124-G126 PolarHBondContact O-N 3Å
125	G	66.7	Low	85.8	Confident	53 Å²	53	33 Å²	33	55%	0.546	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	-2.8	-178.7	0	0	0	0	0	115	H123	H123-G125 PolarHBondContact O-N 2.94Å; H123-G125 VanDerWaalsContact O-N 3.1Å
126	G	74.6	Confident	85.8	Confident	22 Å²	22	34.4 Å²	34.4	23%	0.227	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	170.7	174	0	0	0	0	0	113.2	E122 H123 A124	E122-G126 WeakPolarHBondContact CA-O 3.26Å; H123-G126 PolarHBondContact N-O 2.78Å; H123-G126 WeakPolarHBondContact O-CA 3.31Å; H123-G126 PolarHBondContact O-N 2.83Å; A124-G126 VanDerWaalsContact C-N 3.25Å; A124-G126 PolarHBondContact O-N 3Å
127	Q	80.5	Confident	84.9	Confident	108 Å²	108	35.5 Å²	35.5	51%	0.505	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.3	175.3	-74.1	178.3	-17.4	0	0	109.3	T104 L120 M121 E122	T104-Q127 PolarHBondContact OG1-NE2 2.76Å; T104-Q127 VanDerWaalsContact OG1-NE2 3.13Å; L120-Q127 HydrophobicContact CB-CB 4.05Å; L120-Q127 HydrophobicContact CD2-CB 4.23Å; M121-Q127 CarbonylContact O-C 3.6Å; M121-Q127 WeakPolarHBondContact O-CA 3.47Å; E122-Q127 HydrophobicContact CG-CG 4.33Å
128	I	83.4	Confident	83.6	Confident	15 Å²	15	44.3 Å²	44.3	8%	0.077	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.9	-174.5	-46.8	170.7	0	0	0	109.5	Y83 L120 M121 H123	Y83-I128 HydrophobicContact CD2-CB 3.96Å; Y83-I128 HydrophobicContact CD2-CD1 3.74Å; Y83-I128 HydrophobicContact CD2-CG1 4.46Å; Y83-I128 HydrophobicContact CD2-CG2 3.5Å; Y83-I128 VanDerWaalsContact CD2-CG2 3.5Å; Y83-I128 HydrophobicContact CE1-CG2 4.44Å; Y83-I128 HydrophobicContact CE2-CB 4.05Å; Y83-I128 HydrophobicContact CE2-CG2 3.17Å; Y83-I128 HydrophobicContact CG-CD1 3.85Å; Y83-I128 HydrophobicContact CG-CG2 4.28Å; L120-I128 CarbonylContact C-O 3.51Å; L120-I128 VanDerWaalsContact CA-O 3.32Å; L120-I128 WeakPolarHBondContact CA-O 3.49Å; M121-I128 PolarHBondContact N-O 3.19Å; M121-I128 PolarHBondContact O-N 2.91Å; H123-I128 HydrophobicContact CB-CD1 4.2Å
129	P	87.6	Confident	82.4	Confident	46 Å²	46	52.1 Å²	52.1	30%	0.299	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.9	-175.7	28.7	-35.2	0	0	0	110.8	E118 L120 T148	E118-P129 HydrophobicContact CG-CB 4.18Å; E118-P129 WeakPolarHBondContact OE1-CB 3.18Å; L120-P129 HydrophobicContact CD2-CB 3.95Å; P129-T148 HydrophobicContact CB-CG2 3.75Å; P129-T148 PolarHBondContact O-OG1 2.89Å
130	L	89	Confident	81.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-45.2	177.2	-62.4	-176.1	0	0	0	114.3	Y83 L89 F92 V93 F101 L119 M121 T148	Y83-L130 HydrophobicContact CD2-CD2 4.16Å; Y83-L130 HydrophobicContact CE2-CD2 3.62Å; L89-L130 HydrophobicContact CD1-CD2 3.67Å; F92-L130 HydrophobicContact CE1-CD1 3.88Å; V93-L130 HydrophobicContact CG1-CB 4.34Å; F101-L130 HydrophobicContact CE2-CD1 3.49Å; F101-L130 VanDerWaalsContact CE2-CD1 3.49Å; F101-L130 HydrophobicContact CZ-CD1 3.5Å; L119-L130 PolarHBondContact O-N 2.7Å; M121-L130 HydrophobicContact CB-CD1 3.98Å; M121-L130 HydrophobicContact CB-CG 4.19Å; M121-L130 HydrophobicContact CE-CD1 4.21Å; L130-T148 WeakPolarHBondContact CA-OG1 3.43Å; L130-T148 PolarHBondContact N-OG1 3.31Å; L130-T148 PolarHBondContact O-N 2.8Å; L130-T148 PolarHBondContact O-OG1 2.94Å
131	L	94.4	Very high	80.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.6	-174.4	-65.3	170.8	0	0	0	110.8	V93 E118 L119 I145 W146 L147 T148 V192 P415 V416 F419	V93-L131 HydrophobicContact CB-CD1 4.44Å; V93-L131 HydrophobicContact CB-CD2 4.21Å; V93-L131 HydrophobicContact CB-CG 4.5Å; V93-L131 HydrophobicContact CG1-CD2 4.21Å; V93-L131 HydrophobicContact CG1-CG 4.26Å; V93-L131 HydrophobicContact CG2-CD2 4.13Å; E118-L131 CarbonylContact C-O 3.4Å; E118-L131 WeakPolarHBondContact CA-O 3.39Å; L119-L131 HydrophobicContact CB-CB 4.23Å; L119-L131 HydrophobicContact CD2-CD1 4.29Å; L119-L131 PolarHBondContact N-O 3.38Å; L119-L131 PolarHBondContact O-N 2.59Å; L131-I145 HydrophobicContact CB-CG2 4.28Å; L131-I145 HydrophobicContact CD1-CG2 4.38Å; L131-I145 HydrophobicContact CD2-CG2 3.99Å; L131-I145 HydrophobicContact CG-CG2 4.46Å; L131-W146 CarbonylContact C-O 3.48Å; L131-W146 VanDerWaalsContact CA-O 3.25Å; L131-W146 WeakPolarHBondContact CA-O 3.45Å; L131-W146 WeakPolarHBondContact CD2-O 3.46Å; L131-L147 HydrophobicContact CD2-CD2 4.02Å; L131-T148 VanDerWaalsContact N-CG2 3.33Å; L131-V192 HydrophobicContact CD2-CG2 4.42Å; L131-P415 HydrophobicContact CD1-CB 4.45Å; L131-V416 HydrophobicContact CD1-CB 4.45Å; L131-V416 HydrophobicContact CD1-CG2 3.86Å; L131-V416 HydrophobicContact CD2-CG2 4.16Å; L131-F419 HydrophobicContact CB-CD1 3.77Å; L131-F419 HydrophobicContact CB-CE1 3.81Å; L131-F419 HydrophobicContact CD1-CB 4.15Å; L131-F419 HydrophobicContact CD1-CD1 3.98Å; L131-F419 HydrophobicContact CD1-CG 4.38Å
132	R	92	Very high	80.4	Confident	77 Å²	77	57.3 Å²	57.3	29%	0.291	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.5	168.4	-78.8	-176.7	-176.9	-168	-6.2	110.5	F108 W117 E118 Y134 I145 W146 T148	F108-R132 HydrophobicContact CE1-CB 4.34Å; F108-R132 HydrophobicContact CE1-CG 4.19Å; W117-R132 CarbonylContact O-C 3.57Å; W117-R132 WeakPolarHBondContact O-CA 3.48Å; E118-R132 HydrophobicContact CB-CG 4.12Å; E118-R132 HydrophobicContact CG-CG 3.92Å; E118-R132 IonicContact OE1-CZ 2.86Å; E118-R132 VanDerWaalsContact OE1-CZ 3.25Å; E118-R132 IonicContact OE1-NE 3.91Å; E118-R132 PolarHBondContact OE1-NE 3.08Å; E118-R132 IonicContact OE1-NH2 3.43Å; E118-R132 PolarHBondContact OE1-NH2 2.92Å; E118-R132 IonicContact OE2-NE 2.92Å; E118-R132 IonicContact OE2-NH2 3.25Å; E118-R132 PolarHBondContact OE2-NH2 2.91Å; R132-Y134 HydrophobicContact CB-CE2 3.93Å; R132-I145 CarbonylContact O-C 3.5Å; R132-I145 WeakPolarHBondContact O-CA 3.47Å; R132-W146 PolarHBondContact N-O 3.27Å; R132-W146 PolarHBondContact O-N 3.01Å; R132-T148 HydrophobicContact CG-CG2 3.96Å
133	A	93	Very high	80.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.4	173.6	0	0	0	0	0	110	G116 W117 Y143 L144 I145 F419 L423	G116-A133 CarbonylContact C-O 3.5Å; G116-A133 WeakPolarHBondContact CA-O 3.47Å; W117-A133 PolarHBondContact N-O 3.2Å; W117-A133 PolarHBondContact O-N 3.44Å; A133-Y143 HydrophobicContact CB-CD1 3.97Å; A133-Y143 HydrophobicContact CB-CG 4.43Å; A133-L144 CarbonylContact C-O 3.52Å; A133-L144 WeakPolarHBondContact CA-O 3.43Å; A133-I145 HydrophobicContact CB-CG1 4.18Å; A133-F419 HydrophobicContact CB-CE1 3.55Å; A133-F419 HydrophobicContact CB-CZ 3.75Å; A133-L423 HydrophobicContact CB-CD1 3.42Å; A133-L423 VanDerWaalsContact CB-CD1 3.42Å; A133-L423 HydrophobicContact CB-CD2 3.84Å; A133-L423 HydrophobicContact CB-CG 4.28Å
134	Y	87.9	Confident	81.4	Confident	75 Å²	75	54.8 Å²	54.8	29%	0.294	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	130.4	176.7	-63.7	-89.5	0	0	0	110.2	F108 R132 L136 Y143 L144 W146	F108-Y134 AromaticContact CE2-CD1 3.71Å; F108-Y134 HydrophobicContact CE2-CD1 3.71Å; F108-Y134 AromaticContact CE2-CE1 3.54Å; F108-Y134 HydrophobicContact CE2-CE1 3.54Å; F108-Y134 AromaticContact CZ-CD1 3.63Å; F108-Y134 HydrophobicContact CZ-CD1 3.63Å; F108-Y134 AromaticContact CZ-CE1 3.5Å; F108-Y134 HydrophobicContact CZ-CE1 3.5Å; F108-Y134 HydrophobicContact CZ-CG 4.24Å; R132-Y134 HydrophobicContact CB-CE2 3.93Å; Y134-L136 PolarHBondContact O-N 3.19Å; Y134-Y143 VanDerWaalsContact O-CA 3.31Å; Y134-Y143 WeakPolarHBondContact O-CA 3.38Å; Y134-L144 PolarHBondContact N-O 2.84Å; Y134-L144 PolarHBondContact O-N 2.98Å; Y134-W146 AromaticContact CD2-CD1 3.59Å; Y134-W146 HydrophobicContact CD2-CG 4.17Å; Y134-W146 AromaticContact CD2-NE1 3.79Å; Y134-W146 HydrophobicContact CE2-CB 4.39Å; Y134-W146 AromaticContact CE2-CD1 3.9Å; Y134-W146 HydrophobicContact CE2-CD2 4.39Å; Y134-W146 HydrophobicContact CE2-CG 4Å
135	R	86.7	Confident	82.6	Confident	56 Å²	56	53.1 Å²	53.1	21%	0.211	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	123.9	174.9	-171.5	175.3	176.5	167.4	3	109.6	T115 G137 R138 E142 Y143	T115-R135 WeakPolarHBondContact O-CB 3.33Å; T115-R135 PolarHBondContact O-N 3.12Å; R135-G137 PolarHBondContact NE-O 3.31Å; R135-R138 PolarHBondContact NH2-O 3.28Å; R135-R138 VanDerWaalsContact NH2-O 3.13Å; R135-E142 WeakPolarHBondContact CA-O 3.49Å; R135-Y143 HydrophobicContact CB-CD1 4.11Å; R135-Y143 HydrophobicContact CB-CE1 3.64Å; R135-Y143 HydrophobicContact CG-CE1 4.24Å
136	L	82.8	Confident	83.6	Confident	96 Å²	96	52.6 Å²	52.6	50%	0.503	25%	0.25	S	C	.	.			trans	-91.1	-37.5	-178.8	-56.6	-177.6	0	0	0	113	Y134 E142 L144 L194	Y134-L136 PolarHBondContact O-N 3.19Å; L136-E142 HydrophobicContact CB-CB 4.22Å; L136-E142 HydrophobicContact CD1-CB 4.29Å; L136-E142 HydrophobicContact CG-CB 4.49Å; L136-E142 PolarHBondContact N-O 3.47Å; L136-L144 HydrophobicContact CD1-CB 4.13Å; L136-L144 HydrophobicContact CD2-CB 3.99Å; L136-L144 HydrophobicContact CG-CB 4.2Å; L136-L194 HydrophobicContact CD1-CD1 4.03Å
137	G	70.1	Confident	84.2	Confident	22 Å²	22	52.7 Å²	52.7	23%	0.227	25%	0.245	C	C	.	.			trans	-119.5	148.6	-172.2	0	0	0	0	0	114.4	R135	R135-G137 PolarHBondContact NE-O 3.31Å
138	R	66.2	Low	84	Confident	199 Å²	199	47.9 Å²	47.9	75%	0.751	22%	0.223	S	C	*	.	S	Bend	trans	-80.9	-47	169.9	-69	-173.2	-176.1	-177.5	2.6	112	R135	R135-R138 PolarHBondContact NH2-O 3.28Å; R135-R138 VanDerWaalsContact NH2-O 3.13Å
139	F	68.5	Low	83	Confident	188 Å²	188	49.6 Å²	49.6	83%	0.825	24%	0.244	S	C	*	.	S	Bend	trans	-89.9	-52.6	-170.3	-60.2	-69.2	0	0	0	113.6	P141	F139-P141 WeakPolarHBondContact O-CD 3.43Å
140	C	71.1	Confident	81.2	Confident	58 Å²	58	48.9 Å²	48.9	39%	0.392	24%	0.239	S	C	.	.	S	Bend	trans	-97.5	111.7	167.9	-65.1	0	0	0	0	107.1	E142	C140-E142 PolarHBondContact O-N 3.34Å
141	P	73.9	Confident	79.2	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.026	26%	0.264	C	S	.	.			trans	-69.4	128.2	179.7	26.4	-29	0	0	0	108.7	F139 A197 C201 M427	F139-P141 WeakPolarHBondContact O-CD 3.43Å; P141-A197 HydrophobicContact CG-CB 4.16Å; P141-C201 VanDerWaalsContact CG-SG 3.51Å; P141-M427 HydrophobicContact CB-CB 3.97Å; P141-M427 HydrophobicContact CB-CE 3.47Å; P141-M427 VanDerWaalsContact CB-CE 3.47Å; P141-M427 HydrophobicContact CB-CG 3.82Å; P141-M427 HydrophobicContact CB-SD 4.48Å; P141-M427 HydrophobicContact CG-CB 3.73Å; P141-M427 HydrophobicContact CG-CE 3.76Å; P141-M427 HydrophobicContact CG-CG 4.12Å; P141-M427 WeakPolarHBondContact O-CE 3.41Å
142	E	88.2	Confident	77	Confident	71 Å²	71	61.1 Å²	61.1	33%	0.332	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.3	168.4	-67	-172.3	154.6	0	0	107.8	R135 L136 C140 L195	R135-E142 WeakPolarHBondContact CA-O 3.49Å; L136-E142 HydrophobicContact CB-CB 4.22Å; L136-E142 HydrophobicContact CD1-CB 4.29Å; L136-E142 HydrophobicContact CG-CB 4.49Å; L136-E142 PolarHBondContact N-O 3.47Å; C140-E142 PolarHBondContact O-N 3.34Å; E142-L195 CarbonylContact C-O 3.53Å; E142-L195 VanDerWaalsContact CA-O 3.25Å; E142-L195 WeakPolarHBondContact CA-O 3.25Å
143	Y	91.2	Very high	74.9	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.2	174.7	-76.3	-80.5	0	0	0	110.7	W117 A133 Y134 R135 L195 L423 M427	W117-Y143 AromaticContact CD1-CE1 3.84Å; W117-Y143 PolarHBondContact NE1-OH 3.28Å; A133-Y143 HydrophobicContact CB-CD1 3.97Å; A133-Y143 HydrophobicContact CB-CG 4.43Å; Y134-Y143 VanDerWaalsContact O-CA 3.31Å; Y134-Y143 WeakPolarHBondContact O-CA 3.38Å; R135-Y143 HydrophobicContact CB-CD1 4.11Å; R135-Y143 HydrophobicContact CB-CE1 3.64Å; R135-Y143 HydrophobicContact CG-CE1 4.24Å; Y143-L195 HydrophobicContact CD2-CD2 4.18Å; Y143-L195 PolarHBondContact N-O 2.97Å; Y143-L195 PolarHBondContact O-N 2.96Å; Y143-L423 HydrophobicContact CD1-CD2 4.21Å; Y143-L423 HydrophobicContact CD2-CB 4.28Å; Y143-L423 HydrophobicContact CD2-CD2 4.34Å; Y143-L423 HydrophobicContact CE1-CD2 4.25Å; Y143-L423 HydrophobicContact CE2-CD2 4.35Å; Y143-L423 HydrophobicContact CG-CD1 4.37Å; Y143-L423 HydrophobicContact CG-CD2 4.26Å; Y143-M427 HydrophobicContact CD2-CE 4.07Å; Y143-M427 HydrophobicContact CD2-CG 4.07Å; Y143-M427 HydrophobicContact CD2-SD 3.78Å; Y143-M427 HydrophobicContact CE2-CE 4.45Å; Y143-M427 HydrophobicContact CE2-CG 3.59Å; Y143-M427 HydrophobicContact CE2-SD 3.96Å
144	L	91.8	Very high	72.8	Confident	21 Å²	21	64.2 Å²	64.2	11%	0.11	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	121.1	169.6	-173.2	64.5	0	0	0	109.2	A133 Y134 L136 W146 K191 L194 L209	A133-L144 CarbonylContact C-O 3.52Å; A133-L144 WeakPolarHBondContact CA-O 3.43Å; Y134-L144 PolarHBondContact N-O 2.84Å; Y134-L144 PolarHBondContact O-N 2.98Å; L136-L144 HydrophobicContact CD1-CB 4.13Å; L136-L144 HydrophobicContact CD2-CB 3.99Å; L136-L144 HydrophobicContact CG-CB 4.2Å; L144-W146 HydrophobicContact CD2-CZ2 3.88Å; L144-K191 HydrophobicContact CD1-CB 4.46Å; L144-K191 HydrophobicContact CD1-CD 4.28Å; L144-K191 HydrophobicContact CD1-CG 4.37Å; L144-K191 HydrophobicContact CD2-CD 3.99Å; L144-K191 HydrophobicContact CD2-CG 4.17Å; L144-K191 HydrophobicContact CG-CG 4.47Å; L144-L194 HydrophobicContact CD1-CD1 4.3Å; L144-L209 HydrophobicContact CD1-CD1 3.51Å
145	I	94	Very high	70.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.8	-176.7	-58.9	173.9	0	0	0	109.9	L131 R132 A133 V192 A193 F419 A420 L423	L131-I145 HydrophobicContact CB-CG2 4.28Å; L131-I145 HydrophobicContact CD1-CG2 4.38Å; L131-I145 HydrophobicContact CD2-CG2 3.99Å; L131-I145 HydrophobicContact CG-CG2 4.46Å; R132-I145 CarbonylContact O-C 3.5Å; R132-I145 WeakPolarHBondContact O-CA 3.47Å; A133-I145 HydrophobicContact CB-CG1 4.18Å; I145-V192 PolarHBondContact O-N 2.98Å; I145-A193 HydrophobicContact CB-CB 4.3Å; I145-A193 WeakPolarHBondContact CB-O 3.19Å; I145-A193 HydrophobicContact CD1-CB 4.22Å; I145-A193 PolarHBondContact N-O 2.8Å; I145-A193 PolarHBondContact O-N 3.18Å; I145-F419 HydrophobicContact CD1-CD1 4.21Å; I145-F419 HydrophobicContact CG1-CD1 4.39Å; I145-F419 HydrophobicContact CG2-CD1 4.04Å; I145-F419 HydrophobicContact CG2-CE1 4.28Å; I145-A420 HydrophobicContact CD1-CB 3.88Å; I145-L423 HydrophobicContact CD1-CD1 4.02Å; I145-L423 HydrophobicContact CG1-CD1 4.17Å
146	W	88.9	Confident	69.4	Low	43 Å²	43	67.3 Å²	67.3	16%	0.163	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	151.7	-176	-65.9	59.3	0	0	0	110.7	L131 R132 Y134 L144 L187 Q190 K191	L131-W146 CarbonylContact C-O 3.48Å; L131-W146 VanDerWaalsContact CA-O 3.25Å; L131-W146 WeakPolarHBondContact CA-O 3.45Å; L131-W146 WeakPolarHBondContact CD2-O 3.46Å; R132-W146 PolarHBondContact N-O 3.27Å; R132-W146 PolarHBondContact O-N 3.01Å; Y134-W146 AromaticContact CD2-CD1 3.59Å; Y134-W146 HydrophobicContact CD2-CG 4.17Å; Y134-W146 AromaticContact CD2-NE1 3.79Å; Y134-W146 HydrophobicContact CE2-CB 4.39Å; Y134-W146 AromaticContact CE2-CD1 3.9Å; Y134-W146 HydrophobicContact CE2-CD2 4.39Å; Y134-W146 HydrophobicContact CE2-CG 4Å; L144-W146 HydrophobicContact CD2-CZ2 3.88Å; W146-L187 HydrophobicContact CH2-CD2 4.33Å; W146-L187 HydrophobicContact CZ3-CD2 4.25Å; W146-Q190 VanDerWaalsContact CA-O 3.25Å; W146-Q190 WeakPolarHBondContact CA-O 3.17Å; W146-Q190 HydrophobicContact CD2-CB 4.38Å; W146-Q190 HydrophobicContact CE3-CB 3.48Å; W146-Q190 VanDerWaalsContact CE3-CB 3.48Å; W146-Q190 HydrophobicContact CE3-CG 4.49Å; W146-Q190 HydrophobicContact CZ3-CB 3.86Å; W146-K191 HydrophobicContact CD2-CG 4.36Å; W146-K191 HydrophobicContact CH2-CG 4.33Å; W146-K191 HydrophobicContact CZ2-CD 4.4Å; W146-K191 HydrophobicContact CZ2-CG 3.9Å
147	L	87.1	Confident	67.8	Low	23 Å²	23	65 Å²	65	12%	0.12	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	143.9	164.5	-74	176.1	0	0	0	111.6	L89 L90 V93 L131 Q190 V192	L89-L147 HydrophobicContact CD2-CD2 4.27Å; L89-L147 HydrophobicContact CG-CD2 4.03Å; L90-L147 HydrophobicContact CB-CD1 3.86Å; L90-L147 HydrophobicContact CD1-CD1 3.85Å; L90-L147 HydrophobicContact CD1-CG 4.48Å; L90-L147 HydrophobicContact CG-CD1 4.41Å; V93-L147 HydrophobicContact CB-CD2 4.45Å; V93-L147 HydrophobicContact CG1-CD2 4.18Å; V93-L147 HydrophobicContact CG2-CD2 3.49Å; V93-L147 VanDerWaalsContact CG2-CD2 3.49Å; L131-L147 HydrophobicContact CD2-CD2 4.02Å; L147-Q190 PolarHBondContact N-O 2.8Å; L147-Q190 VanDerWaalsContact N-O 3.1Å; L147-V192 HydrophobicContact CD1-CG2 4.45Å; L147-V192 HydrophobicContact CD2-CG2 4.1Å; L147-V192 HydrophobicContact CG-CG2 3.62Å
148	T	76.2	Confident	66.8	Low	7 Å²	7	71.7 Å²	71.7	4%	0.043	34%	0.34	C	S	.	.	S	Bend	trans	-83.3	166.4	168.2	58.2	0	0	0	0	111	E118 P129 L130 L131 R132	E118-T148 HydrophobicContact CG-CG2 4.46Å; P129-T148 HydrophobicContact CB-CG2 3.75Å; P129-T148 PolarHBondContact O-OG1 2.89Å; L130-T148 WeakPolarHBondContact CA-OG1 3.43Å; L130-T148 PolarHBondContact N-OG1 3.31Å; L130-T148 PolarHBondContact O-N 2.8Å; L130-T148 PolarHBondContact O-OG1 2.94Å; L131-T148 VanDerWaalsContact N-CG2 3.33Å; R132-T148 HydrophobicContact CG-CG2 3.96Å
149	G	61.9	Low	66.3	Low	51 Å²	51	70.4 Å²	70.4	53%	0.526	34%	0.335	S	S	.	.	S	Bend	trans	97.1	-21.9	174.3	0	0	0	0	0	115.1
150	T	49.9	Very low	65.6	Low	31 Å²	31	65.9 Å²	65.9	19%	0.19	32%	0.319	C	S	.	.	H	α-helix	trans	-83.3	-25.4	-175.3	57.2	0	0	0	0	114.3	K152 K153 D154 Q190	T150-K152 PolarHBondContact O-N 2.74Å; T150-K153 CarbonylContact O-C 3.59Å; T150-K153 WeakPolarHBondContact O-CA 3.12Å; T150-K153 WeakPolarHBondContact O-CB 3.38Å; T150-K153 PolarHBondContact O-N 3.28Å; T150-D154 PolarHBondContact O-N 2.8Å; T150-D154 PolarHBondContact OG1-OD2 3.08Å; T150-Q190 VanDerWaalsContact CB-CD 3.5Å; T150-Q190 HydrophobicContact CG2-CG 3.96Å; T150-Q190 PolarHBondContact OG1-NE2 3.26Å; T150-Q190 PolarHBondContact OG1-OE1 2.78Å
151	H	46.8	Very low	64.8	Low	112 Å²	112	63.5 Å²	63.5	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-55.8	-32.7	-177.1	-166.1	-82.4	0	0	0	113.1	M155	H151-M155 VanDerWaalsContact CE1-SD 3.53Å; H151-M155 PolarHBondContact ND1-SD 2.81Å; H151-M155 WeakPolarHBondContact O-CB 3.26Å; H151-M155 WeakPolarHBondContact O-CG 2.94Å; H151-M155 PolarHBondContact O-N 2.96Å
152	K	48.7	Very low	63.8	Low	146 Å²	146	66.2 Å²	66.2	64%	0.635	32%	0.317	S	S	*	.	H	α-helix	trans	-65.5	-43.9	173.4	-82.8	-175	178.4	177.6	0	111.8	T150 M155 I156	T150-K152 PolarHBondContact O-N 2.74Å; K152-M155 PolarHBondContact O-N 3.15Å; K152-I156 WeakPolarHBondContact O-CG1 3.41Å; K152-I156 PolarHBondContact O-N 3.43Å; K152-I156 VanDerWaalsContact O-N 3.12Å
153	K	47.7	Very low	62.2	Low	110 Å²	110	67.2 Å²	67.2	48%	0.478	33%	0.328	S	S	.	.	H	α-helix	trans	-67.6	-41.7	175.6	-74.5	179.9	177	165.4	0	111	E86 T150 M155 I156 L157	E86-K153 WeakPolarHBondContact OE1-CE 3.45Å; E86-K153 IonicContact OE1-NZ 2.83Å; E86-K153 PolarHBondContact OE1-NZ 3.07Å; E86-K153 IonicContact OE2-NZ 2.97Å; E86-K153 PolarHBondContact OE2-NZ 2.83Å; T150-K153 CarbonylContact O-C 3.59Å; T150-K153 WeakPolarHBondContact O-CA 3.12Å; T150-K153 WeakPolarHBondContact O-CB 3.38Å; T150-K153 PolarHBondContact O-N 3.28Å; K153-M155 VanDerWaalsContact C-N 3.32Å; K153-M155 PolarHBondContact O-N 3.04Å; K153-I156 CarbonylContact O-C 3.55Å; K153-I156 WeakPolarHBondContact O-CA 3.45Å; K153-I156 WeakPolarHBondContact O-CB 3.41Å; K153-I156 PolarHBondContact O-N 2.92Å; K153-L157 WeakPolarHBondContact O-CB 3.49Å; K153-L157 PolarHBondContact O-N 2.84Å
154	D	48.3	Very low	60.6	Low	32 Å²	32	69.1 Å²	69.1	17%	0.171	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-38.3	176.3	-60.6	-34.8	0	0	0	111.3	T150 I156 L157 W158 Q190	T150-D154 PolarHBondContact O-N 2.8Å; T150-D154 PolarHBondContact OG1-OD2 3.08Å; D154-I156 VanDerWaalsContact C-N 3.33Å; D154-I156 PolarHBondContact O-N 2.68Å; D154-L157 PolarHBondContact O-N 2.77Å; D154-W158 WeakPolarHBondContact O-CA 3.48Å; D154-W158 WeakPolarHBondContact O-CB 3.42Å; D154-W158 PolarHBondContact O-N 2.89Å; D154-Q190 VanDerWaalsContact CG-NE2 3.3Å; D154-Q190 PolarHBondContact OD1-NE2 2.88Å; D154-Q190 VanDerWaalsContact OD1-NE2 3.09Å; D154-Q190 PolarHBondContact OD2-NE2 3.39Å; D154-Q190 PolarHBondContact OD2-OE1 3.31Å
155	M	48.4	Very low	58.7	Low	93 Å²	93	72.1 Å²	72.1	46%	0.458	35%	0.354	S	S	.	.	H	α-helix	trans	-64.3	-37	172.2	-77.5	-175.5	78.5	0	0	112.4	H151 K152 K153 R159	H151-M155 VanDerWaalsContact CE1-SD 3.53Å; H151-M155 PolarHBondContact ND1-SD 2.81Å; H151-M155 WeakPolarHBondContact O-CB 3.26Å; H151-M155 WeakPolarHBondContact O-CG 2.94Å; H151-M155 PolarHBondContact O-N 2.96Å; K152-M155 PolarHBondContact O-N 3.15Å; K153-M155 VanDerWaalsContact C-N 3.32Å; K153-M155 PolarHBondContact O-N 3.04Å; M155-R159 VanDerWaalsContact O-CB 3.31Å; M155-R159 WeakPolarHBondContact O-CB 3.2Å; M155-R159 VanDerWaalsContact O-CG 3.24Å; M155-R159 WeakPolarHBondContact O-CG 3.39Å; M155-R159 PolarHBondContact O-N 3.34Å
156	I	54.9	Low	57	Low	102 Å²	102	78.4 Å²	78.4	52%	0.523	39%	0.387	S	S	.	.	H	α-helix	trans	-67.9	-44.3	174.3	-67.5	163.3	0	0	0	110.1	K152 K153 D154 W158 R159 L160	K152-I156 WeakPolarHBondContact O-CG1 3.41Å; K152-I156 PolarHBondContact O-N 3.43Å; K152-I156 VanDerWaalsContact O-N 3.12Å; K153-I156 CarbonylContact O-C 3.55Å; K153-I156 WeakPolarHBondContact O-CA 3.45Å; K153-I156 WeakPolarHBondContact O-CB 3.41Å; K153-I156 PolarHBondContact O-N 2.92Å; D154-I156 VanDerWaalsContact C-N 3.33Å; D154-I156 PolarHBondContact O-N 2.68Å; I156-W158 VanDerWaalsContact C-N 3.31Å; I156-W158 PolarHBondContact O-N 2.83Å; I156-R159 WeakPolarHBondContact O-CB 3.37Å; I156-R159 PolarHBondContact O-N 3.3Å; I156-L160 HydrophobicContact CG2-CD1 3.92Å; I156-L160 WeakPolarHBondContact O-CB 3.35Å; I156-L160 WeakPolarHBondContact O-CG 3.25Å; I156-L160 PolarHBondContact O-N 2.87Å
157	L	51	Low	55.5	Low	47 Å²	47	78.2 Å²	78.2	25%	0.246	39%	0.392	C	S	.	.	H	α-helix	trans	-67.6	-35.4	179.8	-143.4	114.2	0	0	0	111.4	K153 D154 L160 S161 T182 V183 L186	K153-L157 WeakPolarHBondContact O-CB 3.49Å; K153-L157 PolarHBondContact O-N 2.84Å; D154-L157 PolarHBondContact O-N 2.77Å; L157-L160 PolarHBondContact O-N 2.86Å; L157-S161 WeakPolarHBondContact O-CB 3.34Å; L157-S161 PolarHBondContact O-N 3.37Å; L157-S161 PolarHBondContact O-OG 3.45Å; L157-T182 HydrophobicContact CD2-CG2 4.29Å; L157-V183 HydrophobicContact CD2-CG2 3.72Å; L157-L186 HydrophobicContact CD1-CD1 3.61Å; L157-L186 HydrophobicContact CD2-CD1 3.28Å; L157-L186 HydrophobicContact CG-CD1 4Å
158	W	48.1	Very low	54.3	Low	163 Å²	163	83.4 Å²	83.4	62%	0.617	42%	0.42	S	S	*	.	H	α-helix	trans	-70.4	-37.4	172.8	-165	79.9	0	0	0	111.5	D154 I156 S161 I162	D154-W158 WeakPolarHBondContact O-CA 3.48Å; D154-W158 WeakPolarHBondContact O-CB 3.42Å; D154-W158 PolarHBondContact O-N 2.89Å; I156-W158 VanDerWaalsContact C-N 3.31Å; I156-W158 PolarHBondContact O-N 2.83Å; W158-S161 VanDerWaalsContact O-CB 3.27Å; W158-S161 WeakPolarHBondContact O-CB 3.31Å; W158-S161 PolarHBondContact O-N 3.27Å; W158-I162 HydrophobicContact CD2-CD1 3.88Å; W158-I162 HydrophobicContact CE3-CD1 3.42Å; W158-I162 VanDerWaalsContact CE3-CD1 3.42Å; W158-I162 HydrophobicContact CE3-CG1 4.47Å; W158-I162 HydrophobicContact CH2-CD1 3.46Å; W158-I162 VanDerWaalsContact CH2-CD1 3.46Å; W158-I162 HydrophobicContact CZ2-CD1 3.89Å; W158-I162 HydrophobicContact CZ3-CD1 3.19Å; W158-I162 WeakPolarHBondContact O-CG1 3.28Å; W158-I162 PolarHBondContact O-N 2.86Å
159	R	55	Low	53.3	Low	172 Å²	172	91.9 Å²	91.9	65%	0.649	45%	0.452	S	S	*	.	H	α-helix	trans	-63.8	-45.4	170.1	-81.5	177.3	168.3	-160.1	-3.9	111.9	M155 I156 S161 I162 T163	M155-R159 VanDerWaalsContact O-CB 3.31Å; M155-R159 WeakPolarHBondContact O-CB 3.2Å; M155-R159 VanDerWaalsContact O-CG 3.24Å; M155-R159 WeakPolarHBondContact O-CG 3.39Å; M155-R159 PolarHBondContact O-N 3.34Å; I156-R159 WeakPolarHBondContact O-CB 3.37Å; I156-R159 PolarHBondContact O-N 3.3Å; R159-S161 VanDerWaalsContact C-N 3.26Å; R159-S161 PolarHBondContact O-N 2.85Å; R159-I162 PolarHBondContact O-N 2.98Å; R159-T163 PolarHBondContact O-N 2.88Å; R159-T163 PolarHBondContact O-OG1 2.89Å
160	L	54.9	Low	53.3	Low	93 Å²	93	94.5 Å²	94.5	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-60.4	-40	173.3	-77.3	160.4	0	0	0	110.8	I156 L157 I162 T163 I164	I156-L160 HydrophobicContact CG2-CD1 3.92Å; I156-L160 WeakPolarHBondContact O-CB 3.35Å; I156-L160 WeakPolarHBondContact O-CG 3.25Å; I156-L160 PolarHBondContact O-N 2.87Å; L157-L160 PolarHBondContact O-N 2.86Å; L160-I162 VanDerWaalsContact C-N 3.33Å; L160-I162 PolarHBondContact O-N 3.1Å; L160-T163 PolarHBondContact O-N 3.5Å; L160-I164 WeakPolarHBondContact O-CB 3.5Å; L160-I164 VanDerWaalsContact O-CG1 3.26Å; L160-I164 WeakPolarHBondContact O-CG1 3.4Å; L160-I164 PolarHBondContact O-N 3.48Å
161	S	53.1	Low	53.5	Low	9 Å²	9	97.2 Å²	97.2	6%	0.063	47%	0.474	C	S	.	.	H	α-helix	trans	-58.2	-46.7	175.1	-61.8	0	0	0	0	111.4	L157 W158 R159 I164 L165 L179	L157-S161 WeakPolarHBondContact O-CB 3.34Å; L157-S161 PolarHBondContact O-N 3.37Å; L157-S161 PolarHBondContact O-OG 3.45Å; W158-S161 VanDerWaalsContact O-CB 3.27Å; W158-S161 WeakPolarHBondContact O-CB 3.31Å; W158-S161 PolarHBondContact O-N 3.27Å; R159-S161 VanDerWaalsContact C-N 3.26Å; R159-S161 PolarHBondContact O-N 2.85Å; S161-I164 PolarHBondContact O-N 3.16Å; S161-L165 WeakPolarHBondContact O-CB 3.32Å; S161-L165 WeakPolarHBondContact O-CD1 3.2Å; S161-L165 PolarHBondContact O-N 2.89Å; S161-L179 VanDerWaalsContact CA-CD2 3.43Å; S161-L179 VanDerWaalsContact OG-CD1 3.28Å; S161-L179 WeakPolarHBondContact OG-CD1 3.35Å; S161-L179 WeakPolarHBondContact OG-CG 3.41Å
162	I	53.9	Low	53.9	Low	61 Å²	61	96.7 Å²	96.7	31%	0.313	47%	0.468	S	S	.	.	H	α-helix	trans	-63.3	-45.2	175.6	-71.8	169.4	0	0	0	110.8	W158 R159 L160 I164 L165 L166	W158-I162 HydrophobicContact CD2-CD1 3.88Å; W158-I162 HydrophobicContact CE3-CD1 3.42Å; W158-I162 VanDerWaalsContact CE3-CD1 3.42Å; W158-I162 HydrophobicContact CE3-CG1 4.47Å; W158-I162 HydrophobicContact CH2-CD1 3.46Å; W158-I162 VanDerWaalsContact CH2-CD1 3.46Å; W158-I162 HydrophobicContact CZ2-CD1 3.89Å; W158-I162 HydrophobicContact CZ3-CD1 3.19Å; W158-I162 WeakPolarHBondContact O-CG1 3.28Å; W158-I162 PolarHBondContact O-N 2.86Å; R159-I162 PolarHBondContact O-N 2.98Å; L160-I162 VanDerWaalsContact C-N 3.33Å; L160-I162 PolarHBondContact O-N 3.1Å; I162-I164 VanDerWaalsContact C-N 3.29Å; I162-I164 PolarHBondContact O-N 3.48Å; I162-L165 CarbonylContact O-C 3.56Å; I162-L165 WeakPolarHBondContact O-CA 3.43Å; I162-L165 WeakPolarHBondContact O-CB 3.32Å; I162-L165 PolarHBondContact O-N 2.82Å; I162-L165 VanDerWaalsContact O-N 3.14Å; I162-L166 HydrophobicContact CG2-CD1 3.81Å; I162-L166 HydrophobicContact CG2-CG 4.26Å; I162-L166 WeakPolarHBondContact O-CB 3.21Å; I162-L166 VanDerWaalsContact O-CG 3.23Å; I162-L166 WeakPolarHBondContact O-CG 3.34Å; I162-L166 PolarHBondContact O-N 2.82Å
163	T	55.2	Low	54.3	Low	91 Å²	91	100.5 Å²	100.5	56%	0.558	48%	0.478	S	S	*	.	H	α-helix	trans	-60.4	-40.3	178	-52.5	0	0	0	0	111.8	R159 L160 L166 S167	R159-T163 PolarHBondContact O-N 2.88Å; R159-T163 PolarHBondContact O-OG1 2.89Å; L160-T163 PolarHBondContact O-N 3.5Å; T163-L166 CarbonylContact O-C 3.58Å; T163-L166 PolarHBondContact O-N 2.89Å; T163-S167 PolarHBondContact O-N 2.82Å; T163-S167 VanDerWaalsContact O-N 3.11Å
164	I	56.1	Low	54.8	Low	44 Å²	44	99.7 Å²	99.7	23%	0.226	48%	0.482	C	S	.	.	H	α-helix	trans	-67.5	-41.2	175	-67.9	165.4	0	0	0	110.7	L160 S161 I162 L166 S167 Y175 L179	L160-I164 WeakPolarHBondContact O-CB 3.5Å; L160-I164 VanDerWaalsContact O-CG1 3.26Å; L160-I164 WeakPolarHBondContact O-CG1 3.4Å; L160-I164 PolarHBondContact O-N 3.48Å; S161-I164 PolarHBondContact O-N 3.16Å; I162-I164 VanDerWaalsContact C-N 3.29Å; I162-I164 PolarHBondContact O-N 3.48Å; I164-L166 PolarHBondContact O-N 2.88Å; I164-S167 VanDerWaalsContact O-CB 3.31Å; I164-S167 WeakPolarHBondContact O-CB 3.36Å; I164-S167 PolarHBondContact O-N 2.79Å; I164-S167 PolarHBondContact O-OG 3.31Å; I164-Y175 HydrophobicContact CG2-CG 4.41Å; I164-L179 HydrophobicContact CB-CD2 4.43Å; I164-L179 HydrophobicContact CD1-CD1 4.21Å; I164-L179 HydrophobicContact CD1-CD2 4.41Å; I164-L179 HydrophobicContact CG2-CD2 4.41Å
165	L	53.7	Low	55.1	Low	84 Å²	84	103.6 Å²	103.6	44%	0.44	50%	0.496	S	S	.	.	H	α-helix	trans	-60.6	-31.1	172.6	-101.4	136	0	0	0	112.4	S161 I162 S167 R172 L176	S161-L165 WeakPolarHBondContact O-CB 3.32Å; S161-L165 WeakPolarHBondContact O-CD1 3.2Å; S161-L165 PolarHBondContact O-N 2.89Å; I162-L165 CarbonylContact O-C 3.56Å; I162-L165 WeakPolarHBondContact O-CA 3.43Å; I162-L165 WeakPolarHBondContact O-CB 3.32Å; I162-L165 PolarHBondContact O-N 2.82Å; I162-L165 VanDerWaalsContact O-N 3.14Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-R172 PolarHBondContact O-NE 3.36Å; L165-R172 PolarHBondContact O-NH2 2.9Å; L165-R172 VanDerWaalsContact O-NH2 3.13Å; L165-L176 HydrophobicContact CD1-CD1 3.94Å; L165-L176 HydrophobicContact CD2-CD1 4.41Å; L165-L176 HydrophobicContact CG-CD1 3.98Å
166	L	57.6	Low	55.6	Low	133 Å²	133	103 Å²	103	70%	0.696	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-8.8	174.8	-66.2	171.9	0	0	0	113.2	I162 T163 I164	I162-L166 HydrophobicContact CG2-CD1 3.81Å; I162-L166 HydrophobicContact CG2-CG 4.26Å; I162-L166 WeakPolarHBondContact O-CB 3.21Å; I162-L166 VanDerWaalsContact O-CG 3.23Å; I162-L166 WeakPolarHBondContact O-CG 3.34Å; I162-L166 PolarHBondContact O-N 2.82Å; T163-L166 CarbonylContact O-C 3.58Å; T163-L166 PolarHBondContact O-N 2.89Å; I164-L166 PolarHBondContact O-N 2.88Å
167	S	57.4	Low	55.8	Low	39 Å²	39	101.4 Å²	101.4	27%	0.273	49%	0.492	S	S	.	.	S	Bend	trans	-76.8	169.5	177.1	79.3	0	0	0	0	112.9	T163 I164 L165 R172	T163-S167 PolarHBondContact O-N 2.82Å; T163-S167 VanDerWaalsContact O-N 3.11Å; I164-S167 VanDerWaalsContact O-CB 3.31Å; I164-S167 WeakPolarHBondContact O-CB 3.36Å; I164-S167 PolarHBondContact O-N 2.79Å; I164-S167 PolarHBondContact O-OG 3.31Å; L165-S167 VanDerWaalsContact C-N 3.33Å; S167-R172 PolarHBondContact O-NE 3.47Å; S167-R172 PolarHBondContact O-NH2 3.12Å
168	D	60.6	Low	56.1	Low	131 Å²	131	105.1 Å²	105.1	70%	0.701	51%	0.508	S	S	*	.			trans	-58.9	151.2	-174.2	-159.4	0.2	0	0	0	113.1	S170 M171 R172	D168-S170 VanDerWaalsContact C-N 3.32Å; D168-S170 PolarHBondContact O-N 2.94Å; D168-M171 PolarHBondContact O-N 2.91Å; D168-R172 PolarHBondContact O-N 3.48Å
169	Y	56.2	Low	56.7	Low	185 Å²	185	98.4 Å²	98.4	73%	0.725	48%	0.483	S	S	*	.	H	α-helix	trans	-60.5	-37.6	-165.5	-166.3	-94	0	0	0	113.4	M171 R172	Y169-M171 VanDerWaalsContact C-N 3.26Å; Y169-M171 PolarHBondContact O-N 2.94Å; Y169-R172 PolarHBondContact O-N 2.86Å; Y169-R172 VanDerWaalsContact O-N 3.13Å
170	S	62	Low	56.7	Low	107 Å²	107	95.5 Å²	95.5	75%	0.748	48%	0.481	S	S	*	.	H	α-helix	trans	-59.6	-35.9	178.2	-177.3	0	0	0	0	112.4	D168	D168-S170 VanDerWaalsContact C-N 3.32Å; D168-S170 PolarHBondContact O-N 2.94Å
171	M	54.3	Low	56.8	Low	88 Å²	88	97.5 Å²	97.5	43%	0.433	49%	0.486	S	S	.	.	H	α-helix	trans	-77.8	-27.3	177.7	-69.4	-77.1	-81.9	0	0	112.4	D168 Y169 R173 Y175	D168-M171 PolarHBondContact O-N 2.91Å; Y169-M171 VanDerWaalsContact C-N 3.26Å; Y169-M171 PolarHBondContact O-N 2.94Å; M171-R173 PolarHBondContact O-N 3.07Å; M171-Y175 HydrophobicContact CB-CD2 4.26Å; M171-Y175 HydrophobicContact CE-CD2 3.96Å; M171-Y175 HydrophobicContact CE-CE1 4.37Å; M171-Y175 HydrophobicContact CE-CE2 3.25Å; M171-Y175 VanDerWaalsContact CE-CZ 3.49Å; M171-Y175 WeakPolarHBondContact O-CB 3.27Å; M171-Y175 WeakPolarHBondContact O-CD2 3.17Å; M171-Y175 PolarHBondContact O-N 3.46Å; M171-Y175 HydrophobicContact SD-CD2 4.04Å; M171-Y175 HydrophobicContact SD-CE2 3.43Å; M171-Y175 WeakPolarHBondContact SD-CE2 3.1Å
172	R	54.7	Low	56.6	Low	101 Å²	101	99.8 Å²	99.8	38%	0.381	50%	0.499	S	S	.	.	H	α-helix	trans	-60.4	-45.2	-172.8	-72.8	-178.2	-170	-173.6	-0.8	113.7	L165 S167 D168 Y169 L176	L165-R172 PolarHBondContact O-NE 3.36Å; L165-R172 PolarHBondContact O-NH2 2.9Å; L165-R172 VanDerWaalsContact O-NH2 3.13Å; S167-R172 PolarHBondContact O-NE 3.47Å; S167-R172 PolarHBondContact O-NH2 3.12Å; D168-R172 PolarHBondContact O-N 3.48Å; Y169-R172 PolarHBondContact O-N 2.86Å; Y169-R172 VanDerWaalsContact O-N 3.13Å; R172-L176 WeakPolarHBondContact O-CA 3.21Å; R172-L176 WeakPolarHBondContact O-CB 3.32Å; R172-L176 PolarHBondContact O-N 3.37Å
173	R	57.2	Low	56.7	Low	226 Å²	226	98.5 Å²	98.5	85%	0.853	49%	0.494	S	S	*	.	H	α-helix	trans	-68.8	-44.5	-167.3	-157.5	175.8	-174.9	-172	0.8	112.9	M171	M171-R173 PolarHBondContact O-N 3.07Å
174	T	58.8	Low	56.7	Low	92 Å²	92	97.6 Å²	97.6	56%	0.564	49%	0.488	S	S	*	.	H	α-helix	trans	-76.1	-39.3	-179.8	-45.2	0	0	0	0	111.9	S177 H178	T174-S177 PolarHBondContact O-OG 2.95Å; T174-S177 VanDerWaalsContact O-OG 3.07Å; T174-H178 PolarHBondContact O-N 3Å
175	Y	54.6	Low	56.5	Low	115 Å²	115	99.5 Å²	99.5	45%	0.451	50%	0.498	S	S	.	.	H	α-helix	trans	-74.7	-35.6	179.3	-77.4	-97.4	0	0	0	112.1	I164 M171 S177 H178 L179	I164-Y175 HydrophobicContact CG2-CG 4.41Å; M171-Y175 HydrophobicContact CB-CD2 4.26Å; M171-Y175 HydrophobicContact CE-CD2 3.96Å; M171-Y175 HydrophobicContact CE-CE1 4.37Å; M171-Y175 HydrophobicContact CE-CE2 3.25Å; M171-Y175 VanDerWaalsContact CE-CZ 3.49Å; M171-Y175 WeakPolarHBondContact O-CB 3.27Å; M171-Y175 WeakPolarHBondContact O-CD2 3.17Å; M171-Y175 PolarHBondContact O-N 3.46Å; M171-Y175 HydrophobicContact SD-CD2 4.04Å; M171-Y175 HydrophobicContact SD-CE2 3.43Å; M171-Y175 WeakPolarHBondContact SD-CE2 3.1Å; Y175-S177 PolarHBondContact O-N 2.78Å; Y175-H178 PolarHBondContact O-N 3.38Å; Y175-L179 WeakPolarHBondContact O-CA 3.1Å; Y175-L179 WeakPolarHBondContact O-CB 3.49Å; Y175-L179 PolarHBondContact O-N 2.96Å
176	L	59	Low	56.4	Low	79 Å²	79	97.9 Å²	97.9	41%	0.414	49%	0.49	S	S	.	.	H	α-helix	trans	-65.7	-37.9	-178.7	-169.7	73.1	0	0	0	112	L165 R172 L180	L165-L176 HydrophobicContact CD1-CD1 3.94Å; L165-L176 HydrophobicContact CD2-CD1 4.41Å; L165-L176 HydrophobicContact CG-CD1 3.98Å; R172-L176 WeakPolarHBondContact O-CA 3.21Å; R172-L176 WeakPolarHBondContact O-CB 3.32Å; R172-L176 PolarHBondContact O-N 3.37Å; L176-L180 WeakPolarHBondContact O-CB 3.16Å; L176-L180 PolarHBondContact O-N 2.89Å
177	S	58.4	Low	56.2	Low	70 Å²	70	95 Å²	95	49%	0.49	48%	0.475	S	S	.	.	H	α-helix	trans	-66.9	-47.7	176.5	61.5	0	0	0	0	111.5	T174 Y175 L179 L180 F181	T174-S177 PolarHBondContact O-OG 2.95Å; T174-S177 VanDerWaalsContact O-OG 3.07Å; Y175-S177 PolarHBondContact O-N 2.78Å; S177-L179 VanDerWaalsContact C-N 3.34Å; S177-L179 PolarHBondContact O-N 2.88Å; S177-L180 PolarHBondContact O-N 3.48Å; S177-F181 VanDerWaalsContact O-CB 3.29Å; S177-F181 WeakPolarHBondContact O-CB 3.44Å; S177-F181 PolarHBondContact O-N 2.71Å
178	H	57.3	Low	56	Low	125 Å²	125	99 Å²	99	58%	0.579	49%	0.489	S	S	*	.	H	α-helix	trans	-61.9	-41.6	175.4	-96.3	-81.6	0	0	0	112.4	T174 Y175 T182	T174-H178 PolarHBondContact O-N 3Å; Y175-H178 PolarHBondContact O-N 3.38Å; H178-T182 VanDerWaalsContact O-CB 3.29Å; H178-T182 WeakPolarHBondContact O-CB 3.38Å; H178-T182 PolarHBondContact O-N 2.92Å; H178-T182 PolarHBondContact O-OG1 3.01Å
179	L	60.2	Low	55.9	Low	21 Å²	21	97 Å²	97	11%	0.11	48%	0.478	C	S	.	.	H	α-helix	trans	-68.5	-45.4	179.3	-178.8	71.8	0	0	0	111.3	S161 I164 Y175 S177 F181 T182 V183	S161-L179 VanDerWaalsContact CA-CD2 3.43Å; S161-L179 VanDerWaalsContact OG-CD1 3.28Å; S161-L179 WeakPolarHBondContact OG-CD1 3.35Å; S161-L179 WeakPolarHBondContact OG-CG 3.41Å; I164-L179 HydrophobicContact CB-CD2 4.43Å; I164-L179 HydrophobicContact CD1-CD1 4.21Å; I164-L179 HydrophobicContact CD1-CD2 4.41Å; I164-L179 HydrophobicContact CG2-CD2 4.41Å; Y175-L179 WeakPolarHBondContact O-CA 3.1Å; Y175-L179 WeakPolarHBondContact O-CB 3.49Å; Y175-L179 PolarHBondContact O-N 2.96Å; S177-L179 VanDerWaalsContact C-N 3.34Å; S177-L179 PolarHBondContact O-N 2.88Å; L179-F181 VanDerWaalsContact C-N 3.32Å; L179-F181 PolarHBondContact O-N 3.49Å; L179-T182 CarbonylContact O-C 3.55Å; L179-T182 PolarHBondContact O-N 2.74Å; L179-V183 WeakPolarHBondContact O-CB 3.42Å; L179-V183 VanDerWaalsContact O-CG2 3.26Å; L179-V183 WeakPolarHBondContact O-CG2 3.25Å; L179-V183 PolarHBondContact O-N 2.85Å
180	L	56.4	Low	56.6	Low	112 Å²	112	88.7 Å²	88.7	59%	0.586	45%	0.445	S	S	*	.	H	α-helix	trans	-61.1	-45.2	175.5	-174.7	72.2	0	0	0	110.1	L176 S177 T182 V183 V184	L176-L180 WeakPolarHBondContact O-CB 3.16Å; L176-L180 PolarHBondContact O-N 2.89Å; S177-L180 PolarHBondContact O-N 3.48Å; L180-T182 VanDerWaalsContact C-N 3.34Å; L180-T182 PolarHBondContact O-N 2.72Å; L180-V183 PolarHBondContact O-N 2.79Å; L180-V184 HydrophobicContact CG-CG2 4.45Å; L180-V184 WeakPolarHBondContact O-CB 3.44Å; L180-V184 WeakPolarHBondContact O-CG2 3.45Å; L180-V184 PolarHBondContact O-N 3.12Å
181	F	56.2	Low	57.7	Low	135 Å²	135	86.6 Å²	86.6	59%	0.592	42%	0.423	S	S	*	.	H	α-helix	trans	-59.3	-45.1	174	-178.3	-96.6	0	0	0	111.5	S177 L179 V184 L185	S177-F181 VanDerWaalsContact O-CB 3.29Å; S177-F181 WeakPolarHBondContact O-CB 3.44Å; S177-F181 PolarHBondContact O-N 2.71Å; L179-F181 VanDerWaalsContact C-N 3.32Å; L179-F181 PolarHBondContact O-N 3.49Å; F181-V184 PolarHBondContact O-N 3.04Å; F181-L185 HydrophobicContact CE1-CD2 4.23Å; F181-L185 WeakPolarHBondContact O-CB 3.49Å; F181-L185 PolarHBondContact O-N 3.02Å
182	T	49.8	Very low	59.4	Low	56 Å²	56	82.4 Å²	82.4	34%	0.344	40%	0.402	S	S	.	.	H	α-helix	trans	-64.4	-43.3	178.6	-56.2	0	0	0	0	111.4	L157 H178 L179 L180 L185 L186	L157-T182 HydrophobicContact CD2-CG2 4.29Å; H178-T182 VanDerWaalsContact O-CB 3.29Å; H178-T182 WeakPolarHBondContact O-CB 3.38Å; H178-T182 PolarHBondContact O-N 2.92Å; H178-T182 PolarHBondContact O-OG1 3.01Å; L179-T182 CarbonylContact O-C 3.55Å; L179-T182 PolarHBondContact O-N 2.74Å; L180-T182 VanDerWaalsContact C-N 3.34Å; L180-T182 PolarHBondContact O-N 2.72Å; T182-L185 PolarHBondContact O-N 3.12Å; T182-L186 HydrophobicContact CG2-CD1 3.81Å; T182-L186 HydrophobicContact CG2-CG 4.34Å; T182-L186 VanDerWaalsContact O-CB 3.27Å; T182-L186 WeakPolarHBondContact O-CB 3.35Å; T182-L186 WeakPolarHBondContact O-CD1 3.5Å; T182-L186 WeakPolarHBondContact O-CG 3.31Å; T182-L186 PolarHBondContact O-N 2.96Å
183	V	54.6	Low	61.3	Low	35 Å²	35	77.6 Å²	77.6	21%	0.212	38%	0.384	C	S	.	.	H	α-helix	trans	-64.8	-46.7	176.4	170.1	0	0	0	0	110.4	L157 L179 L180 L185 L186 L187	L157-V183 HydrophobicContact CD2-CG2 3.72Å; L179-V183 WeakPolarHBondContact O-CB 3.42Å; L179-V183 VanDerWaalsContact O-CG2 3.26Å; L179-V183 WeakPolarHBondContact O-CG2 3.25Å; L179-V183 PolarHBondContact O-N 2.85Å; L180-V183 PolarHBondContact O-N 2.79Å; V183-L185 VanDerWaalsContact C-N 3.33Å; V183-L185 PolarHBondContact O-N 3.18Å; V183-L186 PolarHBondContact O-N 2.63Å; V183-L187 HydrophobicContact CG1-CD1 3.89Å; V183-L187 HydrophobicContact CG1-CG 4.3Å; V183-L187 WeakPolarHBondContact O-CB 3.27Å; V183-L187 WeakPolarHBondContact O-CG 3.49Å; V183-L187 PolarHBondContact O-N 2.98Å
184	V	55.3	Low	63.1	Low	72 Å²	72	68.6 Å²	68.6	44%	0.436	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-43.5	177.1	170.4	0	0	0	0	110.8	L180 F181 L187 Q188	L180-V184 HydrophobicContact CG-CG2 4.45Å; L180-V184 WeakPolarHBondContact O-CB 3.44Å; L180-V184 WeakPolarHBondContact O-CG2 3.45Å; L180-V184 PolarHBondContact O-N 3.12Å; F181-V184 PolarHBondContact O-N 3.04Å; V184-L187 PolarHBondContact O-N 2.87Å; V184-Q188 HydrophobicContact CG1-CG 4.48Å; V184-Q188 WeakPolarHBondContact O-CB 2.81Å; V184-Q188 WeakPolarHBondContact O-CG 3.2Å; V184-Q188 PolarHBondContact O-N 3.35Å
185	L	51.4	Low	64.9	Low	83 Å²	83	64.2 Å²	64.2	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-63.3	-46.3	176.3	-174.6	68.2	0	0	0	111.1	F181 T182 V183 L187 Q188 I189	F181-L185 HydrophobicContact CE1-CD2 4.23Å; F181-L185 WeakPolarHBondContact O-CB 3.49Å; F181-L185 PolarHBondContact O-N 3.02Å; T182-L185 PolarHBondContact O-N 3.12Å; V183-L185 VanDerWaalsContact C-N 3.33Å; V183-L185 PolarHBondContact O-N 3.18Å; L185-L187 VanDerWaalsContact C-N 3.33Å; L185-L187 PolarHBondContact O-N 3.1Å; L185-Q188 WeakPolarHBondContact O-CB 3.34Å; L185-Q188 PolarHBondContact O-N 3.08Å; L185-Q188 VanDerWaalsContact O-N 3.12Å; L185-I189 HydrophobicContact CD1-CD1 4.5Å; L185-I189 HydrophobicContact CG-CD1 3.89Å; L185-I189 WeakPolarHBondContact O-CD1 3.31Å; L185-I189 WeakPolarHBondContact O-CG1 3.49Å; L185-I189 PolarHBondContact O-N 2.76Å
186	L	52.6	Low	66.7	Low	50 Å²	50	59.8 Å²	59.8	26%	0.262	31%	0.311	S	S	.	.	H	α-helix	trans	-62.2	-40.1	176.7	-75.1	167	0	0	0	112	L157 T182 V183 Q188 I189 Q190	L157-L186 HydrophobicContact CD1-CD1 3.61Å; L157-L186 HydrophobicContact CD2-CD1 3.28Å; L157-L186 HydrophobicContact CG-CD1 4Å; T182-L186 HydrophobicContact CG2-CD1 3.81Å; T182-L186 HydrophobicContact CG2-CG 4.34Å; T182-L186 VanDerWaalsContact O-CB 3.27Å; T182-L186 WeakPolarHBondContact O-CB 3.35Å; T182-L186 WeakPolarHBondContact O-CD1 3.5Å; T182-L186 WeakPolarHBondContact O-CG 3.31Å; T182-L186 PolarHBondContact O-N 2.96Å; V183-L186 PolarHBondContact O-N 2.63Å; L186-Q188 VanDerWaalsContact C-N 3.31Å; L186-Q188 PolarHBondContact O-N 2.77Å; L186-I189 PolarHBondContact O-N 2.77Å; L186-Q190 WeakPolarHBondContact O-CG 3.48Å; L186-Q190 PolarHBondContact O-NE2 2.66Å
187	L	52.4	Low	68.1	Low	74 Å²	74	56.9 Å²	56.9	39%	0.387	30%	0.299	S	S	.	.	H	α-helix	trans	-66.8	-31.8	174.5	-70.7	173.7	0	0	0	112.2	W146 V183 V184 L185	W146-L187 HydrophobicContact CH2-CD2 4.33Å; W146-L187 HydrophobicContact CZ3-CD2 4.25Å; V183-L187 HydrophobicContact CG1-CD1 3.89Å; V183-L187 HydrophobicContact CG1-CG 4.3Å; V183-L187 WeakPolarHBondContact O-CB 3.27Å; V183-L187 WeakPolarHBondContact O-CG 3.49Å; V183-L187 PolarHBondContact O-N 2.98Å; V184-L187 PolarHBondContact O-N 2.87Å; L185-L187 VanDerWaalsContact C-N 3.33Å; L185-L187 PolarHBondContact O-N 3.1Å
188	Q	54.6	Low	69.5	Low	122 Å²	122	55.5 Å²	55.5	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-72.3	-41.8	174.9	-69.8	-110.6	-30.2	0	0	111.8	V184 L185 L186 Q190 K191	V184-Q188 HydrophobicContact CG1-CG 4.48Å; V184-Q188 WeakPolarHBondContact O-CB 2.81Å; V184-Q188 WeakPolarHBondContact O-CG 3.2Å; V184-Q188 PolarHBondContact O-N 3.35Å; L185-Q188 WeakPolarHBondContact O-CB 3.34Å; L185-Q188 PolarHBondContact O-N 3.08Å; L185-Q188 VanDerWaalsContact O-N 3.12Å; L186-Q188 VanDerWaalsContact C-N 3.31Å; L186-Q188 PolarHBondContact O-N 2.77Å; Q188-Q190 PolarHBondContact O-N 3.45Å; Q188-K191 PolarHBondContact O-N 3.43Å
189	I	57.7	Low	70.7	Confident	89 Å²	89	55.6 Å²	55.6	46%	0.456	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-20.6	-177.5	-71	162.2	0	0	0	112.4	L185 L186 Q210	L185-I189 HydrophobicContact CD1-CD1 4.5Å; L185-I189 HydrophobicContact CG-CD1 3.89Å; L185-I189 WeakPolarHBondContact O-CD1 3.31Å; L185-I189 WeakPolarHBondContact O-CG1 3.49Å; L185-I189 PolarHBondContact O-N 2.76Å; L186-I189 PolarHBondContact O-N 2.77Å; I189-Q210 PolarHBondContact O-NE2 2.92Å
190	Q	72.4	Confident	71.8	Confident	11 Å²	11	62 Å²	62	5%	0.051	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-17.5	-173.8	-65.7	173.6	16.4	0	0	114.7	W146 L147 T150 D154 L186 Q188 V192	W146-Q190 VanDerWaalsContact CA-O 3.25Å; W146-Q190 WeakPolarHBondContact CA-O 3.17Å; W146-Q190 HydrophobicContact CD2-CB 4.38Å; W146-Q190 HydrophobicContact CE3-CB 3.48Å; W146-Q190 VanDerWaalsContact CE3-CB 3.48Å; W146-Q190 HydrophobicContact CE3-CG 4.49Å; W146-Q190 HydrophobicContact CZ3-CB 3.86Å; L147-Q190 PolarHBondContact N-O 2.8Å; L147-Q190 VanDerWaalsContact N-O 3.1Å; T150-Q190 VanDerWaalsContact CB-CD 3.5Å; T150-Q190 HydrophobicContact CG2-CG 3.96Å; T150-Q190 PolarHBondContact OG1-NE2 3.26Å; T150-Q190 PolarHBondContact OG1-OE1 2.78Å; D154-Q190 VanDerWaalsContact CG-NE2 3.3Å; D154-Q190 PolarHBondContact OD1-NE2 2.88Å; D154-Q190 VanDerWaalsContact OD1-NE2 3.09Å; D154-Q190 PolarHBondContact OD2-NE2 3.39Å; D154-Q190 PolarHBondContact OD2-OE1 3.31Å; L186-Q190 WeakPolarHBondContact O-CG 3.48Å; L186-Q190 PolarHBondContact O-NE2 2.66Å; Q188-Q190 PolarHBondContact O-N 3.45Å; Q190-V192 PolarHBondContact O-N 2.77Å
191	K	84	Confident	73.3	Confident	63 Å²	63	57 Å²	57	27%	0.274	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.7	-177.7	-63.7	178.1	-174.7	179.6	0	109.4	L144 W146 Q188 L209 Q210	L144-K191 HydrophobicContact CD1-CB 4.46Å; L144-K191 HydrophobicContact CD1-CD 4.28Å; L144-K191 HydrophobicContact CD1-CG 4.37Å; L144-K191 HydrophobicContact CD2-CD 3.99Å; L144-K191 HydrophobicContact CD2-CG 4.17Å; L144-K191 HydrophobicContact CG-CG 4.47Å; W146-K191 HydrophobicContact CD2-CG 4.36Å; W146-K191 HydrophobicContact CH2-CG 4.33Å; W146-K191 HydrophobicContact CZ2-CD 4.4Å; W146-K191 HydrophobicContact CZ2-CG 3.9Å; Q188-K191 PolarHBondContact O-N 3.43Å; K191-L209 HydrophobicContact CB-CB 4.48Å; K191-L209 HydrophobicContact CB-CD1 3.93Å; K191-Q210 WeakPolarHBondContact O-CG 3.49Å; K191-Q210 PolarHBondContact O-NE2 3.12Å
192	V	90.7	Very high	74.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-45.4	-174.1	-171.2	0	0	0	0	111.8	L90 L131 I145 L147 Q190 L209 Q210 L214 V416	L90-V192 HydrophobicContact CD1-CG1 4.49Å; L90-V192 HydrophobicContact CD1-CG2 4.38Å; L131-V192 HydrophobicContact CD2-CG2 4.42Å; I145-V192 PolarHBondContact O-N 2.98Å; L147-V192 HydrophobicContact CD1-CG2 4.45Å; L147-V192 HydrophobicContact CD2-CG2 4.1Å; L147-V192 HydrophobicContact CG-CG2 3.62Å; Q190-V192 PolarHBondContact O-N 2.77Å; V192-L209 PolarHBondContact O-N 3.25Å; V192-Q210 HydrophobicContact CG1-CG 4.45Å; V192-L214 HydrophobicContact CG1-CD1 3.67Å; V192-V416 HydrophobicContact CB-CG2 4.41Å; V192-V416 HydrophobicContact CG1-CB 4.46Å; V192-V416 HydrophobicContact CG1-CG1 4.19Å; V192-V416 HydrophobicContact CG1-CG2 3.45Å; V192-V416 VanDerWaalsContact CG1-CG2 3.45Å
193	A	94.7	Very high	76.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	158.8	-176.9	0	0	0	0	0	112.2	I145 V206 K207 L218 V416	I145-A193 HydrophobicContact CB-CB 4.3Å; I145-A193 WeakPolarHBondContact CB-O 3.19Å; I145-A193 HydrophobicContact CD1-CB 4.22Å; I145-A193 PolarHBondContact N-O 2.8Å; I145-A193 PolarHBondContact O-N 3.18Å; A193-V206 HydrophobicContact CB-CG1 4.37Å; A193-K207 CarbonylContact C-O 3.44Å; A193-K207 WeakPolarHBondContact CA-O 3.26Å; A193-K207 VanDerWaalsContact CB-O 3.32Å; A193-K207 WeakPolarHBondContact CB-O 3.5Å; A193-L218 HydrophobicContact CB-CD1 4.05Å; A193-V416 HydrophobicContact CB-CG1 3.59Å
194	L	94.4	Very high	78.7	Confident	36 Å²	36	53.4 Å²	53.4	19%	0.188	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.1	171.7	178.4	67.9	0	0	0	109	L136 L144 V206 K207 L209	L136-L194 HydrophobicContact CD1-CD1 4.03Å; L144-L194 HydrophobicContact CD1-CD1 4.3Å; L194-V206 WeakPolarHBondContact O-CA 3.18Å; L194-K207 PolarHBondContact N-O 2.88Å; L194-K207 PolarHBondContact O-N 3.26Å; L194-L209 HydrophobicContact CB-CD1 4.19Å; L194-L209 HydrophobicContact CB-CD2 4.46Å; L194-L209 HydrophobicContact CB-CG 4.46Å
195	L	95.6	Very high	80.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.9	169.4	171.5	67.8	0	0	0	108.8	E142 Y143 F204 V206 A420 L423 T424 M427	E142-L195 CarbonylContact C-O 3.53Å; E142-L195 VanDerWaalsContact CA-O 3.25Å; E142-L195 WeakPolarHBondContact CA-O 3.25Å; Y143-L195 HydrophobicContact CD2-CD2 4.18Å; Y143-L195 PolarHBondContact N-O 2.97Å; Y143-L195 PolarHBondContact O-N 2.96Å; L195-F204 HydrophobicContact CD1-CB 3.93Å; L195-F204 HydrophobicContact CD1-CD1 4.32Å; L195-V206 HydrophobicContact CD1-CG2 3.78Å; L195-A420 WeakPolarHBondContact CD2-O 3.45Å; L195-L423 HydrophobicContact CD2-CB 3.46Å; L195-L423 VanDerWaalsContact CD2-CB 3.46Å; L195-L423 HydrophobicContact CD2-CD1 4.36Å; L195-T424 HydrophobicContact CD1-CG2 3.99Å; L195-T424 HydrophobicContact CD2-CG2 4.18Å; L195-M427 HydrophobicContact CD2-CE 4.35Å; L195-M427 HydrophobicContact CD2-SD 3.51Å; L195-M427 VanDerWaalsContact CD2-SD 3.51Å; L195-M427 HydrophobicContact CG-CE 4.25Å; L195-M427 HydrophobicContact CG-SD 3.98Å
196	S	92.3	Very high	82.7	Confident	22 Å²	22	47.3 Å²	47.3	15%	0.154	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.5	178.5	59.4	0	0	0	0	110.5	F204 S205	S196-F204 CarbonylContact O-C 3.55Å; S196-F204 WeakPolarHBondContact O-CA 3.42Å; S196-F204 WeakPolarHBondContact O-CB 3.35Å; S196-S205 PolarHBondContact N-O 3.25Å; S196-S205 PolarHBondContact O-N 3.33Å; S196-S205 PolarHBondContact OG-O 3.09Å
197	A	90	Very high	84.6	Confident	19 Å²	19	49.9 Å²	49.9	16%	0.157	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	150.7	176.4	0	0	0	0	0	110.9	P141 Q203 F204 M427	P141-A197 HydrophobicContact CG-CB 4.16Å; A197-Q203 CarbonylContact C-O 3.51Å; A197-Q203 WeakPolarHBondContact CA-O 3.2Å; A197-F204 HydrophobicContact CB-CD1 3.41Å; A197-F204 VanDerWaalsContact CB-CD1 3.41Å; A197-F204 HydrophobicContact CB-CE1 3.36Å; A197-F204 HydrophobicContact CB-CG 4.33Å; A197-F204 HydrophobicContact CB-CZ 4.25Å; A197-M427 HydrophobicContact CB-CE 3.79Å
198	N	87.3	Confident	86.4	Confident	40 Å²	40	47 Å²	47	21%	0.214	23%	0.228	C	C	.	.			trans	-67.9	168.1	162	74.9	-8.6	0	0	0	110.7	W200 C201 T202 Q203	N198-W200 PolarHBondContact O-N 2.8Å; N198-W200 VanDerWaalsContact O-N 3.11Å; N198-W200 PolarHBondContact OD1-N 2.83Å; N198-C201 PolarHBondContact O-N 2.87Å; N198-C201 WeakPolarHBondContact OD1-CA 2.88Å; N198-C201 PolarHBondContact OD1-N 2.94Å; N198-T202 PolarHBondContact ND2-OG1 2.82Å; N198-T202 PolarHBondContact OD1-N 2.86Å; N198-T202 PolarHBondContact OD1-OG1 2.8Å; N198-Q203 HydrophobicContact CB-CB 4.26Å; N198-Q203 PolarHBondContact N-O 3.46Å; N198-Q203 PolarHBondContact ND2-N 3.18Å; N198-Q203 PolarHBondContact OD1-N 2.86Å; N198-Q203 VanDerWaalsContact OD1-N 3.1Å; N198-Q203 PolarHBondContact OD1-O 2.78Å
199	F	83.2	Confident	88	Confident	127 Å²	127	44.4 Å²	44.4	56%	0.557	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-34.4	-177.4	-173.5	-102.2	0	0	0	113.5
200	W	82.7	Confident	89.2	Confident	155 Å²	155	41 Å²	41	59%	0.587	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.5	-178.1	-58.5	109.9	0	0	0	114.4	N198 T202	N198-W200 PolarHBondContact O-N 2.8Å; N198-W200 VanDerWaalsContact O-N 3.11Å; N198-W200 PolarHBondContact OD1-N 2.83Å; W200-T202 HydrophobicContact CB-CG2 3.99Å; W200-T202 PolarHBondContact O-N 2.84Å
201	C	87	Confident	89.3	Confident	7 Å²	7	43.8 Å²	43.8	5%	0.047	22%	0.219	C	C	.	.	S	Bend	trans	52.7	37.6	-171.5	-59.1	0	0	0	0	112.4	P141 N198 F204	P141-C201 VanDerWaalsContact CG-SG 3.51Å; N198-C201 PolarHBondContact O-N 2.87Å; N198-C201 WeakPolarHBondContact OD1-CA 2.88Å; N198-C201 PolarHBondContact OD1-N 2.94Å; C201-F204 HydrophobicContact CB-CZ 3.92Å; C201-F204 WeakPolarHBondContact O-CE2 3.05Å; C201-F204 WeakPolarHBondContact O-CZ 3.01Å
202	T	87.7	Confident	88.8	Confident	34 Å²	34	45.4 Å²	45.4	21%	0.209	24%	0.238	C	C	.	.	S	Bend	trans	-107.8	-23.8	176.5	54.7	0	0	0	0	112.3	N198 W200 Y223	N198-T202 PolarHBondContact ND2-OG1 2.82Å; N198-T202 PolarHBondContact OD1-N 2.86Å; N198-T202 PolarHBondContact OD1-OG1 2.8Å; W200-T202 HydrophobicContact CB-CG2 3.99Å; W200-T202 PolarHBondContact O-N 2.84Å; T202-Y223 PolarHBondContact O-N 3.14Å
203	Q	92	Very high	88.3	Confident	111 Å²	111	46.3 Å²	46.3	52%	0.519	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.5	178	-58.1	-180	-27.5	0	0	108.4	A197 N198 I221 N222	A197-Q203 CarbonylContact C-O 3.51Å; A197-Q203 WeakPolarHBondContact CA-O 3.2Å; N198-Q203 HydrophobicContact CB-CB 4.26Å; N198-Q203 PolarHBondContact N-O 3.46Å; N198-Q203 PolarHBondContact ND2-N 3.18Å; N198-Q203 PolarHBondContact OD1-N 2.86Å; N198-Q203 VanDerWaalsContact OD1-N 3.1Å; N198-Q203 PolarHBondContact OD1-O 2.78Å; Q203-I221 CarbonylContact C-O 3.45Å; Q203-I221 WeakPolarHBondContact CA-O 3.34Å; Q203-N222 WeakPolarHBondContact CG-OD1 3.34Å
204	F	94.6	Very high	87.9	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146	177.7	-53.3	-103.3	0	0	0	110	L195 S196 A197 C201 D220 I221 Y223 T424 M427	L195-F204 HydrophobicContact CD1-CB 3.93Å; L195-F204 HydrophobicContact CD1-CD1 4.32Å; S196-F204 CarbonylContact O-C 3.55Å; S196-F204 WeakPolarHBondContact O-CA 3.42Å; S196-F204 WeakPolarHBondContact O-CB 3.35Å; A197-F204 HydrophobicContact CB-CD1 3.41Å; A197-F204 VanDerWaalsContact CB-CD1 3.41Å; A197-F204 HydrophobicContact CB-CE1 3.36Å; A197-F204 HydrophobicContact CB-CG 4.33Å; A197-F204 HydrophobicContact CB-CZ 4.25Å; C201-F204 HydrophobicContact CB-CZ 3.92Å; C201-F204 WeakPolarHBondContact O-CE2 3.05Å; C201-F204 WeakPolarHBondContact O-CZ 3.01Å; F204-D220 CarbonylContact O-C 3.55Å; F204-D220 WeakPolarHBondContact O-CA 3.14Å; F204-I221 HydrophobicContact CB-CB 4.1Å; F204-I221 HydrophobicContact CB-CD1 4.15Å; F204-I221 HydrophobicContact CD2-CB 4.4Å; F204-I221 PolarHBondContact N-O 2.83Å; F204-I221 PolarHBondContact O-N 3.37Å; F204-Y223 AromaticContact CD2-CD2 3.9Å; F204-Y223 HydrophobicContact CD2-CD2 3.9Å; F204-Y223 AromaticContact CD2-CE2 3.87Å; F204-Y223 HydrophobicContact CD2-CE2 3.87Å; F204-Y223 AromaticContact CE2-CD2 3.52Å; F204-Y223 HydrophobicContact CE2-CD2 3.52Å; F204-Y223 AromaticContact CE2-CE2 3.55Å; F204-Y223 HydrophobicContact CE2-CE2 3.55Å; F204-T424 HydrophobicContact CB-CG2 3.99Å; F204-T424 HydrophobicContact CD1-CG2 3.78Å; F204-T424 HydrophobicContact CD2-CG2 3.99Å; F204-T424 HydrophobicContact CE1-CG2 4.26Å; F204-T424 HydrophobicContact CE2-CG2 4.45Å; F204-T424 HydrophobicContact CG-CG2 3.64Å; F204-M427 HydrophobicContact CD1-CE 3.99Å; F204-M427 HydrophobicContact CD1-SD 3.69Å; F204-M427 HydrophobicContact CE1-CB 3.59Å; F204-M427 HydrophobicContact CE1-CE 3.86Å; F204-M427 HydrophobicContact CE1-CG 4.08Å; F204-M427 HydrophobicContact CE1-SD 3.43Å; F204-M427 WeakPolarHBondContact CE1-SD 3.42Å; F204-M427 HydrophobicContact CZ-CB 4.02Å
205	S	95	Very high	87.4	Confident	27 Å²	27	44.8 Å²	44.8	19%	0.189	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.6	175.3	-170.2	0	0	0	0	109.6	S196 D220	S196-S205 PolarHBondContact N-O 3.25Å; S196-S205 PolarHBondContact O-N 3.33Å; S196-S205 PolarHBondContact OG-O 3.09Å; S205-D220 PolarHBondContact OG-OD1 3.49Å
206	V	95.8	Very high	86.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.2	177	-170.9	0	0	0	0	108.3	A193 L194 L195 L218 A219 I221 A420	A193-V206 HydrophobicContact CB-CG1 4.37Å; L194-V206 WeakPolarHBondContact O-CA 3.18Å; L195-V206 HydrophobicContact CD1-CG2 3.78Å; V206-L218 HydrophobicContact CB-CB 4.1Å; V206-L218 HydrophobicContact CG1-CB 3.88Å; V206-L218 HydrophobicContact CG1-CD1 3.93Å; V206-L218 HydrophobicContact CG1-CG 4.25Å; V206-L218 PolarHBondContact O-N 2.77Å; V206-A219 HydrophobicContact CB-CB 4.18Å; V206-A219 HydrophobicContact CG2-CB 4.04Å; V206-A219 PolarHBondContact N-O 3.09Å; V206-I221 HydrophobicContact CG2-CD1 3.59Å; V206-A420 HydrophobicContact CB-CB 4.38Å; V206-A420 HydrophobicContact CG1-CB 3.71Å; V206-A420 HydrophobicContact CG2-CB 3.68Å
207	K	92.2	Very high	86.8	Confident	105 Å²	105	51.1 Å²	51.1	46%	0.457	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.7	179	-63.2	-178.3	-179.3	179.3	0	111	A193 L194 K216	A193-K207 CarbonylContact C-O 3.44Å; A193-K207 WeakPolarHBondContact CA-O 3.26Å; A193-K207 VanDerWaalsContact CB-O 3.32Å; A193-K207 WeakPolarHBondContact CB-O 3.5Å; L194-K207 PolarHBondContact N-O 2.88Å; L194-K207 PolarHBondContact O-N 3.26Å; K207-K216 CarbonylContact C-O 3.54Å; K207-K216 WeakPolarHBondContact CA-O 3.48Å; K207-K216 WeakPolarHBondContact CB-O 3.32Å
208	G	91.3	Very high	86.9	Confident	12 Å²	12	50.2 Å²	50.2	12%	0.124	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	132	172.1	0	0	0	0	0	110.4	P215 K216	G208-P215 WeakPolarHBondContact CA-O 3.2Å; G208-K216 PolarHBondContact N-O 3.18Å
209	L	87	Confident	87.3	Confident	68 Å²	68	48.4 Å²	48.4	36%	0.356	24%	0.244	S	C	.	.	S	Bend	trans	-107.2	5.4	177.8	-58.6	-179.8	0	0	0	112.4	L144 K191 V192 L194 P211	L144-L209 HydrophobicContact CD1-CD1 3.51Å; K191-L209 HydrophobicContact CB-CB 4.48Å; K191-L209 HydrophobicContact CB-CD1 3.93Å; V192-L209 PolarHBondContact O-N 3.25Å; L194-L209 HydrophobicContact CB-CD1 4.19Å; L194-L209 HydrophobicContact CB-CD2 4.46Å; L194-L209 HydrophobicContact CB-CG 4.46Å; L209-P211 WeakPolarHBondContact O-CD 3.18Å
210	Q	83.8	Confident	87.9	Confident	19 Å²	19	43 Å²	43	9%	0.089	22%	0.221	C	C	.	.			trans	-119.9	81.7	-178.3	-69.3	-70.7	-22.5	0	0	109.9	L90 I189 K191 V192 S212 A213 L214	L90-Q210 HydrophobicContact CD1-CG 4Å; I189-Q210 PolarHBondContact O-NE2 2.92Å; K191-Q210 WeakPolarHBondContact O-CG 3.49Å; K191-Q210 PolarHBondContact O-NE2 3.12Å; V192-Q210 HydrophobicContact CG1-CG 4.45Å; Q210-S212 PolarHBondContact O-N 3.32Å; Q210-A213 HydrophobicContact CB-CB 4.37Å; Q210-A213 PolarHBondContact O-N 3.1Å; Q210-L214 HydrophobicContact CB-CD1 4.4Å; Q210-L214 PolarHBondContact O-N 3.06Å
211	P	73.9	Confident	88.5	Confident	69 Å²	69	35.7 Å²	35.7	45%	0.448	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.3	-171.6	-22.7	33.5	0	0	0	114.8	L209 A213 K252	L209-P211 WeakPolarHBondContact O-CD 3.18Å; P211-A213 VanDerWaalsContact C-N 3.32Å; P211-K252 HydrophobicContact CB-CD 4.24Å
212	S	73.8	Confident	88.8	Confident	97 Å²	97	37.6 Å²	37.6	68%	0.678	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-18.3	175.4	53.1	0	0	0	0	113.4	Q210	Q210-S212 PolarHBondContact O-N 3.32Å
213	A	80.9	Confident	88.9	Confident	19 Å²	19	37.5 Å²	37.5	16%	0.157	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.2	-16.4	-172	0	0	0	0	0	114.1	L90 C94 Q210 P211	L90-A213 HydrophobicContact CG-CB 4.45Å; C94-A213 HydrophobicContact CB-CB 4.09Å; Q210-A213 HydrophobicContact CB-CB 4.37Å; Q210-A213 PolarHBondContact O-N 3.1Å; P211-A213 VanDerWaalsContact C-N 3.32Å
214	L	85.3	Confident	88.4	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.016	19%	0.192	C	C	.	.	S	Bend	trans	-143.1	139.7	-170	-77.1	176.8	0	0	0	111	C94 V192 Q210 L218 P242	C94-L214 HydrophobicContact CB-CD1 4.29Å; C94-L214 HydrophobicContact CB-CD2 3.65Å; C94-L214 HydrophobicContact CB-CG 3.76Å; C94-L214 VanDerWaalsContact SG-CD1 3.55Å; C94-L214 VanDerWaalsContact SG-CG 3.59Å; V192-L214 HydrophobicContact CG1-CD1 3.67Å; Q210-L214 HydrophobicContact CB-CD1 4.4Å; Q210-L214 PolarHBondContact O-N 3.06Å; L214-L218 HydrophobicContact CB-CD2 4.04Å; L214-L218 HydrophobicContact CD1-CD1 4.01Å; L214-L218 HydrophobicContact CD2-CD1 4.25Å; L214-L218 HydrophobicContact CD2-CD2 3.83Å; L214-L218 HydrophobicContact CG-CD2 4.35Å; L214-P242 HydrophobicContact CD2-CB 4.43Å
215	P	84.4	Confident	87.2	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.006	22%	0.221	C	C	.	.			trans	-65	159.1	168.6	24.2	-27.7	0	0	0	111	G208 R217 L218 V240	G208-P215 WeakPolarHBondContact CA-O 3.2Å; P215-R217 PolarHBondContact O-N 3.3Å; P215-L218 HydrophobicContact CG-CD2 3.77Å; P215-L218 VanDerWaalsContact O-CD2 3.25Å; P215-L218 WeakPolarHBondContact O-CD2 3.33Å; P215-V240 HydrophobicContact CG-CG1 4.16Å
216	K	84.5	Confident	85.7	Confident	93 Å²	93	39.7 Å²	39.7	40%	0.404	22%	0.222	S	C	.	.	S	Bend	trans	-58.7	-35.6	178.9	-78.7	-172.5	175.8	-172.8	0	112.2	K207 G208 E339	K207-K216 CarbonylContact C-O 3.54Å; K207-K216 WeakPolarHBondContact CA-O 3.48Å; K207-K216 WeakPolarHBondContact CB-O 3.32Å; G208-K216 PolarHBondContact N-O 3.18Å; K216-E339 IonicContact NZ-OE1 2.8Å; K216-E339 PolarHBondContact NZ-OE1 2.92Å
217	R	89.6	Confident	84	Confident	61 Å²	61	46 Å²	46	23%	0.23	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.1	177.8	-167.9	-178.4	-168.4	174.8	4.5	109.1	P215 D220 V240 M347	P215-R217 PolarHBondContact O-N 3.3Å; R217-D220 IonicContact CZ-OD1 2.92Å; R217-D220 IonicContact CZ-OD2 2.89Å; R217-D220 VanDerWaalsContact NE-CG 3.28Å; R217-D220 IonicContact NE-OD1 3.96Å; R217-D220 PolarHBondContact NE-OD1 3.46Å; R217-D220 IonicContact NE-OD2 3.52Å; R217-D220 PolarHBondContact NE-OD2 3.23Å; R217-D220 IonicContact NH1-OD2 2.76Å; R217-D220 IonicContact NH2-OD1 2.67Å; R217-D220 PolarHBondContact NH2-OD1 2.98Å; R217-D220 IonicContact NH2-OD2 3.32Å; R217-D220 PolarHBondContact NH2-OD2 3.45Å; R217-V240 HydrophobicContact CG-CG2 4.47Å; R217-V240 WeakPolarHBondContact O-CB 3.12Å; R217-V240 WeakPolarHBondContact O-CG2 3.49Å; R217-M347 PolarHBondContact NH1-SD 3Å
218	L	93.2	Very high	82.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-37.6	-176.5	-55.1	-172.9	0	0	0	112.7	A193 V206 L214 P215 V240 V416 Q417	A193-L218 HydrophobicContact CB-CD1 4.05Å; V206-L218 HydrophobicContact CB-CB 4.1Å; V206-L218 HydrophobicContact CG1-CB 3.88Å; V206-L218 HydrophobicContact CG1-CD1 3.93Å; V206-L218 HydrophobicContact CG1-CG 4.25Å; V206-L218 PolarHBondContact O-N 2.77Å; L214-L218 HydrophobicContact CB-CD2 4.04Å; L214-L218 HydrophobicContact CD1-CD1 4.01Å; L214-L218 HydrophobicContact CD2-CD1 4.25Å; L214-L218 HydrophobicContact CD2-CD2 3.83Å; L214-L218 HydrophobicContact CG-CD2 4.35Å; P215-L218 HydrophobicContact CG-CD2 3.77Å; P215-L218 VanDerWaalsContact O-CD2 3.25Å; P215-L218 WeakPolarHBondContact O-CD2 3.33Å; L218-V240 PolarHBondContact O-N 3.02Å; L218-V416 HydrophobicContact CD1-CG1 3.89Å; L218-Q417 HydrophobicContact CB-CG 4.15Å; L218-Q417 PolarHBondContact O-NE2 3.3Å; L218-Q417 VanDerWaalsContact O-NE2 3.1Å
219	A	95.2	Very high	80.9	Confident	3 Å²	3	56.2 Å²	56.2	3%	0.025	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	153.7	179.9	0	0	0	0	0	111.7	V206 I221 K238 L239	V206-A219 HydrophobicContact CB-CB 4.18Å; V206-A219 HydrophobicContact CG2-CB 4.04Å; V206-A219 PolarHBondContact N-O 3.09Å; A219-I221 HydrophobicContact CB-CD1 4.09Å; A219-K238 CarbonylContact C-O 3.57Å; A219-K238 WeakPolarHBondContact CA-O 3.32Å; A219-L239 HydrophobicContact CB-CD1 4.09Å
220	D	95.5	Very high	79.3	Confident	13 Å²	13	56.8 Å²	56.8	7%	0.07	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.2	159	-48.5	-75.7	0	0	0	110.4	F204 S205 R217 V237 K238	F204-D220 CarbonylContact O-C 3.55Å; F204-D220 WeakPolarHBondContact O-CA 3.14Å; S205-D220 PolarHBondContact OG-OD1 3.49Å; R217-D220 IonicContact CZ-OD1 2.92Å; R217-D220 IonicContact CZ-OD2 2.89Å; R217-D220 VanDerWaalsContact NE-CG 3.28Å; R217-D220 IonicContact NE-OD1 3.96Å; R217-D220 PolarHBondContact NE-OD1 3.46Å; R217-D220 IonicContact NE-OD2 3.52Å; R217-D220 PolarHBondContact NE-OD2 3.23Å; R217-D220 IonicContact NH1-OD2 2.76Å; R217-D220 IonicContact NH2-OD1 2.67Å; R217-D220 PolarHBondContact NH2-OD1 2.98Å; R217-D220 IonicContact NH2-OD2 3.32Å; R217-D220 PolarHBondContact NH2-OD2 3.45Å; D220-V237 WeakPolarHBondContact O-CA 3.1Å; D220-K238 HydrophobicContact CB-CB 4.35Å; D220-K238 PolarHBondContact N-O 3.05Å; D220-K238 PolarHBondContact O-N 2.83Å
221	I	95.7	Very high	78.2	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.2	-174.8	-55.1	89.3	0	0	0	107.6	Q203 F204 V206 A219 Y223 L235 L421 T424	Q203-I221 CarbonylContact C-O 3.45Å; Q203-I221 WeakPolarHBondContact CA-O 3.34Å; F204-I221 HydrophobicContact CB-CB 4.1Å; F204-I221 HydrophobicContact CB-CD1 4.15Å; F204-I221 HydrophobicContact CD2-CB 4.4Å; F204-I221 PolarHBondContact N-O 2.83Å; F204-I221 PolarHBondContact O-N 3.37Å; V206-I221 HydrophobicContact CG2-CD1 3.59Å; A219-I221 HydrophobicContact CB-CD1 4.09Å; I221-Y223 HydrophobicContact CG2-CD2 4.18Å; I221-Y223 HydrophobicContact CG2-CE2 3.64Å; I221-L235 HydrophobicContact CG2-CD1 3.13Å; I221-L235 HydrophobicContact CG2-CG 4.48Å; I221-L421 HydrophobicContact CB-CD1 4.45Å; I221-L421 HydrophobicContact CG1-CD1 3.72Å; I221-L421 HydrophobicContact CG2-CD1 3.78Å; I221-T424 HydrophobicContact CD1-CG2 4.47Å; I221-T424 HydrophobicContact CG1-CG2 4.46Å; I221-T424 HydrophobicContact CG2-CG2 4.49Å
222	N	93.4	Very high	77.7	Confident	47 Å²	47	61.4 Å²	61.4	25%	0.251	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.6	178.8	-64.2	-57.9	0	0	0	109.8	Q203 L235 T236	Q203-N222 WeakPolarHBondContact CG-OD1 3.34Å; N222-L235 WeakPolarHBondContact O-CA 3.36Å; N222-T236 PolarHBondContact N-O 3.48Å; N222-T236 PolarHBondContact O-N 3.42Å
223	Y	89.6	Confident	77.6	Confident	32 Å²	32	62.7 Å²	62.7	13%	0.125	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.8	170.9	-72.7	-89.1	0	0	0	109.2	T202 F204 I221 R233 Q234 L235 T424	T202-Y223 PolarHBondContact O-N 3.14Å; F204-Y223 AromaticContact CD2-CD2 3.9Å; F204-Y223 HydrophobicContact CD2-CD2 3.9Å; F204-Y223 AromaticContact CD2-CE2 3.87Å; F204-Y223 HydrophobicContact CD2-CE2 3.87Å; F204-Y223 AromaticContact CE2-CD2 3.52Å; F204-Y223 HydrophobicContact CE2-CD2 3.52Å; F204-Y223 AromaticContact CE2-CE2 3.55Å; F204-Y223 HydrophobicContact CE2-CE2 3.55Å; I221-Y223 HydrophobicContact CG2-CD2 4.18Å; I221-Y223 HydrophobicContact CG2-CE2 3.64Å; Y223-R233 HydrophobicContact CD1-CB 3.94Å; Y223-Q234 CarbonylContact C-O 3.53Å; Y223-Q234 WeakPolarHBondContact CA-O 3.49Å; Y223-L235 HydrophobicContact CD1-CB 4.24Å; Y223-L235 HydrophobicContact CD1-CD1 4.05Å; Y223-L235 HydrophobicContact CD2-CD1 4.11Å; Y223-L235 HydrophobicContact CE1-CB 4.04Å; Y223-L235 HydrophobicContact CE1-CD1 3.65Å; Y223-L235 HydrophobicContact CE1-CD2 4.16Å; Y223-L235 HydrophobicContact CE1-CG 4.18Å; Y223-L235 HydrophobicContact CE2-CD1 3.73Å; Y223-L235 HydrophobicContact CG-CD1 4.28Å; Y223-L235 VanDerWaalsContact CZ-CD1 3.47Å; Y223-T424 PolarHBondContact OH-OG1 2.9Å
224	S	82.6	Confident	77.8	Confident	53 Å²	53	65.8 Å²	65.8	37%	0.371	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.1	171.1	-60.1	0	0	0	0	109.1	N226 Q234	S224-N226 PolarHBondContact O-N 3.22Å; S224-Q234 PolarHBondContact N-O 3.46Å
225	P	67.9	Low	78.1	Confident	98 Å²	98	65.8 Å²	65.8	64%	0.636	34%	0.336	S	S	*	.			trans	-65.9	118.5	175.3	27	-32	0	0	0	108.9	I227	P225-I227 PolarHBondContact O-N 3.22Å
226	N	63.4	Low	78.6	Confident	39 Å²	39	67.1 Å²	67.1	21%	0.209	34%	0.344	C	S	.	.			trans	-81.6	100.5	164.6	-172.5	-8.6	0	0	0	108.2	S224 F228 H229 Q231	S224-N226 PolarHBondContact O-N 3.22Å; N226-F228 PolarHBondContact O-N 3.29Å; N226-F228 PolarHBondContact OD1-N 3.47Å; N226-H229 PolarHBondContact O-N 3.32Å; N226-Q231 WeakPolarHBondContact ND2-CA 3.47Å; N226-Q231 VanDerWaalsContact ND2-CB 3.29Å; N226-Q231 WeakPolarHBondContact ND2-CB 3.45Å; N226-Q231 PolarHBondContact ND2-N 2.92Å; N226-Q231 PolarHBondContact ND2-O 2.86Å
227	I	60.1	Low	79.1	Confident	134 Å²	134	62.8 Å²	62.8	69%	0.687	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-36.7	-175.9	-62.7	170.4	0	0	0	111.3	P225 H229	P225-I227 PolarHBondContact O-N 3.22Å; I227-H229 VanDerWaalsContact C-N 3.33Å
228	F	59.6	Low	79.4	Confident	174 Å²	174	63.2 Å²	63.2	76%	0.763	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-2.6	-175.8	-61.5	-70	0	0	0	113.5	N226 A230	N226-F228 PolarHBondContact O-N 3.29Å; N226-F228 PolarHBondContact OD1-N 3.47Å; F228-A230 HydrophobicContact CB-CB 4.45Å; F228-A230 PolarHBondContact O-N 2.72Å
229	H	59.3	Low	79.5	Confident	157 Å²	157	63.3 Å²	63.3	73%	0.727	33%	0.329	S	S	*	.			trans	50.8	6.9	-176.6	-66.8	-71.8	0	0	0	115.8	N226 I227 Q231	N226-H229 PolarHBondContact O-N 3.32Å; I227-H229 VanDerWaalsContact C-N 3.33Å; H229-Q231 VanDerWaalsContact C-N 3.3Å; H229-Q231 PolarHBondContact O-N 2.78Å
230	A	54.8	Low	79.2	Confident	79 Å²	79	63.3 Å²	63.3	65%	0.653	33%	0.329	S	S	*	.	S	Bend	trans	-77.8	-16.8	-173.6	0	0	0	0	0	112.8	F228	F228-A230 HydrophobicContact CB-CB 4.45Å; F228-A230 PolarHBondContact O-N 2.72Å
231	Q	60.4	Low	78.6	Confident	104 Å²	104	64.3 Å²	64.3	49%	0.486	34%	0.337	S	S	.	.	S	Bend	trans	-133.6	153	178.6	-51.3	178.2	-12.7	0	0	110.2	N226 H229	N226-Q231 WeakPolarHBondContact ND2-CA 3.47Å; N226-Q231 VanDerWaalsContact ND2-CB 3.29Å; N226-Q231 WeakPolarHBondContact ND2-CB 3.45Å; N226-Q231 PolarHBondContact ND2-N 2.92Å; N226-Q231 PolarHBondContact ND2-O 2.86Å; H229-Q231 VanDerWaalsContact C-N 3.3Å; H229-Q231 PolarHBondContact O-N 2.78Å
232	P	62.3	Low	77.2	Confident	81 Å²	81	64.5 Å²	64.5	53%	0.526	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-49.2	145.5	172.1	-25.3	33.7	0	0	0	111.9	Q234	P232-Q234 PolarHBondContact O-N 3.06Å
233	R	72.9	Confident	75.8	Confident	125 Å²	125	66.8 Å²	66.8	47%	0.472	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-58.9	127.6	177.1	-66.1	-178	-176	-173.7	-0.9	109	Y223 L235	Y223-R233 HydrophobicContact CD1-CB 3.94Å; R233-L235 PolarHBondContact O-N 3.48Å
234	Q	84.8	Confident	74.1	Confident	83 Å²	83	65.7 Å²	65.7	39%	0.388	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	132.5	174	-170	175.8	13.8	0	0	108.8	Y223 S224 P232	Y223-Q234 CarbonylContact C-O 3.53Å; Y223-Q234 WeakPolarHBondContact CA-O 3.49Å; S224-Q234 PolarHBondContact N-O 3.46Å; P232-Q234 PolarHBondContact O-N 3.06Å
235	L	91.8	Very high	72.6	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.016	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.2	-170	167.5	62.7	0	0	0	108.2	I221 N222 Y223 R233 V237 N356 N357 F385 I387 L421	I221-L235 HydrophobicContact CG2-CD1 3.13Å; I221-L235 HydrophobicContact CG2-CG 4.48Å; N222-L235 WeakPolarHBondContact O-CA 3.36Å; Y223-L235 HydrophobicContact CD1-CB 4.24Å; Y223-L235 HydrophobicContact CD1-CD1 4.05Å; Y223-L235 HydrophobicContact CD2-CD1 4.11Å; Y223-L235 HydrophobicContact CE1-CB 4.04Å; Y223-L235 HydrophobicContact CE1-CD1 3.65Å; Y223-L235 HydrophobicContact CE1-CD2 4.16Å; Y223-L235 HydrophobicContact CE1-CG 4.18Å; Y223-L235 HydrophobicContact CE2-CD1 3.73Å; Y223-L235 HydrophobicContact CG-CD1 4.28Å; Y223-L235 VanDerWaalsContact CZ-CD1 3.47Å; R233-L235 PolarHBondContact O-N 3.48Å; L235-V237 HydrophobicContact CD1-CG2 4.29Å; L235-V237 HydrophobicContact CG-CG2 4.23Å; L235-N356 WeakPolarHBondContact O-CA 3.36Å; L235-N357 HydrophobicContact CB-CB 4.01Å; L235-N357 PolarHBondContact N-OD1 3.12Å; L235-N357 PolarHBondContact O-N 3.05Å; L235-N357 PolarHBondContact O-OD1 2.93Å; L235-F385 HydrophobicContact CD2-CD2 4.1Å; L235-F385 HydrophobicContact CD2-CE2 4.17Å; L235-I387 HydrophobicContact CD2-CD1 3.79Å; L235-I387 HydrophobicContact CG-CD1 4.34Å; L235-L421 HydrophobicContact CD1-CD1 4.47Å; L235-L421 HydrophobicContact CD2-CD1 4.29Å
236	T	94	Very high	71.5	Confident	30 Å²	30	63.3 Å²	63.3	18%	0.184	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.3	173.3	-59.6	0	0	0	0	109	N222 V354 L355 N356	N222-T236 PolarHBondContact N-O 3.48Å; N222-T236 PolarHBondContact O-N 3.42Å; T236-V354 HydrophobicContact CG2-CG1 3.7Å; T236-L355 CarbonylContact C-O 3.49Å; T236-L355 WeakPolarHBondContact CA-O 3.31Å; T236-N356 WeakPolarHBondContact CB-OD1 3.15Å; T236-N356 WeakPolarHBondContact CG2-OD1 3.27Å; T236-N356 PolarHBondContact OG1-OD1 2.92Å
237	V	96	Very high	70.7	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.006	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.8	178.6	-176.4	0	0	0	0	108.3	D220 L235 L239 V354 L355 I387 F413 L421	D220-V237 WeakPolarHBondContact O-CA 3.1Å; L235-V237 HydrophobicContact CD1-CG2 4.29Å; L235-V237 HydrophobicContact CG-CG2 4.23Å; V237-L239 HydrophobicContact CG1-CB 4.42Å; V237-V354 WeakPolarHBondContact O-CA 3.35Å; V237-L355 HydrophobicContact CB-CB 4.35Å; V237-L355 PolarHBondContact N-O 2.78Å; V237-L355 PolarHBondContact O-N 2.9Å; V237-I387 HydrophobicContact CG2-CD1 4.31Å; V237-F413 HydrophobicContact CG1-CE1 4.41Å; V237-L421 HydrophobicContact CG2-CD1 3.64Å; V237-L421 HydrophobicContact CG2-CD2 3.94Å; V237-L421 HydrophobicContact CG2-CG 4.47Å
238	K	95.5	Very high	70	Confident	71 Å²	71	64 Å²	64	31%	0.309	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	101.8	166.7	-66.5	-171.6	178	-174.6	0	107.5	A219 D220 V352 L353 V354	A219-K238 CarbonylContact C-O 3.57Å; A219-K238 WeakPolarHBondContact CA-O 3.32Å; D220-K238 HydrophobicContact CB-CB 4.35Å; D220-K238 PolarHBondContact N-O 3.05Å; D220-K238 PolarHBondContact O-N 2.83Å; K238-V352 HydrophobicContact CB-CG1 3.82Å; K238-V352 HydrophobicContact CG-CG1 4.42Å; K238-L353 CarbonylContact C-O 3.52Å; K238-L353 WeakPolarHBondContact CA-O 3.26Å; K238-V354 HydrophobicContact CG-CG2 4.39Å
239	L	94.4	Very high	69.3	Low	1 Å²	1	58.2 Å²	58.2	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.6	-176.5	-165.7	73.1	0	0	0	109.7	A219 V237 V352 L353 L355 P412 F413 Q417	A219-L239 HydrophobicContact CB-CD1 4.09Å; V237-L239 HydrophobicContact CG1-CB 4.42Å; L239-V352 WeakPolarHBondContact O-CA 3.45Å; L239-L353 HydrophobicContact CB-CB 4.4Å; L239-L353 PolarHBondContact N-O 2.66Å; L239-L353 PolarHBondContact O-N 3.18Å; L239-L355 HydrophobicContact CB-CD1 3.69Å; L239-L355 HydrophobicContact CD2-CD1 4.4Å; L239-P412 HydrophobicContact CD2-CB 3.95Å; L239-P412 HydrophobicContact CD2-CG 3.78Å; L239-F413 HydrophobicContact CD1-CD1 3.89Å; L239-F413 HydrophobicContact CD1-CE1 3.78Å; L239-F413 HydrophobicContact CD2-CD1 3.96Å; L239-F413 HydrophobicContact CD2-CE1 4.08Å; L239-F413 HydrophobicContact CD2-CG 4.31Å; L239-Q417 HydrophobicContact CD1-CB 3.87Å; L239-Q417 VanDerWaalsContact CD1-CD 3.43Å; L239-Q417 HydrophobicContact CD1-CG 3.86Å
240	V	90.2	Very high	68.8	Low	3 Å²	3	56.6 Å²	56.6	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	131.8	173.8	-177.4	0	0	0	0	108.4	P215 R217 L218 P242 V352 Q417	P215-V240 HydrophobicContact CG-CG1 4.16Å; R217-V240 HydrophobicContact CG-CG2 4.47Å; R217-V240 WeakPolarHBondContact O-CB 3.12Å; R217-V240 WeakPolarHBondContact O-CG2 3.49Å; L218-V240 PolarHBondContact O-N 3.02Å; V240-P242 WeakPolarHBondContact O-CD 3.25Å; V240-V352 HydrophobicContact CG2-CG2 4.39Å; V240-Q417 PolarHBondContact O-NE2 3.32Å
241	S	82	Confident	68.4	Low	35 Å²	35	57.6 Å²	57.6	25%	0.245	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-60.2	122.9	176.4	-176.3	0	0	0	0	110.7	D243 C244 N351	S241-D243 PolarHBondContact O-N 2.9Å; S241-C244 WeakPolarHBondContact O-CB 3.26Å; S241-C244 PolarHBondContact O-N 2.8Å; S241-N351 PolarHBondContact N-O 3.01Å
242	P	67.3	Low	67.8	Low	5 Å²	5	56.5 Å²	56.5	3%	0.032	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-69.4	-20.6	179.6	28.7	-36.1	0	0	0	113.1	C94 P96 L214 V240 C244 S245	C94-P242 VanDerWaalsContact O-CB 3.31Å; C94-P242 WeakPolarHBondContact O-CB 3.22Å; P96-P242 VanDerWaalsContact CD-CG 3.49Å; P96-P242 HydrophobicContact CG-CG 3.48Å; P96-P242 VanDerWaalsContact CG-CG 3.48Å; L214-P242 HydrophobicContact CD2-CB 4.43Å; V240-P242 WeakPolarHBondContact O-CD 3.25Å; P242-C244 PolarHBondContact O-N 3.46Å; P242-C244 VanDerWaalsContact O-N 3.11Å; P242-S245 PolarHBondContact O-N 3.01Å
243	D	63.9	Low	67.2	Low	95 Å²	95	55.9 Å²	55.9	51%	0.508	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-66.9	-11.9	179.8	-64.7	-37.6	0	0	0	113	S241 S245 A246	S241-D243 PolarHBondContact O-N 2.9Å; D243-S245 PolarHBondContact O-N 3.04Å; D243-S245 VanDerWaalsContact O-N 3.12Å; D243-A246 PolarHBondContact O-N 2.67Å
244	C	54	Low	66.1	Low	9 Å²	9	56.1 Å²	56.1	6%	0.061	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-61.6	-19.6	177.8	-158.9	0	0	0	0	113.2	S241 P242 A246 Q247 Q248 N351	S241-C244 WeakPolarHBondContact O-CB 3.26Å; S241-C244 PolarHBondContact O-N 2.8Å; P242-C244 PolarHBondContact O-N 3.46Å; P242-C244 VanDerWaalsContact O-N 3.11Å; C244-A246 PolarHBondContact O-N 2.99Å; C244-Q247 PolarHBondContact O-N 2.74Å; C244-Q247 VanDerWaalsContact O-N 3.12Å; C244-Q248 PolarHBondContact O-N 2.67Å; C244-N351 PolarHBondContact SG-ND2 3.33Å; C244-N351 VanDerWaalsContact SG-ND2 3.41Å
245	S	50.4	Low	64.3	Low	21 Å²	21	53.9 Å²	53.9	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-64.1	-26.7	-178.2	74.2	0	0	0	0	113.1	P242 D243 Q247 A249	P242-S245 PolarHBondContact O-N 3.01Å; D243-S245 PolarHBondContact O-N 3.04Å; D243-S245 VanDerWaalsContact O-N 3.12Å; S245-Q247 VanDerWaalsContact C-N 3.34Å; S245-A249 WeakPolarHBondContact O-CB 3.31Å; S245-A249 PolarHBondContact O-N 3.24Å
246	A	45.5	Very low	62.3	Low	79 Å²	79	57.4 Å²	57.4	65%	0.653	31%	0.311	S	S	*	.	H	α-helix	trans	-68.1	-35.1	175.8	0	0	0	0	0	112.1	D243 C244	D243-A246 PolarHBondContact O-N 2.67Å; C244-A246 PolarHBondContact O-N 2.99Å
247	Q	44.7	Very low	60.3	Low	146 Å²	146	58.4 Å²	58.4	68%	0.682	32%	0.32	S	S	*	.	H	α-helix	trans	-82.2	-35.8	175.7	-72	170	-22	0	0	111.6	C244 S245	C244-Q247 PolarHBondContact O-N 2.74Å; C244-Q247 VanDerWaalsContact O-N 3.12Å; S245-Q247 VanDerWaalsContact C-N 3.34Å
248	Q	45.8	Very low	58.1	Low	42 Å²	42	62 Å²	62	20%	0.196	34%	0.336	C	S	.	.	H	α-helix	trans	-73.1	-28.4	176.2	-76.6	-179.8	-10.7	0	0	113.4	C244 D250 H251 K252 D346	C244-Q248 PolarHBondContact O-N 2.67Å; Q248-D250 PolarHBondContact O-N 2.83Å; Q248-H251 PolarHBondContact O-N 2.81Å; Q248-K252 VanDerWaalsContact O-CB 3.24Å; Q248-K252 WeakPolarHBondContact O-CB 3.39Å; Q248-K252 PolarHBondContact O-N 2.82Å; Q248-D346 PolarHBondContact NE2-OD1 3.24Å; Q248-D346 PolarHBondContact NE2-OD2 3.49Å
249	A	46.3	Very low	55.7	Low	52 Å²	52	60.4 Å²	60.4	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-58.7	-37.2	177.7	0	0	0	0	0	110.9	S245 S253	S245-A249 WeakPolarHBondContact O-CB 3.31Å; S245-A249 PolarHBondContact O-N 3.24Å; A249-S253 VanDerWaalsContact O-CB 3.32Å; A249-S253 WeakPolarHBondContact O-CB 3.39Å; A249-S253 PolarHBondContact O-N 3Å
250	D	48.3	Very low	53.5	Low	124 Å²	124	67.6 Å²	67.6	66%	0.663	37%	0.367	S	S	*	.	H	α-helix	trans	-68.4	-46.2	177.8	-134.2	13.2	0	0	0	111.1	Q248 K252 S253 Y254	Q248-D250 PolarHBondContact O-N 2.83Å; D250-K252 PolarHBondContact O-N 3.26Å; D250-S253 PolarHBondContact O-N 2.96Å; D250-S253 PolarHBondContact O-OG 3.42Å; D250-Y254 PolarHBondContact O-N 2.77Å
251	H	46.7	Very low	51.6	Low	100 Å²	100	71.1 Å²	71.1	46%	0.463	39%	0.389	S	S	.	.	H	α-helix	trans	-69.2	-33.3	178	-156.7	60.2	0	0	0	112.7	Q248 Y254 I255	Q248-H251 PolarHBondContact O-N 2.81Å; H251-Y254 WeakPolarHBondContact O-CB 3.49Å; H251-Y254 PolarHBondContact O-N 3.4Å; H251-I255 VanDerWaalsContact O-CG1 3.29Å; H251-I255 WeakPolarHBondContact O-CG1 3.31Å; H251-I255 PolarHBondContact O-N 2.86Å
252	K	46.5	Very low	49.8	Very low	81 Å²	81	71.7 Å²	71.7	35%	0.352	39%	0.392	S	S	.	.	H	α-helix	trans	-72.8	-36.2	172.2	-173.5	176.4	178.1	-173.8	0	111.1	P211 Q248 D250 Y254 I255 D256	P211-K252 HydrophobicContact CB-CD 4.24Å; Q248-K252 VanDerWaalsContact O-CB 3.24Å; Q248-K252 WeakPolarHBondContact O-CB 3.39Å; Q248-K252 PolarHBondContact O-N 2.82Å; D250-K252 PolarHBondContact O-N 3.26Å; K252-Y254 PolarHBondContact O-N 2.84Å; K252-I255 CarbonylContact O-C 3.52Å; K252-I255 PolarHBondContact O-N 3.1Å; K252-D256 VanDerWaalsContact O-CB 3.26Å; K252-D256 WeakPolarHBondContact O-CB 3.44Å; K252-D256 PolarHBondContact O-N 2.85Å
253	S	50.6	Low	48.6	Very low	68 Å²	68	76.2 Å²	76.2	48%	0.476	42%	0.416	S	S	.	.	H	α-helix	trans	-59.8	-40.6	172.7	106.9	0	0	0	0	110.1	A249 D250 S257	A249-S253 VanDerWaalsContact O-CB 3.32Å; A249-S253 WeakPolarHBondContact O-CB 3.39Å; A249-S253 PolarHBondContact O-N 3Å; D250-S253 PolarHBondContact O-N 2.96Å; D250-S253 PolarHBondContact O-OG 3.42Å; S253-S257 VanDerWaalsContact O-CB 3.3Å; S253-S257 WeakPolarHBondContact O-CB 3.23Å; S253-S257 PolarHBondContact O-N 2.94Å; S253-S257 PolarHBondContact O-OG 3.45Å
254	Y	48.9	Very low	47.9	Very low	130 Å²	130	73.5 Å²	73.5	51%	0.51	41%	0.41	S	S	.	.	H	α-helix	trans	-63.8	-47.2	173.2	179.7	-103.5	0	0	0	111.7	D250 H251 K252 S257 E258	D250-Y254 PolarHBondContact O-N 2.77Å; H251-Y254 WeakPolarHBondContact O-CB 3.49Å; H251-Y254 PolarHBondContact O-N 3.4Å; K252-Y254 PolarHBondContact O-N 2.84Å; Y254-S257 PolarHBondContact O-N 3.39Å; Y254-S257 PolarHBondContact O-OG 3.31Å; Y254-E258 WeakPolarHBondContact O-CB 3.37Å; Y254-E258 PolarHBondContact O-N 2.84Å
255	I	47.9	Very low	47.5	Very low	36 Å²	36	78.7 Å²	78.7	19%	0.185	44%	0.435	C	S	.	.	H	α-helix	trans	-67.7	-39.2	178.2	-68.1	171.6	0	0	0	112.2	H251 K252 S257 E258 A259 T338 L342	H251-I255 VanDerWaalsContact O-CG1 3.29Å; H251-I255 WeakPolarHBondContact O-CG1 3.31Å; H251-I255 PolarHBondContact O-N 2.86Å; K252-I255 CarbonylContact O-C 3.52Å; K252-I255 PolarHBondContact O-N 3.1Å; I255-S257 VanDerWaalsContact C-N 3.33Å; I255-E258 PolarHBondContact O-N 2.91Å; I255-A259 WeakPolarHBondContact O-CB 3.47Å; I255-A259 PolarHBondContact O-N 3.01Å; I255-T338 HydrophobicContact CD1-CG2 4.02Å; I255-L342 HydrophobicContact CD1-CD1 3.7Å; I255-L342 HydrophobicContact CD1-CD2 3.87Å; I255-L342 HydrophobicContact CD1-CG 4.18Å
256	D	48.7	Very low	47.3	Very low	76 Å²	76	81 Å²	81	41%	0.406	45%	0.445	S	S	.	.	H	α-helix	trans	-68.4	-34.6	175.3	-86.5	4.3	0	0	0	110.2	K252 K260	K252-D256 VanDerWaalsContact O-CB 3.26Å; K252-D256 WeakPolarHBondContact O-CB 3.44Å; K252-D256 PolarHBondContact O-N 2.85Å; D256-K260 WeakPolarHBondContact O-CB 3.27Å; D256-K260 VanDerWaalsContact O-CG 3.23Å; D256-K260 WeakPolarHBondContact O-CG 3.38Å; D256-K260 PolarHBondContact O-N 3.12Å
257	S	53	Low	47.3	Very low	52 Å²	52	81.9 Å²	81.9	36%	0.364	44%	0.438	S	S	.	.	H	α-helix	trans	-67.4	-41.7	172	76	0	0	0	0	110.9	S253 Y254 I255 K260 T261	S253-S257 VanDerWaalsContact O-CB 3.3Å; S253-S257 WeakPolarHBondContact O-CB 3.23Å; S253-S257 PolarHBondContact O-N 2.94Å; S253-S257 PolarHBondContact O-OG 3.45Å; Y254-S257 PolarHBondContact O-N 3.39Å; Y254-S257 PolarHBondContact O-OG 3.31Å; I255-S257 VanDerWaalsContact C-N 3.33Å; S257-K260 PolarHBondContact O-N 3.48Å; S257-T261 VanDerWaalsContact O-CB 3.3Å; S257-T261 WeakPolarHBondContact O-CB 3.39Å; S257-T261 PolarHBondContact O-N 3.41Å; S257-T261 PolarHBondContact O-OG1 2.82Å
258	E	49.2	Very low	47.6	Very low	77 Å²	77	78.4 Å²	78.4	36%	0.36	43%	0.43	S	S	.	.	H	α-helix	trans	-66.5	-44.3	177.5	-138.5	65.5	-171	0	0	110.7	Y254 I255 T261 C262	Y254-E258 WeakPolarHBondContact O-CB 3.37Å; Y254-E258 PolarHBondContact O-N 2.84Å; I255-E258 PolarHBondContact O-N 2.91Å; E258-T261 CarbonylContact O-C 3.59Å; E258-T261 WeakPolarHBondContact O-CB 3.49Å; E258-T261 PolarHBondContact O-N 3.4Å; E258-T261 VanDerWaalsContact O-N 3.16Å; E258-C262 PolarHBondContact O-N 3.25Å; E258-C262 PolarHBondContact O-SG 3.08Å
259	A	45.4	Very low	47.6	Very low	36 Å²	36	77.5 Å²	77.5	30%	0.298	43%	0.432	S	S	.	.	H	α-helix	trans	-65.4	-40.9	176.7	0	0	0	0	0	111.7	I255 T261 C262 L263	I255-A259 WeakPolarHBondContact O-CB 3.47Å; I255-A259 PolarHBondContact O-N 3.01Å; A259-T261 VanDerWaalsContact C-N 3.31Å; A259-C262 PolarHBondContact O-N 3.06Å; A259-L263 VanDerWaalsContact O-CB 3.28Å; A259-L263 WeakPolarHBondContact O-CB 3.49Å; A259-L263 PolarHBondContact O-N 3.49Å
260	K	47.5	Very low	47.3	Very low	153 Å²	153	77.3 Å²	77.3	67%	0.665	43%	0.43	S	S	*	.	H	α-helix	trans	-64.8	-36.2	171.7	-82	176.8	179.7	175.6	0	111.8	D256 S257 L263 G264	D256-K260 WeakPolarHBondContact O-CB 3.27Å; D256-K260 VanDerWaalsContact O-CG 3.23Å; D256-K260 WeakPolarHBondContact O-CG 3.38Å; D256-K260 PolarHBondContact O-N 3.12Å; S257-K260 PolarHBondContact O-N 3.48Å; K260-L263 PolarHBondContact O-N 3.39Å; K260-G264 WeakPolarHBondContact O-CA 3.08Å; K260-G264 PolarHBondContact O-N 3.44Å
261	T	50.7	Low	47.1	Very low	77 Å²	77	76.6 Å²	76.6	47%	0.472	43%	0.426	S	S	.	.	H	α-helix	trans	-66.5	-45.2	175.4	-57.7	0	0	0	0	110	S257 E258 A259 L263 G264 M265	S257-T261 VanDerWaalsContact O-CB 3.3Å; S257-T261 WeakPolarHBondContact O-CB 3.39Å; S257-T261 PolarHBondContact O-N 3.41Å; S257-T261 PolarHBondContact O-OG1 2.82Å; E258-T261 CarbonylContact O-C 3.59Å; E258-T261 WeakPolarHBondContact O-CB 3.49Å; E258-T261 PolarHBondContact O-N 3.4Å; E258-T261 VanDerWaalsContact O-N 3.16Å; A259-T261 VanDerWaalsContact C-N 3.31Å; T261-L263 PolarHBondContact O-N 3.29Å; T261-G264 PolarHBondContact O-N 2.96Å; T261-M265 HydrophobicContact CG2-CE 4.47Å; T261-M265 VanDerWaalsContact O-CG 3.32Å; T261-M265 WeakPolarHBondContact O-CG 3.43Å; T261-M265 PolarHBondContact O-N 3.16Å
262	C	43.9	Very low	46.9	Very low	47 Å²	47	78.7 Å²	78.7	32%	0.318	43%	0.43	S	S	.	.	H	α-helix	trans	-62	-42.6	173	-66.3	0	0	0	0	112.8	E258 A259 M265 L266	E258-C262 PolarHBondContact O-N 3.25Å; E258-C262 PolarHBondContact O-SG 3.08Å; A259-C262 PolarHBondContact O-N 3.06Å; C262-M265 PolarHBondContact O-N 3.2Å; C262-L266 WeakPolarHBondContact O-CG 3.35Å; C262-L266 PolarHBondContact O-N 2.85Å
263	L	43.4	Very low	46.3	Very low	100 Å²	100	81 Å²	81	52%	0.524	44%	0.437	S	S	.	.	H	α-helix	trans	-67.8	-38.4	177.1	-160.2	79.7	0	0	0	111.4	A259 K260 T261 L266 L267	A259-L263 VanDerWaalsContact O-CB 3.28Å; A259-L263 WeakPolarHBondContact O-CB 3.49Å; A259-L263 PolarHBondContact O-N 3.49Å; K260-L263 PolarHBondContact O-N 3.39Å; T261-L263 PolarHBondContact O-N 3.29Å; L263-L266 WeakPolarHBondContact O-CB 3.49Å; L263-L266 PolarHBondContact O-N 3.2Å; L263-L267 HydrophobicContact CD2-CD1 4.42Å; L263-L267 HydrophobicContact CG-CD1 4.31Å; L263-L267 WeakPolarHBondContact O-CB 3.31Å; L263-L267 WeakPolarHBondContact O-CG 3.46Å; L263-L267 PolarHBondContact O-N 3.13Å
264	G	48.4	Very low	45.9	Very low	37 Å²	37	84.3 Å²	84.3	38%	0.381	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-40.3	173.1	0	0	0	0	0	111.8	K260 T261 L266 L267 S268	K260-G264 WeakPolarHBondContact O-CA 3.08Å; K260-G264 PolarHBondContact O-N 3.44Å; T261-G264 PolarHBondContact O-N 2.96Å; G264-L266 VanDerWaalsContact C-N 3.31Å; G264-L266 PolarHBondContact O-N 3.25Å; G264-L267 PolarHBondContact O-N 2.85Å; G264-S268 VanDerWaalsContact O-CB 3.25Å; G264-S268 WeakPolarHBondContact O-CB 3.24Å; G264-S268 PolarHBondContact O-N 3.05Å; G264-S268 PolarHBondContact O-OG 3.32Å; G264-S268 VanDerWaalsContact O-OG 3.07Å
265	M	46.9	Very low	45.8	Very low	119 Å²	119	85.4 Å²	85.4	59%	0.586	45%	0.452	S	S	*	.	H	α-helix	trans	-65.2	-32.4	172	-73.2	-168.2	-69.1	0	0	112.8	T261 C262 S268 G269	T261-M265 HydrophobicContact CG2-CE 4.47Å; T261-M265 VanDerWaalsContact O-CG 3.32Å; T261-M265 WeakPolarHBondContact O-CG 3.43Å; T261-M265 PolarHBondContact O-N 3.16Å; C262-M265 PolarHBondContact O-N 3.2Å; M265-S268 WeakPolarHBondContact CA-OG 3.45Å; M265-S268 PolarHBondContact O-OG 3.38Å; M265-S268 VanDerWaalsContact O-OG 3.1Å; M265-G269 PolarHBondContact O-N 3.24Å
266	L	45.1	Very low	45.8	Very low	68 Å²	68	87.6 Å²	87.6	36%	0.356	46%	0.461	S	S	.	.	H	α-helix	trans	-74	-44.7	175.4	-75.4	159.1	0	0	0	112	C262 L263 G264 G269 A270 I331	C262-L266 WeakPolarHBondContact O-CG 3.35Å; C262-L266 PolarHBondContact O-N 2.85Å; L263-L266 WeakPolarHBondContact O-CB 3.49Å; L263-L266 PolarHBondContact O-N 3.2Å; G264-L266 VanDerWaalsContact C-N 3.31Å; G264-L266 PolarHBondContact O-N 3.25Å; L266-G269 PolarHBondContact O-N 2.85Å; L266-A270 PolarHBondContact O-N 3.21Å; L266-I331 HydrophobicContact CD1-CD1 3.53Å; L266-I331 HydrophobicContact CD2-CD1 3.92Å; L266-I331 HydrophobicContact CG-CD1 4.21Å
267	L	45.8	Very low	45.2	Very low	98 Å²	98	89.3 Å²	89.3	51%	0.513	47%	0.47	S	S	.	.	H	α-helix	trans	-71.8	-35.2	179.6	-72.6	171.5	0	0	0	111.6	L263 G264 G269 A270 L271	L263-L267 HydrophobicContact CD2-CD1 4.42Å; L263-L267 HydrophobicContact CG-CD1 4.31Å; L263-L267 WeakPolarHBondContact O-CB 3.31Å; L263-L267 WeakPolarHBondContact O-CG 3.46Å; L263-L267 PolarHBondContact O-N 3.13Å; G264-L267 PolarHBondContact O-N 2.85Å; L267-G269 VanDerWaalsContact C-N 3.25Å; L267-G269 PolarHBondContact O-N 2.64Å; L267-A270 PolarHBondContact O-N 2.66Å; L267-A270 VanDerWaalsContact O-N 3.16Å; L267-L271 WeakPolarHBondContact O-CB 3.41Å; L267-L271 PolarHBondContact O-N 3.46Å
268	S	51.6	Low	44.6	Very low	74 Å²	74	90.1 Å²	90.1	52%	0.517	48%	0.479	S	S	.	.	H	α-helix	trans	-64.3	-34.9	171.9	66.2	0	0	0	0	111.4	G264 M265 W272	G264-S268 VanDerWaalsContact O-CB 3.25Å; G264-S268 WeakPolarHBondContact O-CB 3.24Å; G264-S268 PolarHBondContact O-N 3.05Å; G264-S268 PolarHBondContact O-OG 3.32Å; G264-S268 VanDerWaalsContact O-OG 3.07Å; M265-S268 WeakPolarHBondContact CA-OG 3.45Å; M265-S268 PolarHBondContact O-OG 3.38Å; M265-S268 VanDerWaalsContact O-OG 3.1Å; S268-W272 WeakPolarHBondContact O-CB 3.46Å; S268-W272 PolarHBondContact O-N 3.23Å; S268-W272 VanDerWaalsContact O-N 3.08Å
269	G	44.5	Very low	44.6	Very low	22 Å²	22	92.3 Å²	92.3	23%	0.227	49%	0.494	C	S	.	.	H	α-helix	trans	-59.3	-56.1	165.1	0	0	0	0	0	111.4	M265 L266 L267 L271 W272 W273	M265-G269 PolarHBondContact O-N 3.24Å; L266-G269 PolarHBondContact O-N 2.85Å; L267-G269 VanDerWaalsContact C-N 3.25Å; L267-G269 PolarHBondContact O-N 2.64Å; G269-L271 PolarHBondContact O-N 2.99Å; G269-W272 WeakPolarHBondContact O-CA 3.39Å; G269-W272 VanDerWaalsContact O-CB 3.28Å; G269-W272 WeakPolarHBondContact O-CB 3.43Å; G269-W272 PolarHBondContact O-N 3.37Å; G269-W273 PolarHBondContact O-N 2.87Å; G269-W273 VanDerWaalsContact O-N 3.12Å
270	A	40.5	Very low	44.2	Very low	49 Å²	49	96 Å²	96	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-59.8	-40.7	-178.2	0	0	0	0	0	113.8	L266 L267 W272 W273 E274	L266-A270 PolarHBondContact O-N 3.21Å; L267-A270 PolarHBondContact O-N 2.66Å; L267-A270 VanDerWaalsContact O-N 3.16Å; A270-W272 VanDerWaalsContact C-N 3.29Å; A270-W272 PolarHBondContact O-N 2.78Å; A270-W273 WeakPolarHBondContact O-CA 3.45Å; A270-W273 WeakPolarHBondContact O-CB 3.09Å; A270-W273 PolarHBondContact O-N 3.44Å; A270-W273 VanDerWaalsContact O-N 3.12Å; A270-E274 PolarHBondContact O-N 3.1Å
271	L	44.2	Very low	43.6	Very low	108 Å²	108	92.6 Å²	92.6	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-64.6	-32.6	174.1	-94	142	0	0	0	112.2	L267 G269 W273 E274 K275	L267-L271 WeakPolarHBondContact O-CB 3.41Å; L267-L271 PolarHBondContact O-N 3.46Å; G269-L271 PolarHBondContact O-N 2.99Å; L271-W273 VanDerWaalsContact C-N 3.32Å; L271-E274 PolarHBondContact O-N 2.7Å; L271-K275 PolarHBondContact O-N 2.86Å
272	W	42.1	Very low	42.8	Very low	145 Å²	145	97.6 Å²	97.6	55%	0.549	52%	0.519	S	S	.	.	H	α-helix	trans	-65.9	-37.7	172.4	-163.8	82.5	0	0	0	111.2	S268 G269 A270 K275 Q276	S268-W272 WeakPolarHBondContact O-CB 3.46Å; S268-W272 PolarHBondContact O-N 3.23Å; S268-W272 VanDerWaalsContact O-N 3.08Å; G269-W272 WeakPolarHBondContact O-CA 3.39Å; G269-W272 VanDerWaalsContact O-CB 3.28Å; G269-W272 WeakPolarHBondContact O-CB 3.43Å; G269-W272 PolarHBondContact O-N 3.37Å; A270-W272 VanDerWaalsContact C-N 3.29Å; A270-W272 PolarHBondContact O-N 2.78Å; W272-K275 PolarHBondContact O-N 3.15Å; W272-Q276 HydrophobicContact CD2-CG 4.41Å; W272-Q276 HydrophobicContact CE3-CG 4.16Å; W272-Q276 HydrophobicContact CH2-CG 4.24Å; W272-Q276 HydrophobicContact CZ2-CG 4.48Å; W272-Q276 HydrophobicContact CZ3-CG 4.08Å; W272-Q276 WeakPolarHBondContact O-CG 3.43Å; W272-Q276 PolarHBondContact O-N 3.11Å
273	W	33.6	Very low	42.3	Very low	130 Å²	130	102.2 Å²	102.2	49%	0.492	54%	0.539	S	S	.	.	H	α-helix	trans	-67.9	-41.2	172.6	-98	-99.8	0	0	0	113	G269 A270 L271 K275 Q276 L277	G269-W273 PolarHBondContact O-N 2.87Å; G269-W273 VanDerWaalsContact O-N 3.12Å; A270-W273 WeakPolarHBondContact O-CA 3.45Å; A270-W273 WeakPolarHBondContact O-CB 3.09Å; A270-W273 PolarHBondContact O-N 3.44Å; A270-W273 VanDerWaalsContact O-N 3.12Å; L271-W273 VanDerWaalsContact C-N 3.32Å; W273-K275 PolarHBondContact O-N 3.21Å; W273-Q276 PolarHBondContact O-N 2.89Å; W273-L277 PolarHBondContact O-N 3.13Å
274	E	41.9	Very low	42.1	Very low	136 Å²	136	102.4 Å²	102.4	64%	0.636	54%	0.541	S	S	*	.	H	α-helix	trans	-60.1	-37.9	174.7	-77	-176.3	168.4	0	0	111.4	A270 L271 L277 A278	A270-E274 PolarHBondContact O-N 3.1Å; L271-E274 PolarHBondContact O-N 2.7Å; E274-L277 PolarHBondContact O-N 3.32Å; E274-A278 PolarHBondContact O-N 3.36Å; E274-A278 VanDerWaalsContact O-N 3.08Å
275	K	47.2	Very low	41.5	Very low	153 Å²	153	109.6 Å²	109.6	67%	0.665	56%	0.564	S	S	*	*	H	α-helix	trans	-68.1	-38.6	176.1	-139.3	176.1	-174.4	-177.2	0	112.6	L271 W272 W273 A278 D279	L271-K275 PolarHBondContact O-N 2.86Å; W272-K275 PolarHBondContact O-N 3.15Å; W273-K275 PolarHBondContact O-N 3.21Å; K275-A278 PolarHBondContact O-N 2.93Å; K275-D279 PolarHBondContact O-N 3.49Å
276	Q	47.7	Very low	41.1	Very low	82 Å²	82	110.5 Å²	110.5	38%	0.383	57%	0.572	S	S	.	*	H	α-helix	trans	-71	-34.2	176	-72.8	-67	-69.7	0	0	113	W272 W273 D279 I280	W272-Q276 HydrophobicContact CD2-CG 4.41Å; W272-Q276 HydrophobicContact CE3-CG 4.16Å; W272-Q276 HydrophobicContact CH2-CG 4.24Å; W272-Q276 HydrophobicContact CZ2-CG 4.48Å; W272-Q276 HydrophobicContact CZ3-CG 4.08Å; W272-Q276 WeakPolarHBondContact O-CG 3.43Å; W272-Q276 PolarHBondContact O-N 3.11Å; W273-Q276 PolarHBondContact O-N 2.89Å; Q276-D279 PolarHBondContact O-N 2.8Å; Q276-I280 WeakPolarHBondContact O-CG1 3.21Å; Q276-I280 PolarHBondContact O-N 3.43Å
277	L	36.7	Very low	40.6	Very low	113 Å²	113	114.5 Å²	114.5	59%	0.592	59%	0.593	S	S	*	*	H	α-helix	trans	-70.7	-32.7	175.3	-79.8	161.8	0	0	0	112.2	W273 E274 D279 I280 A281	W273-L277 PolarHBondContact O-N 3.13Å; E274-L277 PolarHBondContact O-N 3.32Å; L277-D279 VanDerWaalsContact C-N 3.29Å; L277-D279 PolarHBondContact O-N 3.07Å; L277-I280 PolarHBondContact O-N 3Å; L277-A281 PolarHBondContact O-N 3.22Å
278	A	41.4	Very low	40.1	Very low	68 Å²	68	118.6 Å²	118.6	56%	0.562	61%	0.61	S	S	*	*	H	α-helix	trans	-63.4	-35.2	173.9	0	0	0	0	0	112.3	E274 K275	E274-A278 PolarHBondContact O-N 3.36Å; E274-A278 VanDerWaalsContact O-N 3.08Å; K275-A278 PolarHBondContact O-N 2.93Å
279	D	47.7	Very low	39.3	Very low	123 Å²	123	119.9 Å²	119.9	66%	0.658	63%	0.625	S	S	*	*	H	α-helix	trans	-78.2	-19.8	178	-68.8	-20.3	0	0	0	113.1	K275 Q276 L277	K275-D279 PolarHBondContact O-N 3.49Å; Q276-D279 PolarHBondContact O-N 2.8Å; L277-D279 VanDerWaalsContact C-N 3.29Å; L277-D279 PolarHBondContact O-N 3.07Å
280	I	37	Very low	38.7	Very low	113 Å²	113	126 Å²	126	58%	0.579	65%	0.652	S	S	*	*	H	α-helix	trans	-91.1	-17.5	179.2	-65.4	170.3	0	0	0	112.3	Q276 L277 Y282	Q276-I280 WeakPolarHBondContact O-CG1 3.21Å; Q276-I280 PolarHBondContact O-N 3.43Å; L277-I280 PolarHBondContact O-N 3Å; I280-Y282 PolarHBondContact O-N 3.08Å
281	A	34.9	Very low	38.3	Very low	82 Å²	82	128 Å²	128	68%	0.678	66%	0.664	S	S	*	*	S	Bend	trans	-81.5	10.9	-175.1	0	0	0	0	0	115.3	L277	L277-A281 PolarHBondContact O-N 3.22Å
282	Y	35	Very low	37.7	Very low	182 Å²	182	129.6 Å²	129.6	71%	0.714	67%	0.673	S	S	*	*			trans	-120.7	67.4	177.4	-128.4	-90	0	0	0	110.3	I280 D284	I280-Y282 PolarHBondContact O-N 3.08Å; Y282-D284 WeakPolarHBondContact CE1-OD2 3.49Å
283	I	33.2	Very low	36.9	Very low	145 Å²	145	129.9 Å²	129.9	74%	0.744	68%	0.684	S	S	*	*			trans	-103.3	88.8	156.7	-58.1	174.9	0	0	0	103.6	E285	I283-E285 PolarHBondContact O-N 3.26Å
284	D	38.3	Very low	36.9	Very low	103 Å²	103	129.6 Å²	129.6	55%	0.551	70%	0.699	S	S	*	*			trans	-59.8	117.9	165.7	-87.9	-28.5	0	0	0	106.5	Y282 D286	Y282-D284 WeakPolarHBondContact CE1-OD2 3.49Å; D284-D286 PolarHBondContact O-N 3.43Å
285	E	35.9	Very low	36.2	Very low	188 Å²	188	130.4 Å²	130.4	88%	0.879	71%	0.707	S	S	*	*			trans	-68.1	74.8	162.6	-69.7	-178.2	164.6	0	0	107.2	I283	I283-E285 PolarHBondContact O-N 3.26Å
286	D	39.3	Very low	35.3	Very low	138 Å²	138	130.6 Å²	130.6	74%	0.738	71%	0.71	S	S	*	*			trans	-122.2	123.9	166.1	-83.6	-35.6	0	0	0	109.7	D284	D284-D286 PolarHBondContact O-N 3.43Å
287	D	35.1	Very low	34.2	Very low	152 Å²	152	134.9 Å²	134.9	81%	0.813	74%	0.735	S	S	*	*			trans	-61.1	171.6	-174.8	-66.2	-67.8	0	0	0	114.4
288	E	34.8	Very low	33.9	Very low	185 Å²	185	137.7 Å²	137.7	86%	0.864	74%	0.742	S	S	*	*			trans	86.8	91.9	160.5	-65.6	-171.7	149.1	0	0	118.8
289	A	35.2	Very low	33.1	Very low	100 Å²	100	139.7 Å²	139.7	83%	0.826	75%	0.752	S	S	*	*				46.7	86.9	117.4	0	0	0	0	0	117.2
290	N	31.1	Very low	32.4	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	76%	0.756	S	S	*	*			trans	-144.3	95.5	143.3	-154.6	2.8	0	0	0	111.5	N292	N290-N292 PolarHBondContact O-N 2.76Å
291	S	31.5	Very low	32.1	Very low	93 Å²	93	140.8 Å²	140.8	65%	0.65	77%	0.767	S	S	*	*			trans	-54	121.7	157.1	50.5	0	0	0	0	109.3
292	N	33.2	Very low	31.8	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	77%	0.772	S	S	*	*			trans	176.1	99.5	134.3	-83.5	-33.1	0	0	0	109.2	N290 P294	N290-N292 PolarHBondContact O-N 2.76Å; N292-P294 WeakPolarHBondContact O-CD 3.46Å
293	L	25.4	Very low	31.8	Very low	151 Å²	151	139.1 Å²	139.1	79%	0.791	78%	0.777	S	S	*	*			trans	-63.4	137.6	159.7	-103.1	81.1	0	0	0	109.1	L295	L293-L295 HydrophobicContact CD2-CD1 4.28Å; L293-L295 HydrophobicContact CD2-CG 4.25Å
294	P	32.2	Very low	31.7	Very low	123 Å²	123	136.7 Å²	136.7	80%	0.799	78%	0.779	S	S	*	*			trans	-130.2	121	134.1	6.5	15.8	0	0	0	111.4	N292	N292-P294 WeakPolarHBondContact O-CD 3.46Å
295	L	26.7	Very low	31.5	Very low	153 Å²	153	140.8 Å²	140.8	80%	0.801	80%	0.795	S	S	*	*			trans	-76.2	114.9	166.9	-71.7	157	0	0	0	108.8	L293	L293-L295 HydrophobicContact CD2-CD1 4.28Å; L293-L295 HydrophobicContact CD2-CG 4.25Å
296	E	29.6	Very low	31.1	Very low	158 Å²	158	137.8 Å²	137.8	74%	0.738	79%	0.794	S	S	*	*			trans	-132.4	102	158.1	-80.2	-159.4	176.7	0	0	111.1	K298	E296-K298 IonicContact OE2-NZ 3.36Å; E296-K298 PolarHBondContact OE2-NZ 2.81Å
297	L	24.8	Very low	30.9	Very low	172 Å²	172	137.1 Å²	137.1	90%	0.901	80%	0.8	S	S	*	*			trans	-74.6	115.5	168.1	-140.5	86.4	0	0	0	107.8
298	K	29.4	Very low	30.5	Very low	171 Å²	171	138.4 Å²	138.4	74%	0.743	80%	0.802	S	S	*	*			trans	-126.3	102.3	166	-80.7	-179.6	179.4	150.6	0	110.5	E296	E296-K298 IonicContact OE2-NZ 3.36Å; E296-K298 PolarHBondContact OE2-NZ 2.81Å
299	S	26	Very low	30.2	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	80%	0.804	S	S	*	*			trans	-72.9	134.3	159.3	50.7	0	0	0	0	109.9
300	S	31.4	Very low	30	Very low	107 Å²	107	142 Å²	142	75%	0.748	80%	0.801	S	S	*	*			trans	-153.6	96.6	162.8	51.3	0	0	0	0	110.4
301	D	30.9	Very low	29.9	Very low	152 Å²	152	142.2 Å²	142.2	81%	0.813	81%	0.808	S	S	*	*				43.4	110.3	123.7	-56.3	-26.4	0	0	0	120.4
302	A	28.8	Very low	29.8	Very low	93 Å²	93	142.5 Å²	142.5	77%	0.769	81%	0.81	S	S	*	*				45.9	113.6	120.1	0	0	0	0	0	120.1
303	V	36	Very low	29.4	Very low	136 Å²	136	141.6 Å²	141.6	82%	0.824	81%	0.813	S	S	*	*			trans	-146.6	122.5	130.5	179.6	0	0	0	0	109.1
304	A	29.5	Very low	29.6	Very low	95 Å²	95	139.8 Å²	139.8	79%	0.785	81%	0.813	S	S	*	*			trans	-85.3	131.4	171.6	0	0	0	0	0	110.4
305	Q	34.9	Very low	29.4	Very low	189 Å²	189	142.3 Å²	142.3	88%	0.883	81%	0.813	S	S	*	*			trans	-139.1	119.1	157.2	-75.5	-170.8	-11.8	0	0	110.1
306	S	27	Very low	29.5	Very low	124 Å²	124	139.6 Å²	139.6	87%	0.867	81%	0.814	S	S	*	*			trans	-78.2	130.1	175.3	50.6	0	0	0	0	111.2
307	S	35.9	Very low	29.6	Very low	124 Å²	124	137.4 Å²	137.4	87%	0.867	81%	0.811	S	S	*	*			trans	-156.4	131.9	155	-172.5	0	0	0	0	110
308	E	26.6	Very low	29.9	Very low	180 Å²	180	136.9 Å²	136.9	84%	0.841	81%	0.809	S	S	*	*			trans	-79.2	143.6	-168.1	-59.1	166.6	151.7	0	0	112.5
309	R	28.4	Very low	29.9	Very low	243 Å²	243	138.3 Å²	138.3	92%	0.917	81%	0.81	S	S	*	*			trans	138	156.2	154.2	-77.9	164.8	-173.6	-173.7	4.1	112.4
310	P	31.1	Very low	30.1	Very low	117 Å²	117	142.3 Å²	142.3	76%	0.76	82%	0.816	S	S	*	*				-107.2	159.2	-67.7	33.6	-18.2	0	0	0	111.7	S312	P310-S312 PolarHBondContact O-N 3.46Å
311	V	28.2	Very low	30.4	Very low	155 Å²	155	143.9 Å²	143.9	94%	0.939	81%	0.81	S	S	*	*			trans	-17.3	86.8	173.8	-167.8	0	0	0	0	115.4
312	S	29.1	Very low	30.8	Very low	99 Å²	99	141.5 Å²	141.5	69%	0.692	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-92.7	138.3	163.3	70.9	0	0	0	0	108.8	P310 S314	P310-S312 PolarHBondContact O-N 3.46Å; S312-S314 PolarHBondContact O-N 3.2Å
313	C	25.7	Very low	31.5	Very low	122 Å²	122	140.3 Å²	140.3	82%	0.824	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-50.8	123.9	-175.7	-67.1	0	0	0	0	110.1	H315	C313-H315 PolarHBondContact O-N 3.42Å; C313-H315 VanDerWaalsContact O-N 3.13Å
314	S	28.9	Very low	32	Very low	113 Å²	113	138 Å²	138	79%	0.79	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-51	120.7	-179.4	38.6	0	0	0	0	109.8	S312 A316	S312-S314 PolarHBondContact O-N 3.2Å; S314-A316 PolarHBondContact O-N 3.34Å
315	H	28.6	Very low	33.1	Very low	175 Å²	175	138.2 Å²	138.2	81%	0.81	78%	0.781	S	S	*	*			trans	-48.7	105.7	167.1	-77.6	-81.9	0	0	0	108	C313 T317	C313-H315 PolarHBondContact O-N 3.42Å; C313-H315 VanDerWaalsContact O-N 3.13Å; H315-T317 PolarHBondContact O-N 3.41Å
316	A	29.9	Very low	33.9	Very low	97 Å²	97	132.7 Å²	132.7	80%	0.802	76%	0.757	S	S	*	*			trans	-55.2	108.5	168.1	0	0	0	0	0	105.8	S314 N318	S314-A316 PolarHBondContact O-N 3.34Å; A316-N318 PolarHBondContact O-N 3.05Å
317	T	30	Very low	35	Very low	111 Å²	111	132.8 Å²	132.8	68%	0.681	74%	0.738	S	S	*	*			trans	-53.8	134.5	176.4	43.3	0	0	0	0	107.9	H315 R319	H315-T317 PolarHBondContact O-N 3.41Å; T317-R319 PolarHBondContact O-N 2.93Å
318	N	31	Very low	35.3	Very low	161 Å²	161	130.7 Å²	130.7	86%	0.861	72%	0.722	S	S	*	*			trans	-55.3	78.2	171.2	-95.3	-19.5	0	0	0	109.2	A316 E320	A316-N318 PolarHBondContact O-N 3.05Å; N318-E320 PolarHBondContact O-N 2.81Å
319	R	29.3	Very low	36.6	Very low	202 Å²	202	130.5 Å²	130.5	76%	0.762	71%	0.714	S	S	*	*			trans	-78.6	109.9	160.8	-79.8	-173.3	174.9	173.2	-0.4	105.3	T317 F321	T317-R319 PolarHBondContact O-N 2.93Å; R319-F321 PolarHBondContact O-N 3.12Å
320	E	31.8	Very low	37.8	Very low	194 Å²	194	121 Å²	121	91%	0.907	69%	0.687	S	S	*	*			trans	-38.4	100.6	166.8	-70.1	170.8	152.4	0	0	109.4	N318 S322	N318-E320 PolarHBondContact O-N 2.81Å; E320-S322 PolarHBondContact O-N 3.42Å; E320-S322 VanDerWaalsContact O-N 3.09Å
321	F	36.1	Very low	38.7	Very low	139 Å²	139	118.1 Å²	118.1	61%	0.61	67%	0.665	S	S	*	*			trans	-86.5	89.3	-172.3	-124.5	-78.2	0	0	0	107.6	R319 G323	R319-F321 PolarHBondContact O-N 3.12Å; F321-G323 PolarHBondContact O-N 3.11Å
322	S	40.4	Very low	39.7	Very low	103 Å²	103	114.7 Å²	114.7	72%	0.72	64%	0.644	S	S	*	*			trans	-51.9	124.2	170.2	48.9	0	0	0	0	109.3	E320 D324	E320-S322 PolarHBondContact O-N 3.42Å; E320-S322 VanDerWaalsContact O-N 3.09Å; S322-D324 VanDerWaalsContact C-N 3.29Å; S322-D324 PolarHBondContact O-N 3.4Å
323	G	42.5	Very low	41.1	Very low	67 Å²	67	117.5 Å²	117.5	69%	0.691	64%	0.64	S	S	*	*			trans	-67.3	83.6	-176.1	0	0	0	0	0	111.2	F321 S325	F321-G323 PolarHBondContact O-N 3.11Å; G323-S325 PolarHBondContact O-N 2.9Å
324	D	48.3	Very low	42.4	Very low	88 Å²	88	118.9 Å²	118.9	47%	0.471	63%	0.628	S	S	.	*			trans	-69	104.4	176.5	-172.9	5.4	0	0	0	109.6	S322 N326 R327	S322-D324 VanDerWaalsContact C-N 3.29Å; S322-D324 PolarHBondContact O-N 3.4Å; D324-N326 PolarHBondContact O-N 3.36Å; D324-N326 WeakPolarHBondContact OD1-CB 3.13Å; D324-N326 PolarHBondContact OD1-N 3.49Å; D324-N326 VanDerWaalsContact OD1-N 3.15Å; D324-N326 PolarHBondContact OD1-ND2 3.47Å; D324-R327 PolarHBondContact O-N 2.81Å
325	S	52.2	Low	43.6	Very low	100 Å²	100	117.7 Å²	117.7	70%	0.699	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	-11.7	174.7	65.2	0	0	0	0	114.2	G323 P328	G323-S325 PolarHBondContact O-N 2.9Å; S325-P328 WeakPolarHBondContact O-CD 3.45Å
326	N	50.4	Low	44.9	Very low	73 Å²	73	114.2 Å²	114.2	39%	0.39	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.2	-15.2	173.4	-76.1	-45.5	0	0	0	115.1	D324 R329 A330	D324-N326 PolarHBondContact O-N 3.36Å; D324-N326 WeakPolarHBondContact OD1-CB 3.13Å; D324-N326 PolarHBondContact OD1-N 3.49Å; D324-N326 VanDerWaalsContact OD1-N 3.15Å; D324-N326 PolarHBondContact OD1-ND2 3.47Å; N326-R329 PolarHBondContact O-N 2.84Å; N326-A330 PolarHBondContact O-N 2.81Å
327	R	50.7	Low	46.5	Very low	125 Å²	125	114 Å²	114	47%	0.472	58%	0.582	S	S	.	*	H	α-helix	trans	-55	-50.8	-176.6	-88.7	-178.7	172.1	-176.2	-3.7	114	D324 R329 A330 I331	D324-R327 PolarHBondContact O-N 2.81Å; R327-R329 VanDerWaalsContact C-N 3.3Å; R327-R329 PolarHBondContact O-N 3.45Å; R327-A330 PolarHBondContact O-N 3.43Å; R327-I331 WeakPolarHBondContact O-CD1 3.32Å; R327-I331 VanDerWaalsContact O-CG1 3.3Å; R327-I331 WeakPolarHBondContact O-CG1 3.39Å; R327-I331 PolarHBondContact O-N 3.45Å
328	P	43.2	Very low	47.5	Very low	81 Å²	81	110 Å²	110	53%	0.526	56%	0.558	S	S	.	*	H	α-helix	trans	-59.3	-41.1	179.3	-23.1	33.4	0	0	0	112.3	S325 I331 T332	S325-P328 WeakPolarHBondContact O-CD 3.45Å; P328-I331 PolarHBondContact O-N 2.76Å; P328-T332 PolarHBondContact O-N 3.43Å; P328-T332 PolarHBondContact O-OG1 3.37Å; P328-T332 VanDerWaalsContact O-OG1 3.05Å
329	R	53.6	Low	48.7	Very low	176 Å²	176	106 Å²	106	66%	0.664	53%	0.534	S	S	*	.	H	α-helix	trans	-65.8	-40.4	177.8	-72.8	-179.3	170.4	169.9	-2.1	112.2	N326 R327 I331 R333	N326-R329 PolarHBondContact O-N 2.84Å; R327-R329 VanDerWaalsContact C-N 3.3Å; R327-R329 PolarHBondContact O-N 3.45Å; R329-I331 VanDerWaalsContact C-N 3.34Å; R329-R333 WeakPolarHBondContact O-CB 3.12Å; R329-R333 PolarHBondContact O-N 2.81Å
330	A	53.4	Low	50.1	Low	44 Å²	44	103.3 Å²	103.3	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-41.7	176	0	0	0	0	0	111.3	N326 R327 R333 Y334	N326-A330 PolarHBondContact O-N 2.81Å; R327-A330 PolarHBondContact O-N 3.43Å; A330-R333 WeakPolarHBondContact O-CB 3.25Å; A330-R333 PolarHBondContact O-N 2.8Å; A330-Y334 WeakPolarHBondContact O-CB 3.4Å; A330-Y334 PolarHBondContact O-N 2.78Å
331	I	50.5	Low	51.4	Low	56 Å²	56	98.4 Å²	98.4	29%	0.287	50%	0.503	S	S	.	.	H	α-helix	trans	-65.6	-47.3	177.2	-65.7	155.6	0	0	0	111.1	L266 R327 P328 R329 R333 Y334 L335	L266-I331 HydrophobicContact CD1-CD1 3.53Å; L266-I331 HydrophobicContact CD2-CD1 3.92Å; L266-I331 HydrophobicContact CG-CD1 4.21Å; R327-I331 WeakPolarHBondContact O-CD1 3.32Å; R327-I331 VanDerWaalsContact O-CG1 3.3Å; R327-I331 WeakPolarHBondContact O-CG1 3.39Å; R327-I331 PolarHBondContact O-N 3.45Å; P328-I331 PolarHBondContact O-N 2.76Å; R329-I331 VanDerWaalsContact C-N 3.34Å; I331-R333 VanDerWaalsContact C-N 3.26Å; I331-R333 PolarHBondContact O-N 3.23Å; I331-Y334 PolarHBondContact O-N 3.13Å; I331-Y334 VanDerWaalsContact O-N 3.14Å; I331-L335 HydrophobicContact CG2-CD1 4Å; I331-L335 HydrophobicContact CG2-CG 4.32Å; I331-L335 WeakPolarHBondContact O-CG 3.42Å; I331-L335 PolarHBondContact O-N 3.2Å
332	T	48.1	Very low	52.3	Low	82 Å²	82	93.7 Å²	93.7	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-58.2	-41.8	175.1	-54	0	0	0	0	111	P328 L335 L336	P328-T332 PolarHBondContact O-N 3.43Å; P328-T332 PolarHBondContact O-OG1 3.37Å; P328-T332 VanDerWaalsContact O-OG1 3.05Å; T332-L335 PolarHBondContact O-N 3.47Å; T332-L336 HydrophobicContact CG2-CD1 4Å; T332-L336 HydrophobicContact CG2-CG 4.44Å; T332-L336 WeakPolarHBondContact O-CB 3.47Å; T332-L336 VanDerWaalsContact O-CG 3.27Å; T332-L336 WeakPolarHBondContact O-CG 3.36Å; T332-L336 PolarHBondContact O-N 2.65Å
333	R	59.6	Low	53.1	Low	158 Å²	158	91.1 Å²	91.1	60%	0.596	46%	0.462	S	S	*	.	H	α-helix	trans	-61.1	-44.7	174.9	-115.6	-178.3	-78.1	126.1	-6.4	112	R329 A330 I331 Q337	R329-R333 WeakPolarHBondContact O-CB 3.12Å; R329-R333 PolarHBondContact O-N 2.81Å; A330-R333 WeakPolarHBondContact O-CB 3.25Å; A330-R333 PolarHBondContact O-N 2.8Å; I331-R333 VanDerWaalsContact C-N 3.26Å; I331-R333 PolarHBondContact O-N 3.23Å; R333-Q337 VanDerWaalsContact O-CB 3.31Å; R333-Q337 WeakPolarHBondContact O-CB 3.31Å; R333-Q337 PolarHBondContact O-N 3.33Å
334	Y	52.7	Low	54	Low	151 Å²	151	91.5 Å²	91.5	59%	0.592	45%	0.446	S	S	*	.	H	α-helix	trans	-62.6	-48.3	177.9	-177.8	-97.4	0	0	0	111.5	A330 I331 L336 Q337 T338	A330-Y334 WeakPolarHBondContact O-CB 3.4Å; A330-Y334 PolarHBondContact O-N 2.78Å; I331-Y334 PolarHBondContact O-N 3.13Å; I331-Y334 VanDerWaalsContact O-N 3.14Å; Y334-L336 PolarHBondContact O-N 3.46Å; Y334-Q337 PolarHBondContact O-N 3Å; Y334-T338 PolarHBondContact O-N 3.06Å; Y334-T338 PolarHBondContact O-OG1 3.37Å
335	L	53.4	Low	54.4	Low	88 Å²	88	94.6 Å²	94.6	46%	0.461	45%	0.452	S	S	.	.	H	α-helix	trans	-61.1	-42.3	178.4	-69.4	173.6	0	0	0	112.6	I331 T332 T338 E339	I331-L335 HydrophobicContact CG2-CD1 4Å; I331-L335 HydrophobicContact CG2-CG 4.32Å; I331-L335 WeakPolarHBondContact O-CG 3.42Å; I331-L335 PolarHBondContact O-N 3.2Å; T332-L335 PolarHBondContact O-N 3.47Å; L335-T338 PolarHBondContact O-N 3.24Å; L335-E339 WeakPolarHBondContact O-CB 3.19Å; L335-E339 PolarHBondContact O-N 2.8Å
336	L	56.7	Low	54.4	Low	102 Å²	102	90.3 Å²	90.3	53%	0.534	42%	0.422	S	S	.	.	H	α-helix	trans	-66.1	-39.2	175.5	-72.4	171.6	0	0	0	112	T332 Y334 E339 R340	T332-L336 HydrophobicContact CG2-CD1 4Å; T332-L336 HydrophobicContact CG2-CG 4.44Å; T332-L336 WeakPolarHBondContact O-CB 3.47Å; T332-L336 VanDerWaalsContact O-CG 3.27Å; T332-L336 WeakPolarHBondContact O-CG 3.36Å; T332-L336 PolarHBondContact O-N 2.65Å; Y334-L336 PolarHBondContact O-N 3.46Å; L336-E339 PolarHBondContact O-N 2.9Å; L336-R340 WeakPolarHBondContact O-CB 3.5Å; L336-R340 PolarHBondContact O-N 3.08Å
337	Q	63	Low	54.7	Low	93 Å²	93	90.3 Å²	90.3	44%	0.435	42%	0.42	S	S	.	.	H	α-helix	trans	-65.7	-44.7	176	-175.9	63.5	23.5	0	0	111	R333 Y334 E339 R340 L341	R333-Q337 VanDerWaalsContact O-CB 3.31Å; R333-Q337 WeakPolarHBondContact O-CB 3.31Å; R333-Q337 PolarHBondContact O-N 3.33Å; Y334-Q337 PolarHBondContact O-N 3Å; Q337-E339 VanDerWaalsContact C-N 3.34Å; Q337-E339 PolarHBondContact O-N 3.41Å; Q337-R340 WeakPolarHBondContact O-CB 3.37Å; Q337-R340 PolarHBondContact O-N 3.49Å; Q337-L341 HydrophobicContact CG-CD1 4.31Å; Q337-L341 WeakPolarHBondContact O-CG 3.19Å; Q337-L341 PolarHBondContact O-N 3.18Å
338	T	51.2	Low	54.8	Low	27 Å²	27	92.2 Å²	92.2	17%	0.166	43%	0.434	C	S	.	.	H	α-helix	trans	-62	-43	175.3	-55.7	0	0	0	0	110.9	I255 Y334 L335 R340 L341 L342	I255-T338 HydrophobicContact CD1-CG2 4.02Å; Y334-T338 PolarHBondContact O-N 3.06Å; Y334-T338 PolarHBondContact O-OG1 3.37Å; L335-T338 PolarHBondContact O-N 3.24Å; T338-R340 VanDerWaalsContact C-N 3.3Å; T338-R340 PolarHBondContact O-N 3.44Å; T338-L341 PolarHBondContact O-N 3.41Å; T338-L342 HydrophobicContact CG2-CD1 4.42Å; T338-L342 VanDerWaalsContact O-CG 3.26Å; T338-L342 WeakPolarHBondContact O-CG 3.37Å; T338-L342 PolarHBondContact O-N 3.48Å
339	E	55.9	Low	55.4	Low	77 Å²	77	90.4 Å²	90.4	36%	0.36	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-40.4	174.3	178.3	162.9	-125.2	0	0	112.4	K216 L335 L336 Q337 N343	K216-E339 IonicContact NZ-OE1 2.8Å; K216-E339 PolarHBondContact NZ-OE1 2.92Å; L335-E339 WeakPolarHBondContact O-CB 3.19Å; L335-E339 PolarHBondContact O-N 2.8Å; L336-E339 PolarHBondContact O-N 2.9Å; Q337-E339 VanDerWaalsContact C-N 3.34Å; Q337-E339 PolarHBondContact O-N 3.41Å; E339-N343 VanDerWaalsContact O-CG 3.23Å; E339-N343 PolarHBondContact O-N 3.2Å; E339-N343 VanDerWaalsContact O-N 3.08Å; E339-N343 PolarHBondContact O-ND2 2.85Å
340	R	59.6	Low	55.5	Low	146 Å²	146	85 Å²	85	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-63.3	-47.9	174.8	-179.2	179.9	170.3	169.4	-0.7	111.8	L336 Q337 T338 L342 N343 E344	L336-R340 WeakPolarHBondContact O-CB 3.5Å; L336-R340 PolarHBondContact O-N 3.08Å; Q337-R340 WeakPolarHBondContact O-CB 3.37Å; Q337-R340 PolarHBondContact O-N 3.49Å; T338-R340 VanDerWaalsContact C-N 3.3Å; T338-R340 PolarHBondContact O-N 3.44Å; R340-L342 VanDerWaalsContact C-N 3.32Å; R340-L342 PolarHBondContact O-N 3.16Å; R340-N343 PolarHBondContact O-N 2.86Å; R340-N343 VanDerWaalsContact O-N 3.16Å; R340-E344 WeakPolarHBondContact CG-OE1 3.38Å; R340-E344 IonicContact CZ-OE1 3.96Å; R340-E344 IonicContact NE-OE1 3.29Å; R340-E344 PolarHBondContact NE-OE1 2.93Å; R340-E344 IonicContact NH2-OE1 2.66Å; R340-E344 PolarHBondContact NH2-OE1 3.29Å; R340-E344 WeakPolarHBondContact O-CG 3.26Å; R340-E344 PolarHBondContact O-N 2.96Å
341	L	57.9	Low	56.5	Low	90 Å²	90	85.2 Å²	85.2	47%	0.471	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-38.9	178.8	-69.9	172.5	0	0	0	112.1	Q337 T338 E344 Y345	Q337-L341 HydrophobicContact CG-CD1 4.31Å; Q337-L341 WeakPolarHBondContact O-CG 3.19Å; Q337-L341 PolarHBondContact O-N 3.18Å; T338-L341 PolarHBondContact O-N 3.41Å; L341-E344 PolarHBondContact O-N 2.76Å; L341-Y345 WeakPolarHBondContact O-CB 3.4Å; L341-Y345 PolarHBondContact O-N 2.89Å
342	L	56.1	Low	58.2	Low	41 Å²	41	84 Å²	84	22%	0.215	41%	0.413	C	S	.	.	H	α-helix	trans	-62.5	-43.6	173.4	-71.6	172	0	0	0	112.1	I255 T338 R340 E344 Y345 D346	I255-L342 HydrophobicContact CD1-CD1 3.7Å; I255-L342 HydrophobicContact CD1-CD2 3.87Å; I255-L342 HydrophobicContact CD1-CG 4.18Å; T338-L342 HydrophobicContact CG2-CD1 4.42Å; T338-L342 VanDerWaalsContact O-CG 3.26Å; T338-L342 WeakPolarHBondContact O-CG 3.37Å; T338-L342 PolarHBondContact O-N 3.48Å; R340-L342 VanDerWaalsContact C-N 3.32Å; R340-L342 PolarHBondContact O-N 3.16Å; L342-E344 VanDerWaalsContact C-N 3.32Å; L342-E344 PolarHBondContact O-N 2.68Å; L342-Y345 PolarHBondContact O-N 2.81Å; L342-D346 PolarHBondContact O-N 3.43Å
343	N	57.2	Low	60.3	Low	49 Å²	49	82.2 Å²	82.2	26%	0.262	40%	0.4	S	S	.	.	H	α-helix	trans	-66.7	-34.8	177.8	-70	-35.3	0	0	0	112.3	E339 R340 M347	E339-N343 VanDerWaalsContact O-CG 3.23Å; E339-N343 PolarHBondContact O-N 3.2Å; E339-N343 VanDerWaalsContact O-N 3.08Å; E339-N343 PolarHBondContact O-ND2 2.85Å; R340-N343 PolarHBondContact O-N 2.86Å; R340-N343 VanDerWaalsContact O-N 3.16Å; N343-M347 WeakPolarHBondContact O-CG 3.44Å; N343-M347 PolarHBondContact O-N 3.38Å
344	E	60.1	Low	61.9	Low	74 Å²	74	78.4 Å²	78.4	35%	0.346	39%	0.394	S	S	.	.	H	α-helix	trans	-68.8	-44.6	174.5	-73.6	170.5	-178.6	0	0	110.4	R340 L341 L342 D346 M347 E348	R340-E344 WeakPolarHBondContact CG-OE1 3.38Å; R340-E344 IonicContact CZ-OE1 3.96Å; R340-E344 IonicContact NE-OE1 3.29Å; R340-E344 PolarHBondContact NE-OE1 2.93Å; R340-E344 IonicContact NH2-OE1 2.66Å; R340-E344 PolarHBondContact NH2-OE1 3.29Å; R340-E344 WeakPolarHBondContact O-CG 3.26Å; R340-E344 PolarHBondContact O-N 2.96Å; L341-E344 PolarHBondContact O-N 2.76Å; L342-E344 VanDerWaalsContact C-N 3.32Å; L342-E344 PolarHBondContact O-N 2.68Å; E344-D346 PolarHBondContact O-N 2.89Å; E344-M347 WeakPolarHBondContact O-CB 3.45Å; E344-M347 PolarHBondContact O-N 3.07Å; E344-M347 VanDerWaalsContact O-N 3.08Å; E344-E348 PolarHBondContact O-N 3.21Å
345	Y	57.8	Low	63.9	Low	153 Å²	153	71.3 Å²	71.3	60%	0.6	37%	0.366	S	S	*	.	H	α-helix	trans	-60.5	-42.4	175.8	-176.5	-95.6	0	0	0	113	L341 L342 M347 E348 S349	L341-Y345 WeakPolarHBondContact O-CB 3.4Å; L341-Y345 PolarHBondContact O-N 2.89Å; L342-Y345 PolarHBondContact O-N 2.81Å; Y345-M347 PolarHBondContact O-N 3.32Å; Y345-E348 PolarHBondContact O-N 3.31Å; Y345-S349 WeakPolarHBondContact O-CB 3.42Å; Y345-S349 PolarHBondContact O-N 2.88Å; Y345-S349 PolarHBondContact O-OG 3.35Å
346	D	52.1	Low	65.8	Low	11 Å²	11	70.3 Å²	70.3	6%	0.059	36%	0.362	C	S	.	.	H	α-helix	trans	-61.2	-30	176	-78.5	-3.7	0	0	0	112.5	Q248 L342 E344 S349	Q248-D346 PolarHBondContact NE2-OD1 3.24Å; Q248-D346 PolarHBondContact NE2-OD2 3.49Å; L342-D346 PolarHBondContact O-N 3.43Å; E344-D346 PolarHBondContact O-N 2.89Å; D346-S349 PolarHBondContact O-OG 3.12Å
347	M	55.4	Low	67.5	Low	72 Å²	72	66.2 Å²	66.2	36%	0.355	34%	0.34	S	S	.	.	H	α-helix	trans	-78.9	-38	176.3	-70.5	-81.9	-72.3	0	0	112.3	R217 N343 E344 Y345 V352	R217-M347 PolarHBondContact NH1-SD 3Å; N343-M347 WeakPolarHBondContact O-CG 3.44Å; N343-M347 PolarHBondContact O-N 3.38Å; E344-M347 WeakPolarHBondContact O-CB 3.45Å; E344-M347 PolarHBondContact O-N 3.07Å; E344-M347 VanDerWaalsContact O-N 3.08Å; Y345-M347 PolarHBondContact O-N 3.32Å; M347-V352 HydrophobicContact SD-CG2 4.25Å
348	E	53.5	Low	68.8	Low	166 Å²	166	63 Å²	63	78%	0.776	33%	0.327	S	S	*	.	H	α-helix	trans	-81.6	-29.3	-176.5	-71.5	-172.8	169.9	0	0	113.6	E344 Y345 G350	E344-E348 PolarHBondContact O-N 3.21Å; Y345-E348 PolarHBondContact O-N 3.31Å; E348-G350 PolarHBondContact O-N 2.98Å
349	S	56.2	Low	70.3	Confident	42 Å²	42	66.8 Å²	66.8	29%	0.294	34%	0.343	S	S	.	.	S	Bend	trans	-67.4	11.7	-174	51	0	0	0	0	115.8	Y345 D346 N351	Y345-S349 WeakPolarHBondContact O-CB 3.42Å; Y345-S349 PolarHBondContact O-N 2.88Å; Y345-S349 PolarHBondContact O-OG 3.35Å; D346-S349 PolarHBondContact O-OG 3.12Å; S349-N351 PolarHBondContact O-N 2.97Å
350	G	56.3	Low	71.6	Confident	63 Å²	63	64.3 Å²	64.3	65%	0.649	33%	0.333	S	S	*	.	S	Bend	trans	72.7	5.1	177.1	0	0	0	0	0	114.6	E348 V352	E348-G350 PolarHBondContact O-N 2.98Å; G350-V352 VanDerWaalsContact C-N 3.29Å; G350-V352 PolarHBondContact O-N 2.87Å
351	N	73.7	Confident	72.7	Confident	49 Å²	49	63.8 Å²	63.8	26%	0.262	34%	0.341	S	S	.	.			trans	-87	8	-176.3	-75.7	-19.3	0	0	0	114.3	S241 C244 S349	S241-N351 PolarHBondContact N-O 3.01Å; C244-N351 PolarHBondContact SG-ND2 3.33Å; C244-N351 VanDerWaalsContact SG-ND2 3.41Å; S349-N351 PolarHBondContact O-N 2.97Å
352	V	86.7	Confident	73.9	Confident	31 Å²	31	65.5 Å²	65.5	19%	0.188	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	115.2	-179.9	-174.9	0	0	0	0	110.1	K238 L239 V240 M347 G350	K238-V352 HydrophobicContact CB-CG1 3.82Å; K238-V352 HydrophobicContact CG-CG1 4.42Å; L239-V352 WeakPolarHBondContact O-CA 3.45Å; V240-V352 HydrophobicContact CG2-CG2 4.39Å; M347-V352 HydrophobicContact SD-CG2 4.25Å; G350-V352 VanDerWaalsContact C-N 3.29Å; G350-V352 PolarHBondContact O-N 2.87Å
353	L	91.3	Very high	75.1	Confident	43 Å²	43	65 Å²	65	23%	0.225	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	135.5	173.3	-54.2	-179.1	0	0	0	109.5	K238 L239 L355 Y389 P412	K238-L353 CarbonylContact C-O 3.52Å; K238-L353 WeakPolarHBondContact CA-O 3.26Å; L239-L353 HydrophobicContact CB-CB 4.4Å; L239-L353 PolarHBondContact N-O 2.66Å; L239-L353 PolarHBondContact O-N 3.18Å; L353-L355 HydrophobicContact CB-CD1 3.94Å; L353-Y389 HydrophobicContact CB-CE2 4.38Å; L353-Y389 HydrophobicContact CD1-CE1 4.47Å; L353-Y389 HydrophobicContact CD2-CE2 4.48Å; L353-Y389 WeakPolarHBondContact CD2-OH 3.35Å; L353-P412 HydrophobicContact CD1-CB 3.49Å; L353-P412 VanDerWaalsContact CD1-CB 3.49Å; L353-P412 HydrophobicContact CD1-CG 3.71Å
354	V	92.8	Very high	76.6	Confident	78 Å²	78	73 Å²	73	47%	0.473	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.5	174.7	-173.8	0	0	0	0	108.8	T236 V237 K238	T236-V354 HydrophobicContact CG2-CG1 3.7Å; V237-V354 WeakPolarHBondContact O-CA 3.35Å; K238-V354 HydrophobicContact CG-CG2 4.39Å
355	L	95.5	Very high	78	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.01	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152.2	179.1	-53.1	84.8	0	0	0	109.4	T236 V237 L239 L353 I387 Y389 V394 P412 F413	T236-L355 CarbonylContact C-O 3.49Å; T236-L355 WeakPolarHBondContact CA-O 3.31Å; V237-L355 HydrophobicContact CB-CB 4.35Å; V237-L355 PolarHBondContact N-O 2.78Å; V237-L355 PolarHBondContact O-N 2.9Å; L239-L355 HydrophobicContact CB-CD1 3.69Å; L239-L355 HydrophobicContact CD2-CD1 4.4Å; L353-L355 HydrophobicContact CB-CD1 3.94Å; L355-I387 HydrophobicContact CB-CG2 3.57Å; L355-I387 HydrophobicContact CD2-CG2 3.74Å; L355-I387 HydrophobicContact CG-CG2 4.32Å; L355-Y389 HydrophobicContact CD2-CD2 4.38Å; L355-Y389 HydrophobicContact CD2-CG 4.16Å; L355-Y389 HydrophobicContact CG-CD2 3.97Å; L355-Y389 HydrophobicContact CG-CG 4.25Å; L355-V394 HydrophobicContact CD2-CG2 3.84Å; L355-P412 HydrophobicContact CD2-CG 4.12Å; L355-F413 HydrophobicContact CD2-CE2 3.67Å; L355-F413 HydrophobicContact CD2-CZ 3.88Å
356	N	92.7	Very high	79.1	Confident	68 Å²	68	75.9 Å²	75.9	36%	0.364	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	153.6	178.5	-63.7	-65.3	0	0	0	110.7	L235 T236 N388	L235-N356 WeakPolarHBondContact O-CA 3.36Å; T236-N356 WeakPolarHBondContact CB-OD1 3.15Å; T236-N356 WeakPolarHBondContact CG2-OD1 3.27Å; T236-N356 PolarHBondContact OG1-OD1 2.92Å; N356-N388 PolarHBondContact O-N 3.14Å; N356-N388 VanDerWaalsContact O-N 3.08Å
357	N	92.2	Very high	80.7	Confident	15 Å²	15	82.4 Å²	82.4	8%	0.08	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	147.4	172.1	72.5	-68.8	0	0	0	112	L235 Q386 I387	L235-N357 HydrophobicContact CB-CB 4.01Å; L235-N357 PolarHBondContact N-OD1 3.12Å; L235-N357 PolarHBondContact O-N 3.05Å; L235-N357 PolarHBondContact O-OD1 2.93Å; N357-Q386 CarbonylContact C-O 3.52Å; N357-Q386 WeakPolarHBondContact CA-O 3.37Å; N357-Q386 WeakPolarHBondContact CB-O 3.31Å; N357-I387 HydrophobicContact CB-CD1 4.11Å
358	T	89.9	Confident	81.7	Confident	27 Å²	27	82.5 Å²	82.5	17%	0.166	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-68.6	134.2	173.7	-45	0	0	0	0	110	L371 Q386 N388	T358-L371 HydrophobicContact CG2-CD2 3.69Å; T358-Q386 PolarHBondContact N-O 2.86Å; T358-N388 PolarHBondContact OG1-ND2 2.68Å; T358-N388 PolarHBondContact OG1-OD1 2.81Å
359	H	84.8	Confident	82.8	Confident	106 Å²	106	79.2 Å²	79.2	49%	0.491	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-76	136.2	171.9	-66.8	-84.8	0	0	0	109.7
360	P	81.8	Confident	83.9	Confident	24 Å²	24	81.6 Å²	81.6	16%	0.156	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-64.9	146.8	176.3	29.7	-35.2	0	0	0	110.5	F369 L371	P360-F369 HydrophobicContact CB-CB 3.81Å; P360-F369 HydrophobicContact CB-CD1 4.25Å; P360-F369 HydrophobicContact CB-CG 4.47Å; P360-F369 HydrophobicContact CG-CB 3.8Å; P360-F369 HydrophobicContact CG-CD1 3.99Å; P360-F369 HydrophobicContact CG-CG 4.16Å; P360-L371 HydrophobicContact CB-CG 4.13Å
361	L	83.4	Confident	85.2	Confident	136 Å²	136	80.5 Å²	80.5	71%	0.712	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	141.5	174.4	-63.7	175.8	0	0	0	109.3	N363 F369 Q370	L361-N363 PolarHBondContact O-N 2.84Å; L361-F369 WeakPolarHBondContact O-CA 3.42Å; L361-Q370 PolarHBondContact N-O 3Å; L361-Q370 PolarHBondContact O-N 3.3Å
362	W	82.4	Confident	85.9	Confident	126 Å²	126	84.4 Å²	84.4	48%	0.477	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	115.3	173.1	-179.6	-106.7	0	0	0	109.9	E367 F369	W362-E367 HydrophobicContact CH2-CB 3.99Å; W362-E367 WeakPolarHBondContact CH2-O 3.28Å; W362-E367 HydrophobicContact CZ2-CB 3.88Å; W362-E367 HydrophobicContact CZ2-CG 4.34Å; W362-E367 WeakPolarHBondContact CZ3-O 3.32Å; W362-F369 HydrophobicContact CB-CD1 4.23Å; W362-F369 HydrophobicContact CB-CE1 3.84Å; W362-F369 HydrophobicContact CB-CZ 4.33Å; W362-F369 HydrophobicContact CD2-CZ 4.44Å; W362-F369 HydrophobicContact CE3-CD1 4.15Å; W362-F369 AromaticContact CE3-CD2 3.57Å; W362-F369 HydrophobicContact CE3-CD2 3.57Å; W362-F369 HydrophobicContact CE3-CE1 4.06Å; W362-F369 AromaticContact CE3-CE2 3.45Å; W362-F369 HydrophobicContact CE3-CE2 3.45Å; W362-F369 VanDerWaalsContact CE3-CE2 3.45Å; W362-F369 AromaticContact CE3-CG 3.92Å; W362-F369 HydrophobicContact CE3-CG 3.92Å; W362-F369 AromaticContact CE3-CZ 3.71Å; W362-F369 HydrophobicContact CE3-CZ 3.71Å; W362-F369 AromaticContact CZ3-CD2 3.78Å; W362-F369 HydrophobicContact CZ3-CD2 3.78Å; W362-F369 AromaticContact CZ3-CE2 3.76Å; W362-F369 HydrophobicContact CZ3-CE2 3.76Å; W362-F369 HydrophobicContact CZ3-CG 4.47Å; W362-F369 HydrophobicContact CZ3-CZ 4.43Å
363	N	81.5	Confident	86.1	Confident	30 Å²	30	84 Å²	84	16%	0.16	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	111.4	168.6	-175.8	-20.3	0	0	0	109	L361 E365 L366 E367 V368 Q370	L361-N363 PolarHBondContact O-N 2.84Å; N363-E365 VanDerWaalsContact C-N 3.32Å; N363-E365 PolarHBondContact O-N 3.22Å; N363-E365 WeakPolarHBondContact OD1-CB 3.48Å; N363-E365 PolarHBondContact OD1-N 3.41Å; N363-L366 HydrophobicContact CB-CB 4.44Å; N363-L366 PolarHBondContact OD1-N 2.71Å; N363-E367 WeakPolarHBondContact O-CA 3.26Å; N363-E367 PolarHBondContact O-N 3.47Å; N363-V368 WeakPolarHBondContact CB-O 3.42Å; N363-V368 PolarHBondContact N-O 3.23Å; N363-V368 PolarHBondContact O-N 2.89Å; N363-Q370 HydrophobicContact CB-CG 4.04Å; N363-Q370 PolarHBondContact ND2-NE2 2.7Å
364	R	89.1	Confident	85.9	Confident	216 Å²	216	85.1 Å²	85.1	82%	0.815	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-29.2	179.4	-70.1	-174.8	-176.2	168.5	1.8	113.7
365	E	88.7	Confident	85.7	Confident	178 Å²	178	84.4 Å²	84.4	83%	0.832	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-36	-177.7	-61.6	179.2	172.9	0	0	111.7	N363	N363-E365 VanDerWaalsContact C-N 3.32Å; N363-E365 PolarHBondContact O-N 3.22Å; N363-E365 WeakPolarHBondContact OD1-CB 3.48Å; N363-E365 PolarHBondContact OD1-N 3.41Å
366	L	82.2	Confident	85.5	Confident	110 Å²	110	87.9 Å²	87.9	58%	0.576	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-9.2	179.7	-61.5	-179.2	0	0	0	113.3	N363 V368	N363-L366 HydrophobicContact CB-CB 4.44Å; N363-L366 PolarHBondContact OD1-N 2.71Å; L366-V368 WeakPolarHBondContact O-CG2 3.34Å; L366-V368 PolarHBondContact O-N 3.43Å
367	E	84.7	Confident	85.5	Confident	149 Å²	149	85.7 Å²	85.7	70%	0.696	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	39.4	-171.3	-59.4	-170.3	153.6	0	0	113.4	W362 N363	W362-E367 HydrophobicContact CH2-CB 3.99Å; W362-E367 WeakPolarHBondContact CH2-O 3.28Å; W362-E367 HydrophobicContact CZ2-CB 3.88Å; W362-E367 HydrophobicContact CZ2-CG 4.34Å; W362-E367 WeakPolarHBondContact CZ3-O 3.32Å; N363-E367 WeakPolarHBondContact O-CA 3.26Å; N363-E367 PolarHBondContact O-N 3.47Å
368	V	75.8	Confident	85.4	Confident	74 Å²	74	89.5 Å²	89.5	45%	0.448	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.6	-177.5	173.9	0	0	0	0	111	N363 L366	N363-V368 WeakPolarHBondContact CB-O 3.42Å; N363-V368 PolarHBondContact N-O 3.23Å; N363-V368 PolarHBondContact O-N 2.89Å; L366-V368 WeakPolarHBondContact O-CG2 3.34Å; L366-V368 PolarHBondContact O-N 3.43Å
369	F	76.5	Confident	85.4	Confident	96 Å²	96	91.6 Å²	91.6	42%	0.421	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.3	167.8	-80.4	-72.7	0	0	0	110.7	P360 L361 W362	P360-F369 HydrophobicContact CB-CB 3.81Å; P360-F369 HydrophobicContact CB-CD1 4.25Å; P360-F369 HydrophobicContact CB-CG 4.47Å; P360-F369 HydrophobicContact CG-CB 3.8Å; P360-F369 HydrophobicContact CG-CD1 3.99Å; P360-F369 HydrophobicContact CG-CG 4.16Å; L361-F369 WeakPolarHBondContact O-CA 3.42Å; W362-F369 HydrophobicContact CB-CD1 4.23Å; W362-F369 HydrophobicContact CB-CE1 3.84Å; W362-F369 HydrophobicContact CB-CZ 4.33Å; W362-F369 HydrophobicContact CD2-CZ 4.44Å; W362-F369 HydrophobicContact CE3-CD1 4.15Å; W362-F369 AromaticContact CE3-CD2 3.57Å; W362-F369 HydrophobicContact CE3-CD2 3.57Å; W362-F369 HydrophobicContact CE3-CE1 4.06Å; W362-F369 AromaticContact CE3-CE2 3.45Å; W362-F369 HydrophobicContact CE3-CE2 3.45Å; W362-F369 VanDerWaalsContact CE3-CE2 3.45Å; W362-F369 AromaticContact CE3-CG 3.92Å; W362-F369 HydrophobicContact CE3-CG 3.92Å; W362-F369 AromaticContact CE3-CZ 3.71Å; W362-F369 HydrophobicContact CE3-CZ 3.71Å; W362-F369 AromaticContact CZ3-CD2 3.78Å; W362-F369 HydrophobicContact CZ3-CD2 3.78Å; W362-F369 AromaticContact CZ3-CE2 3.76Å; W362-F369 HydrophobicContact CZ3-CE2 3.76Å; W362-F369 HydrophobicContact CZ3-CG 4.47Å; W362-F369 HydrophobicContact CZ3-CZ 4.43Å
370	Q	79.8	Confident	85.4	Confident	93 Å²	93	95.2 Å²	95.2	44%	0.435	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	153.5	-179.2	63.4	177.1	17.3	0	0	112.8	L361 N363	L361-Q370 PolarHBondContact N-O 3Å; L361-Q370 PolarHBondContact O-N 3.3Å; N363-Q370 HydrophobicContact CB-CG 4.04Å; N363-Q370 PolarHBondContact ND2-NE2 2.7Å
371	L	84.6	Confident	85.6	Confident	39 Å²	39	95.7 Å²	95.7	20%	0.204	49%	0.494	C	S	.	.			trans	-113.6	136.9	169.3	-76.8	165.9	0	0	0	108	T358 P360 F373	T358-L371 HydrophobicContact CG2-CD2 3.69Å; P360-L371 HydrophobicContact CB-CG 4.13Å; L371-F373 HydrophobicContact CB-CD2 4.27Å; L371-F373 HydrophobicContact CB-CE2 3.62Å; L371-F373 HydrophobicContact CB-CZ 4.03Å; L371-F373 HydrophobicContact CD1-CZ 4.32Å; L371-F373 VanDerWaalsContact O-CD2 3.23Å; L371-F373 WeakPolarHBondContact O-CD2 3.41Å
372	D	87.7	Confident	85.5	Confident	132 Å²	132	94.6 Å²	94.6	71%	0.706	50%	0.504	S	S	*	.			trans	-83.5	116	175.2	-179	15.7	0	0	0	110.4	G374 Q386	D372-G374 PolarHBondContact OD1-N 3.23Å; D372-Q386 PolarHBondContact O-NE2 2.83Å
373	F	90.6	Very high	85.8	Confident	23 Å²	23	90.9 Å²	90.9	10%	0.101	49%	0.492	C	S	.	.			trans	-101	13.9	177.2	-67.5	-89.1	0	0	0	112.7	L371 G375 R376 V377 N384 Q386 Q396	L371-F373 HydrophobicContact CB-CD2 4.27Å; L371-F373 HydrophobicContact CB-CE2 3.62Å; L371-F373 HydrophobicContact CB-CZ 4.03Å; L371-F373 HydrophobicContact CD1-CZ 4.32Å; L371-F373 VanDerWaalsContact O-CD2 3.23Å; L371-F373 WeakPolarHBondContact O-CD2 3.41Å; F373-G375 PolarHBondContact O-N 2.79Å; F373-G375 VanDerWaalsContact O-N 3.12Å; F373-R376 WeakPolarHBondContact O-CB 3.14Å; F373-R376 PolarHBondContact O-N 3.22Å; F373-V377 HydrophobicContact CB-CB 3.59Å; F373-V377 HydrophobicContact CB-CG2 3.67Å; F373-V377 HydrophobicContact CD1-CB 4.04Å; F373-V377 HydrophobicContact CD1-CG2 3.35Å; F373-V377 HydrophobicContact CD2-CB 3.94Å; F373-V377 HydrophobicContact CD2-CG1 4.3Å; F373-V377 HydrophobicContact CD2-CG2 4.16Å; F373-V377 HydrophobicContact CE1-CG2 3.97Å; F373-V377 HydrophobicContact CG-CB 3.6Å; F373-V377 HydrophobicContact CG-CG1 4.38Å; F373-V377 HydrophobicContact CG-CG2 3.47Å; F373-V377 VanDerWaalsContact CG-CG2 3.47Å; F373-N384 HydrophobicContact CE2-CB 4.19Å; F373-N384 HydrophobicContact CZ-CB 3.78Å; F373-Q386 HydrophobicContact CD1-CG 4.05Å; F373-Q386 VanDerWaalsContact CD1-NE2 3.29Å; F373-Q386 HydrophobicContact CE1-CG 3.51Å; F373-Q386 HydrophobicContact CZ-CG 4.03Å; F373-Q396 HydrophobicContact CD1-CB 4.15Å; F373-Q396 HydrophobicContact CE1-CB 4.35Å
374	G	87	Confident	86.3	Confident	66 Å²	66	90.9 Å²	90.9	68%	0.68	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	32	176.9	0	0	0	0	0	113.5	D372 R376	D372-G374 PolarHBondContact OD1-N 3.23Å; G374-R376 PolarHBondContact O-N 3.15Å
375	G	89	Confident	86.5	Confident	63 Å²	63	81.5 Å²	81.5	65%	0.649	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	0.2	-175	0	0	0	0	0	115.9	F373	F373-G375 PolarHBondContact O-N 2.79Å; F373-G375 VanDerWaalsContact O-N 3.12Å
376	R	91.3	Very high	86.8	Confident	74 Å²	74	73.5 Å²	73.5	28%	0.279	42%	0.419	S	S	.	.	S	Bend	trans	-73.3	-27.7	176	-73.6	-58.5	-67	155.9	-15	113.9	E122 F373 G374 I400 V406 D408	E122-R376 IonicContact OE1-NH2 2.77Å; E122-R376 PolarHBondContact OE1-NH2 3.02Å; E122-R376 IonicContact OE2-CZ 3.56Å; E122-R376 IonicContact OE2-NH1 3.87Å; E122-R376 IonicContact OE2-NH2 3.66Å; E122-R376 PolarHBondContact OE2-NH2 3.01Å; F373-R376 WeakPolarHBondContact O-CB 3.14Å; F373-R376 PolarHBondContact O-N 3.22Å; G374-R376 PolarHBondContact O-N 3.15Å; R376-I400 WeakPolarHBondContact O-CG2 3.29Å; R376-V406 HydrophobicContact CB-CG2 4.42Å; R376-D408 IonicContact NE-OD2 3.04Å
377	V	91.7	Very high	87.5	Confident	23 Å²	23	68.3 Å²	68.3	14%	0.139	39%	0.392	C	S	.	.			trans	-106.5	119	174.8	176	0	0	0	0	108.2	F373 L379 N384 R399 V406	F373-V377 HydrophobicContact CB-CB 3.59Å; F373-V377 HydrophobicContact CB-CG2 3.67Å; F373-V377 HydrophobicContact CD1-CB 4.04Å; F373-V377 HydrophobicContact CD1-CG2 3.35Å; F373-V377 HydrophobicContact CD2-CB 3.94Å; F373-V377 HydrophobicContact CD2-CG1 4.3Å; F373-V377 HydrophobicContact CD2-CG2 4.16Å; F373-V377 HydrophobicContact CE1-CG2 3.97Å; F373-V377 HydrophobicContact CG-CB 3.6Å; F373-V377 HydrophobicContact CG-CG1 4.38Å; F373-V377 HydrophobicContact CG-CG2 3.47Å; F373-V377 VanDerWaalsContact CG-CG2 3.47Å; V377-L379 WeakPolarHBondContact CG1-O 3.33Å; V377-N384 VanDerWaalsContact CG1-ND2 3.31Å; V377-N384 WeakPolarHBondContact CG1-ND2 3.45Å; V377-R399 WeakPolarHBondContact CG1-O 3.17Å; V377-V406 HydrophobicContact CG2-CG2 3.71Å
378	T	90.3	Very high	87.9	Confident	95 Å²	95	63.7 Å²	63.7	58%	0.583	37%	0.372	S	S	*	.			trans	-107.4	-12.3	-174.9	52.9	0	0	0	0	112.9	R399 I400	T378-R399 PolarHBondContact N-O 3.44Å; T378-I400 VanDerWaalsContact OG1-CA 3.24Å; T378-I400 WeakPolarHBondContact OG1-CA 3.4Å; T378-I400 PolarHBondContact OG1-O 3.12Å
379	L	91	Very high	88.7	Confident	70 Å²	70	63.2 Å²	63.2	37%	0.366	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-122.8	136.6	179	-64.8	179.3	0	0	0	111.8	V377 N384 R399	V377-L379 WeakPolarHBondContact CG1-O 3.33Å; L379-N384 PolarHBondContact O-ND2 3.16Å; L379-R399 HydrophobicContact CB-CB 4.09Å; L379-R399 HydrophobicContact CB-CG 4.08Å; L379-R399 HydrophobicContact CD1-CG 4.15Å; L379-R399 PolarHBondContact N-O 2.89Å
380	Q	84	Confident	89.3	Confident	182 Å²	182	64.4 Å²	64.4	85%	0.85	37%	0.374	S	S	*	.			trans	-67.4	139.9	171.8	-64.1	-177	6.9	0	0	110.8
381	S	86.2	Confident	89.7	Confident	35 Å²	35	68 Å²	68	25%	0.245	40%	0.396	C	S	.	.			trans	-164.1	140.8	176.9	175.1	0	0	0	0	109.9	K383 N384	S381-K383 PolarHBondContact O-N 2.79Å; S381-K383 WeakPolarHBondContact OG-CB 3.17Å; S381-K383 PolarHBondContact OG-N 3.44Å; S381-K383 VanDerWaalsContact OG-N 3.14Å; S381-N384 WeakPolarHBondContact CB-OD1 3.1Å; S381-N384 PolarHBondContact N-ND2 3.5Å; S381-N384 WeakPolarHBondContact O-CB 3.46Å; S381-N384 PolarHBondContact O-N 3.28Å
382	A	82.2	Confident	90.1	Very high	112 Å²	112	71.7 Å²	71.7	93%	0.926	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-9.2	171.3	0	0	0	0	0	113.4
383	K	88	Confident	90.4	Very high	49 Å²	49	67.6 Å²	67.6	21%	0.213	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-6.9	175.9	-58.7	178.2	-178.8	173.6	0	113.4	S381 F385 F397 Y405 S425 F426	S381-K383 PolarHBondContact O-N 2.79Å; S381-K383 WeakPolarHBondContact OG-CB 3.17Å; S381-K383 PolarHBondContact OG-N 3.44Å; S381-K383 VanDerWaalsContact OG-N 3.14Å; K383-F385 VanDerWaalsContact O-CD1 3.25Å; K383-F385 WeakPolarHBondContact O-CD1 3.49Å; K383-F397 HydrophobicContact CB-CE1 4.24Å; K383-F397 VanDerWaalsContact O-CD1 3.22Å; K383-F397 WeakPolarHBondContact O-CD1 3.41Å; K383-F397 WeakPolarHBondContact O-CE1 3.26Å; K383-Y405 HydrophobicContact CB-CE1 4.33Å; K383-Y405 HydrophobicContact CD-CE1 4.33Å; K383-S425 WeakPolarHBondContact CD-O 3.25Å; K383-S425 VanDerWaalsContact CE-O 3.26Å; K383-S425 WeakPolarHBondContact CE-O 3.41Å; K383-F426 HydrophobicContact CD-CD1 4.2Å; K383-F426 HydrophobicContact CD-CE1 4.11Å
384	N	91.6	Very high	90.6	Very high	29 Å²	29	66.7 Å²	66.7	16%	0.155	38%	0.383	C	S	.	.			trans	-74.4	130	179.2	-62.5	-11.1	0	0	0	109.1	F373 V377 L379 S381 F397 G398 R399	F373-N384 HydrophobicContact CE2-CB 4.19Å; F373-N384 HydrophobicContact CZ-CB 3.78Å; V377-N384 VanDerWaalsContact CG1-ND2 3.31Å; V377-N384 WeakPolarHBondContact CG1-ND2 3.45Å; L379-N384 PolarHBondContact O-ND2 3.16Å; S381-N384 WeakPolarHBondContact CB-OD1 3.1Å; S381-N384 PolarHBondContact N-ND2 3.5Å; S381-N384 WeakPolarHBondContact O-CB 3.46Å; S381-N384 PolarHBondContact O-N 3.28Å; N384-F397 CarbonylContact C-O 3.59Å; N384-F397 VanDerWaalsContact CA-O 3.31Å; N384-F397 WeakPolarHBondContact CA-O 3.19Å; N384-G398 WeakPolarHBondContact OD1-CA 2.96Å; N384-R399 PolarHBondContact OD1-N 2.8Å
385	F	93.9	Very high	91.2	Very high	19 Å²	19	63.5 Å²	63.5	8%	0.083	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	161.3	176.9	65.8	-91.6	0	0	0	111.6	L235 K383 I387 L395 F397 L421	L235-F385 HydrophobicContact CD2-CD2 4.1Å; L235-F385 HydrophobicContact CD2-CE2 4.17Å; K383-F385 VanDerWaalsContact O-CD1 3.25Å; K383-F385 WeakPolarHBondContact O-CD1 3.49Å; F385-I387 HydrophobicContact CD2-CD1 3.9Å; F385-I387 HydrophobicContact CD2-CG1 4.05Å; F385-I387 HydrophobicContact CE2-CD1 4.07Å; F385-I387 HydrophobicContact CE2-CG1 4.01Å; F385-L395 HydrophobicContact CD2-CD2 4.22Å; F385-L395 HydrophobicContact CE2-CD2 3.56Å; F385-L395 HydrophobicContact CZ-CD2 4.26Å; F385-F397 HydrophobicContact CD1-CB 4.26Å; F385-F397 AromaticContact CD1-CD1 3.79Å; F385-F397 HydrophobicContact CD1-CD1 3.79Å; F385-F397 HydrophobicContact CD1-CG 4.48Å; F385-F397 HydrophobicContact CE1-CB 3.83Å; F385-F397 AromaticContact CE1-CD1 3.34Å; F385-F397 HydrophobicContact CE1-CD1 3.34Å; F385-F397 HydrophobicContact CE1-CE1 4.16Å; F385-F397 AromaticContact CE1-CG 3.86Å; F385-F397 HydrophobicContact CE1-CG 3.86Å; F385-F397 HydrophobicContact CE2-CB 4.25Å; F385-F397 HydrophobicContact CZ-CB 3.82Å; F385-F397 HydrophobicContact CZ-CD1 4.1Å; F385-F397 HydrophobicContact CZ-CG 4.17Å; F385-F397 PolarHBondContact N-O 2.73Å; F385-F397 PolarHBondContact O-N 3.44Å; F385-L421 HydrophobicContact CE2-CD2 4.1Å; F385-L421 HydrophobicContact CE2-CG 4.21Å; F385-L421 HydrophobicContact CZ-CG 4.17Å
386	Q	95.4	Very high	91.5	Very high	11 Å²	11	61 Å²	61	5%	0.051	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.5	171.7	-63.2	-178.4	-5.1	0	0	108.6	N357 T358 D372 F373 Q393 L395 Q396	N357-Q386 CarbonylContact C-O 3.52Å; N357-Q386 WeakPolarHBondContact CA-O 3.37Å; N357-Q386 WeakPolarHBondContact CB-O 3.31Å; T358-Q386 PolarHBondContact N-O 2.86Å; D372-Q386 PolarHBondContact O-NE2 2.83Å; F373-Q386 HydrophobicContact CD1-CG 4.05Å; F373-Q386 VanDerWaalsContact CD1-NE2 3.29Å; F373-Q386 HydrophobicContact CE1-CG 3.51Å; F373-Q386 HydrophobicContact CZ-CG 4.03Å; Q386-Q393 HydrophobicContact CB-CG 4.24Å; Q386-Q393 VanDerWaalsContact NE2-NE2 3.1Å; Q386-L395 CarbonylContact C-O 3.52Å; Q386-L395 VanDerWaalsContact CA-O 3.26Å; Q386-L395 WeakPolarHBondContact CA-O 2.96Å; Q386-Q396 HydrophobicContact CG-CB 4.01Å
387	I	96.6	Very high	91.8	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.4	174.3	-55.3	-63.8	0	0	0	108.4	L235 V237 L355 N357 F385 V394 L395 F413 L421	L235-I387 HydrophobicContact CD2-CD1 3.79Å; L235-I387 HydrophobicContact CG-CD1 4.34Å; V237-I387 HydrophobicContact CG2-CD1 4.31Å; L355-I387 HydrophobicContact CB-CG2 3.57Å; L355-I387 HydrophobicContact CD2-CG2 3.74Å; L355-I387 HydrophobicContact CG-CG2 4.32Å; N357-I387 HydrophobicContact CB-CD1 4.11Å; F385-I387 HydrophobicContact CD2-CD1 3.9Å; F385-I387 HydrophobicContact CD2-CG1 4.05Å; F385-I387 HydrophobicContact CE2-CD1 4.07Å; F385-I387 HydrophobicContact CE2-CG1 4.01Å; I387-V394 HydrophobicContact CB-CG2 4.4Å; I387-V394 HydrophobicContact CG2-CG2 4.1Å; I387-V394 WeakPolarHBondContact O-CG2 3.5Å; I387-V394 PolarHBondContact O-N 3.34Å; I387-L395 HydrophobicContact CB-CB 4.11Å; I387-L395 HydrophobicContact CG1-CB 4.27Å; I387-L395 HydrophobicContact CG1-CD2 4Å; I387-L395 PolarHBondContact N-O 2.75Å; I387-L395 PolarHBondContact O-N 2.83Å; I387-F413 HydrophobicContact CG2-CE2 4.21Å; I387-F413 HydrophobicContact CG2-CZ 4.27Å; I387-L421 HydrophobicContact CD1-CD2 4.31Å; I387-L421 HydrophobicContact CG1-CD2 3.95Å
388	N	93.6	Very high	92	Very high	52 Å²	52	56.4 Å²	56.4	28%	0.278	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.8	173.6	-73	-5.4	0	0	0	110.8	N356 T358 K392 Q393	N356-N388 PolarHBondContact O-N 3.14Å; N356-N388 VanDerWaalsContact O-N 3.08Å; T358-N388 PolarHBondContact OG1-ND2 2.68Å; T358-N388 PolarHBondContact OG1-OD1 2.81Å; N388-K392 CarbonylContact C-O 3.56Å; N388-K392 VanDerWaalsContact CA-O 3.27Å; N388-K392 WeakPolarHBondContact CA-O 3.48Å; N388-Q393 WeakPolarHBondContact OD1-CA 3.29Å
389	Y	92.5	Very high	92.3	Very high	65 Å²	65	55.8 Å²	55.8	26%	0.255	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	127.8	170.4	178.1	-114.2	0	0	0	108.4	L353 L355 D391 K392 P412	L353-Y389 HydrophobicContact CB-CE2 4.38Å; L353-Y389 HydrophobicContact CD1-CE1 4.47Å; L353-Y389 HydrophobicContact CD2-CE2 4.48Å; L353-Y389 WeakPolarHBondContact CD2-OH 3.35Å; L355-Y389 HydrophobicContact CD2-CD2 4.38Å; L355-Y389 HydrophobicContact CD2-CG 4.16Å; L355-Y389 HydrophobicContact CG-CD2 3.97Å; L355-Y389 HydrophobicContact CG-CG 4.25Å; Y389-D391 VanDerWaalsContact C-N 3.35Å; Y389-D391 PolarHBondContact O-N 2.79Å; Y389-K392 PolarHBondContact N-O 3.43Å; Y389-K392 WeakPolarHBondContact O-CB 3.2Å; Y389-K392 PolarHBondContact O-N 3.28Å; Y389-K392 VanDerWaalsContact O-N 3.07Å; Y389-P412 HydrophobicContact CD1-CG 4.2Å; Y389-P412 HydrophobicContact CE1-CG 4.47Å
390	N	89.4	Confident	92.4	Very high	121 Å²	121	54.4 Å²	54.4	65%	0.647	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	53	-175.2	-61.4	-15.6	0	0	0	112.8	K392	N390-K392 PolarHBondContact O-N 2.84Å
391	D	87.8	Confident	92.6	Very high	169 Å²	169	49.4 Å²	49.4	90%	0.904	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	11.2	-179.2	-57.4	-47.6	0	0	0	116	Y389	Y389-D391 VanDerWaalsContact C-N 3.35Å; Y389-D391 PolarHBondContact O-N 2.79Å
392	K	91.8	Very high	92.6	Very high	115 Å²	115	49.8 Å²	49.8	50%	0.5	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	133.5	176.1	-165.1	-176.6	-172.6	-154.8	0	110.3	N388 Y389 N390 V394 E410	N388-K392 CarbonylContact C-O 3.56Å; N388-K392 VanDerWaalsContact CA-O 3.27Å; N388-K392 WeakPolarHBondContact CA-O 3.48Å; Y389-K392 PolarHBondContact N-O 3.43Å; Y389-K392 WeakPolarHBondContact O-CB 3.2Å; Y389-K392 PolarHBondContact O-N 3.28Å; Y389-K392 VanDerWaalsContact O-N 3.07Å; N390-K392 PolarHBondContact O-N 2.84Å; K392-V394 PolarHBondContact O-N 3Å; K392-V394 VanDerWaalsContact O-N 3.12Å; K392-E410 WeakPolarHBondContact CD-OE1 3.43Å; K392-E410 WeakPolarHBondContact CE-OE1 3.4Å; K392-E410 IonicContact NZ-OE1 2.74Å; K392-E410 PolarHBondContact NZ-OE1 3.35Å; K392-E410 IonicContact NZ-OE2 2.99Å; K392-E410 PolarHBondContact NZ-OE2 2.85Å
393	Q	94	Very high	93	Very high	47 Å²	47	47.2 Å²	47.2	22%	0.22	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	106.6	169.1	-176.7	-150.5	84.5	0	0	109.2	R100 Q386 N388	R100-Q393 PolarHBondContact NH2-O 3.18Å; Q386-Q393 HydrophobicContact CB-CG 4.24Å; Q386-Q393 VanDerWaalsContact NE2-NE2 3.1Å; N388-Q393 WeakPolarHBondContact OD1-CA 3.29Å
394	V	96.5	Very high	93.3	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-19.8	-177	-68.9	0	0	0	0	113.1	R100 L355 I387 K392 F409 E410 A411 F413	R100-V394 VanDerWaalsContact NH2-C 3.28Å; R100-V394 PolarHBondContact NH2-O 3.13Å; L355-V394 HydrophobicContact CD2-CG2 3.84Å; I387-V394 HydrophobicContact CB-CG2 4.4Å; I387-V394 HydrophobicContact CG2-CG2 4.1Å; I387-V394 WeakPolarHBondContact O-CG2 3.5Å; I387-V394 PolarHBondContact O-N 3.34Å; K392-V394 PolarHBondContact O-N 3Å; K392-V394 VanDerWaalsContact O-N 3.12Å; V394-F409 CarbonylContact O-C 3.59Å; V394-F409 WeakPolarHBondContact O-CA 3.41Å; V394-E410 HydrophobicContact CB-CG 4.19Å; V394-E410 HydrophobicContact CG1-CG 4.33Å; V394-E410 WeakPolarHBondContact O-CG 3.44Å; V394-E410 PolarHBondContact O-N 2.81Å; V394-A411 WeakPolarHBondContact CG1-O 3.27Å; V394-F413 HydrophobicContact CG2-CD2 4.27Å; V394-F413 HydrophobicContact CG2-CE2 3.85Å
395	L	98.3	Very high	93.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	142.2	175.3	-179.4	153.7	0	0	0	111	F385 Q386 I387 F397 L407 D408 F409 F413 A418 L421	F385-L395 HydrophobicContact CD2-CD2 4.22Å; F385-L395 HydrophobicContact CE2-CD2 3.56Å; F385-L395 HydrophobicContact CZ-CD2 4.26Å; Q386-L395 CarbonylContact C-O 3.52Å; Q386-L395 VanDerWaalsContact CA-O 3.26Å; Q386-L395 WeakPolarHBondContact CA-O 2.96Å; I387-L395 HydrophobicContact CB-CB 4.11Å; I387-L395 HydrophobicContact CG1-CB 4.27Å; I387-L395 HydrophobicContact CG1-CD2 4Å; I387-L395 PolarHBondContact N-O 2.75Å; I387-L395 PolarHBondContact O-N 2.83Å; L395-F397 HydrophobicContact CD2-CB 4.27Å; L395-L407 HydrophobicContact CD1-CD1 4.04Å; L395-L407 HydrophobicContact CD2-CD1 4.21Å; L395-L407 HydrophobicContact CG-CD1 4.1Å; L395-D408 CarbonylContact C-O 3.51Å; L395-D408 VanDerWaalsContact CA-O 3.31Å; L395-D408 WeakPolarHBondContact CA-O 3.3Å; L395-F409 HydrophobicContact CB-CB 4.02Å; L395-F409 HydrophobicContact CD1-CB 3.94Å; L395-F409 HydrophobicContact CG-CB 3.97Å; L395-F413 HydrophobicContact CB-CD2 4.16Å; L395-F413 HydrophobicContact CB-CE2 3.97Å; L395-F413 HydrophobicContact CD1-CD1 4.39Å; L395-F413 HydrophobicContact CD1-CD2 4.16Å; L395-F413 HydrophobicContact CD1-CE1 4.38Å; L395-F413 HydrophobicContact CD1-CE2 4.14Å; L395-F413 HydrophobicContact CD1-CG 4.29Å; L395-F413 HydrophobicContact CD1-CZ 4.25Å; L395-A418 HydrophobicContact CD1-CB 3.81Å; L395-L421 HydrophobicContact CD1-CD2 4.05Å; L395-L421 HydrophobicContact CD2-CD2 4.45Å
396	Q	96.4	Very high	93.7	Very high	11 Å²	11	44.6 Å²	44.6	5%	0.051	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139	166.3	62.7	173.6	6.8	0	0	110.6	F373 Q386 D408	F373-Q396 HydrophobicContact CD1-CB 4.15Å; F373-Q396 HydrophobicContact CE1-CB 4.35Å; Q386-Q396 HydrophobicContact CG-CB 4.01Å; Q396-D408 HydrophobicContact CG-CB 3.73Å; Q396-D408 PolarHBondContact N-O 3.48Å; Q396-D408 PolarHBondContact NE2-OD2 3.48Å; Q396-D408 PolarHBondContact O-N 3.2Å
397	F	97.6	Very high	93.9	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	133.1	176.8	173.2	-99.5	0	0	0	109.2	M105 K383 N384 F385 L395 Y405 V406 L407 A422 S425 F426	M105-F397 HydrophobicContact CE-CE2 4.36Å; M105-F397 HydrophobicContact SD-CD2 4.18Å; M105-F397 HydrophobicContact SD-CE2 3.7Å; K383-F397 HydrophobicContact CB-CE1 4.24Å; K383-F397 VanDerWaalsContact O-CD1 3.22Å; K383-F397 WeakPolarHBondContact O-CD1 3.41Å; K383-F397 WeakPolarHBondContact O-CE1 3.26Å; N384-F397 CarbonylContact C-O 3.59Å; N384-F397 VanDerWaalsContact CA-O 3.31Å; N384-F397 WeakPolarHBondContact CA-O 3.19Å; F385-F397 HydrophobicContact CD1-CB 4.26Å; F385-F397 AromaticContact CD1-CD1 3.79Å; F385-F397 HydrophobicContact CD1-CD1 3.79Å; F385-F397 HydrophobicContact CD1-CG 4.48Å; F385-F397 HydrophobicContact CE1-CB 3.83Å; F385-F397 AromaticContact CE1-CD1 3.34Å; F385-F397 HydrophobicContact CE1-CD1 3.34Å; F385-F397 HydrophobicContact CE1-CE1 4.16Å; F385-F397 AromaticContact CE1-CG 3.86Å; F385-F397 HydrophobicContact CE1-CG 3.86Å; F385-F397 HydrophobicContact CE2-CB 4.25Å; F385-F397 HydrophobicContact CZ-CB 3.82Å; F385-F397 HydrophobicContact CZ-CD1 4.1Å; F385-F397 HydrophobicContact CZ-CG 4.17Å; F385-F397 PolarHBondContact N-O 2.73Å; F385-F397 PolarHBondContact O-N 3.44Å; L395-F397 HydrophobicContact CD2-CB 4.27Å; F397-Y405 AromaticContact CE1-CD1 3.71Å; F397-Y405 HydrophobicContact CE1-CD1 3.71Å; F397-Y405 HydrophobicContact CE1-CE1 4.22Å; F397-Y405 HydrophobicContact CE1-CG 4.39Å; F397-Y405 AromaticContact CE2-CD1 3.96Å; F397-Y405 HydrophobicContact CE2-CD1 3.96Å; F397-Y405 AromaticContact CE2-CG 3.85Å; F397-Y405 HydrophobicContact CE2-CG 3.85Å; F397-Y405 AromaticContact CZ-CD1 3.33Å; F397-Y405 HydrophobicContact CZ-CD1 3.33Å; F397-Y405 HydrophobicContact CZ-CD2 4.43Å; F397-Y405 HydrophobicContact CZ-CE1 4.07Å; F397-Y405 AromaticContact CZ-CG 3.57Å; F397-Y405 HydrophobicContact CZ-CG 3.57Å; F397-V406 WeakPolarHBondContact CA-O 3.32Å; F397-V406 WeakPolarHBondContact CD2-O 3.37Å; F397-L407 HydrophobicContact CB-CD1 4.24Å; F397-L407 HydrophobicContact CD2-CB 4.26Å; F397-L407 HydrophobicContact CD2-CD1 4.21Å; F397-A422 HydrophobicContact CD2-CB 3.74Å; F397-A422 HydrophobicContact CE2-CB 3.84Å; F397-A422 HydrophobicContact CG-CB 4.28Å; F397-A422 HydrophobicContact CZ-CB 4.46Å; F397-S425 WeakPolarHBondContact CE1-OG 3.41Å; F397-F426 HydrophobicContact CE2-CE2 4.42Å; F397-F426 HydrophobicContact CE2-CZ 4.36Å; F397-F426 AromaticContact CZ-CE2 3.85Å; F397-F426 HydrophobicContact CZ-CE2 3.85Å; F397-F426 AromaticContact CZ-CZ 3.59Å; F397-F426 HydrophobicContact CZ-CZ 3.59Å
398	G	95.3	Very high	94	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	168	175.7	0	0	0	0	0	115.2	N384 Y405 V406	N384-G398 WeakPolarHBondContact OD1-CA 2.96Å; G398-Y405 CarbonylContact O-C 3.4Å; G398-Y405 WeakPolarHBondContact O-CA 3.33Å; G398-Y405 WeakPolarHBondContact O-CB 3.36Å; G398-V406 PolarHBondContact N-O 3.31Å; G398-V406 VanDerWaalsContact N-O 3.15Å; G398-V406 WeakPolarHBondContact O-CG2 3.22Å; G398-V406 PolarHBondContact O-N 2.93Å
399	R	95.6	Very high	94.2	Very high	82 Å²	82	41.6 Å²	41.6	31%	0.309	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	138.5	-170.1	-164.6	-179.8	-179	-176.5	-0.6	112.1	V377 T378 L379 N384 G402 Y405	V377-R399 WeakPolarHBondContact CG1-O 3.17Å; T378-R399 PolarHBondContact N-O 3.44Å; L379-R399 HydrophobicContact CB-CB 4.09Å; L379-R399 HydrophobicContact CB-CG 4.08Å; L379-R399 HydrophobicContact CD1-CG 4.15Å; L379-R399 PolarHBondContact N-O 2.89Å; N384-R399 PolarHBondContact OD1-N 2.8Å; R399-G402 PolarHBondContact NE-O 3.45Å; R399-G402 PolarHBondContact NH2-O 3.16Å; R399-Y405 HydrophobicContact CB-CD1 3.88Å; R399-Y405 HydrophobicContact CB-CE1 3.67Å; R399-Y405 HydrophobicContact CG-CD1 4.34Å; R399-Y405 HydrophobicContact CG-CE1 3.95Å
400	I	93.1	Very high	94.2	Very high	41 Å²	41	39.6 Å²	39.6	21%	0.21	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-43.1	177.8	50.1	165.4	0	0	0	114.6	T104 R376 T378 S404 V406	T104-I400 HydrophobicContact CG2-CD1 4.42Å; R376-I400 WeakPolarHBondContact O-CG2 3.29Å; T378-I400 VanDerWaalsContact OG1-CA 3.24Å; T378-I400 WeakPolarHBondContact OG1-CA 3.4Å; T378-I400 PolarHBondContact OG1-O 3.12Å; I400-S404 WeakPolarHBondContact CG1-O 3.26Å; I400-S404 PolarHBondContact N-O 3.34Å; I400-S404 VanDerWaalsContact N-O 3.09Å; I400-V406 HydrophobicContact CD1-CG1 4.09Å; I400-V406 HydrophobicContact CG1-CG1 4.45Å; I400-V406 HydrophobicContact CG2-CG1 3.59Å; I400-V406 HydrophobicContact CG2-CG2 4.28Å
401	S	89.1	Confident	94.4	Very high	76 Å²	76	36.2 Å²	36.2	53%	0.531	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	143.4	-177.5	179.7	0	0	0	0	109.6	S403 S404	S401-S403 PolarHBondContact O-N 2.88Å; S401-S403 VanDerWaalsContact O-N 3.08Å; S401-S404 WeakPolarHBondContact O-CA 3.41Å; S401-S404 WeakPolarHBondContact O-CB 3.29Å; S401-S404 PolarHBondContact O-N 3.02Å
402	G	86.9	Confident	94.7	Very high	44 Å²	44	29.1 Å²	29.1	45%	0.454	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-119.2	177.8	0	0	0	0	0	111.6	R399	R399-G402 PolarHBondContact NE-O 3.45Å; R399-G402 PolarHBondContact NH2-O 3.16Å
403	S	90.3	Very high	94.9	Very high	57 Å²	57	23.6 Å²	23.6	40%	0.399	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	19.2	175	-62.8	0	0	0	0	113.3	P107 W117 S401 Y405	P107-S403 VanDerWaalsContact CD-O 3.29Å; P107-S403 WeakPolarHBondContact CD-O 3.43Å; W117-S403 WeakPolarHBondContact CZ3-O 3.48Å; S401-S403 PolarHBondContact O-N 2.88Å; S401-S403 VanDerWaalsContact O-N 3.08Å; S403-Y405 WeakPolarHBondContact O-CD2 3.45Å; S403-Y405 VanDerWaalsContact O-CE2 3.3Å; S403-Y405 WeakPolarHBondContact O-CE2 3.43Å
404	S	94	Very high	95	Very high	31 Å²	31	21.4 Å²	21.4	22%	0.217	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	144	179.2	-53.4	0	0	0	0	111.9	M105 I400 S401	M105-S404 WeakPolarHBondContact O-CA 3.31Å; I400-S404 WeakPolarHBondContact CG1-O 3.26Å; I400-S404 PolarHBondContact N-O 3.34Å; I400-S404 VanDerWaalsContact N-O 3.09Å; S401-S404 WeakPolarHBondContact O-CA 3.41Å; S401-S404 WeakPolarHBondContact O-CB 3.29Å; S401-S404 PolarHBondContact O-N 3.02Å
405	Y	97.4	Very high	95	Very high	11 Å²	11	21.3 Å²	21.3	4%	0.043	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.5	-175.7	-64.9	-105.3	0	0	0	109.9	T104 M105 W117 K383 F397 G398 R399 S403 F426	T104-Y405 CarbonylContact C-O 3.58Å; T104-Y405 WeakPolarHBondContact CA-O 3.24Å; M105-Y405 PolarHBondContact N-O 3.12Å; M105-Y405 PolarHBondContact O-N 2.97Å; W117-Y405 HydrophobicContact CH2-CD2 4.43Å; W117-Y405 HydrophobicContact CH2-CE2 4.12Å; W117-Y405 HydrophobicContact CZ3-CD2 4.03Å; W117-Y405 HydrophobicContact CZ3-CE2 4.16Å; K383-Y405 HydrophobicContact CB-CE1 4.33Å; K383-Y405 HydrophobicContact CD-CE1 4.33Å; F397-Y405 AromaticContact CE1-CD1 3.71Å; F397-Y405 HydrophobicContact CE1-CD1 3.71Å; F397-Y405 HydrophobicContact CE1-CE1 4.22Å; F397-Y405 HydrophobicContact CE1-CG 4.39Å; F397-Y405 AromaticContact CE2-CD1 3.96Å; F397-Y405 HydrophobicContact CE2-CD1 3.96Å; F397-Y405 AromaticContact CE2-CG 3.85Å; F397-Y405 HydrophobicContact CE2-CG 3.85Å; F397-Y405 AromaticContact CZ-CD1 3.33Å; F397-Y405 HydrophobicContact CZ-CD1 3.33Å; F397-Y405 HydrophobicContact CZ-CD2 4.43Å; F397-Y405 HydrophobicContact CZ-CE1 4.07Å; F397-Y405 AromaticContact CZ-CG 3.57Å; F397-Y405 HydrophobicContact CZ-CG 3.57Å; G398-Y405 CarbonylContact O-C 3.4Å; G398-Y405 WeakPolarHBondContact O-CA 3.33Å; G398-Y405 WeakPolarHBondContact O-CB 3.36Å; R399-Y405 HydrophobicContact CB-CD1 3.88Å; R399-Y405 HydrophobicContact CB-CE1 3.67Å; R399-Y405 HydrophobicContact CG-CD1 4.34Å; R399-Y405 HydrophobicContact CG-CE1 3.95Å; S403-Y405 WeakPolarHBondContact O-CD2 3.45Å; S403-Y405 VanDerWaalsContact O-CE2 3.3Å; S403-Y405 WeakPolarHBondContact O-CE2 3.43Å; Y405-F426 HydrophobicContact CD1-CZ 4.38Å; Y405-F426 HydrophobicContact CD2-CE1 4Å; Y405-F426 AromaticContact CD2-CZ 3.63Å; Y405-F426 HydrophobicContact CD2-CZ 3.63Å; Y405-F426 HydrophobicContact CE1-CE1 4.28Å; Y405-F426 HydrophobicContact CE1-CZ 4.38Å; Y405-F426 AromaticContact CE2-CE1 3.52Å; Y405-F426 HydrophobicContact CE2-CE1 3.52Å; Y405-F426 AromaticContact CE2-CZ 3.67Å; Y405-F426 HydrophobicContact CE2-CZ 3.67Å; Y405-F426 HydrophobicContact CG-CZ 4.04Å; Y405-F426 AromaticContact CZ-CE1 3.68Å
406	V	97.3	Very high	94.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	145.2	164.6	-68.9	0	0	0	0	109.7	G103 R376 V377 F397 G398 I400	G103-V406 CarbonylContact O-C 3.42Å; G103-V406 VanDerWaalsContact O-CA 3.26Å; G103-V406 WeakPolarHBondContact O-CA 3.42Å; R376-V406 HydrophobicContact CB-CG2 4.42Å; V377-V406 HydrophobicContact CG2-CG2 3.71Å; F397-V406 WeakPolarHBondContact CA-O 3.32Å; F397-V406 WeakPolarHBondContact CD2-O 3.37Å; G398-V406 PolarHBondContact N-O 3.31Å; G398-V406 VanDerWaalsContact N-O 3.15Å; G398-V406 WeakPolarHBondContact O-CG2 3.22Å; G398-V406 PolarHBondContact O-N 2.93Å; I400-V406 HydrophobicContact CD1-CG1 4.09Å; I400-V406 HydrophobicContact CG1-CG1 4.45Å; I400-V406 HydrophobicContact CG2-CG1 3.59Å; I400-V406 HydrophobicContact CG2-CG2 4.28Å
407	L	98.5	Very high	95	Very high	0 Å²	0	21 Å²	21	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	96	170.4	177	60.3	0	0	0	107.5	G103 M105 L119 L395 F397 F409 A418 F419 A422	G103-L407 VanDerWaalsContact CA-O 3.28Å; G103-L407 WeakPolarHBondContact CA-O 3.39Å; G103-L407 PolarHBondContact N-O 3.45Å; G103-L407 VanDerWaalsContact N-O 3.15Å; G103-L407 PolarHBondContact O-N 3.3Å; M105-L407 HydrophobicContact CG-CB 4.16Å; M105-L407 HydrophobicContact CG-CD2 4.34Å; M105-L407 HydrophobicContact SD-CB 3.95Å; M105-L407 HydrophobicContact SD-CD2 3.66Å; M105-L407 HydrophobicContact SD-CG 4.35Å; L119-L407 HydrophobicContact CD1-CB 4.29Å; L119-L407 HydrophobicContact CD1-CD2 3.95Å; L395-L407 HydrophobicContact CD1-CD1 4.04Å; L395-L407 HydrophobicContact CD2-CD1 4.21Å; L395-L407 HydrophobicContact CG-CD1 4.1Å; F397-L407 HydrophobicContact CB-CD1 4.24Å; F397-L407 HydrophobicContact CD2-CB 4.26Å; F397-L407 HydrophobicContact CD2-CD1 4.21Å; L407-F409 HydrophobicContact CD1-CD1 4.47Å; L407-F409 HydrophobicContact CG-CD1 4.02Å; L407-F409 HydrophobicContact CG-CE1 4.35Å; L407-A418 HydrophobicContact CD1-CB 4.49Å; L407-A418 HydrophobicContact CD2-CB 4.24Å; L407-F419 HydrophobicContact CD2-CB 4.45Å; L407-F419 HydrophobicContact CD2-CD2 4.49Å; L407-A422 HydrophobicContact CD1-CB 4.04Å; L407-A422 HydrophobicContact CD2-CB 3.99Å
408	D	97.9	Very high	95	Very high	0 Å²	0	21 Å²	21	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.1	178.1	-51.9	-30.3	0	0	0	108.6	F101 Y102 G103 R376 L395 Q396	F101-D408 CarbonylContact O-C 3.47Å; F101-D408 WeakPolarHBondContact O-CA 3.47Å; F101-D408 WeakPolarHBondContact O-CB 3.37Å; Y102-D408 WeakPolarHBondContact CA-OD1 3.38Å; Y102-D408 HydrophobicContact CD1-CB 4.22Å; G103-D408 PolarHBondContact N-OD1 2.84Å; G103-D408 VanDerWaalsContact N-OD1 3.08Å; R376-D408 IonicContact NE-OD2 3.04Å; L395-D408 CarbonylContact C-O 3.51Å; L395-D408 VanDerWaalsContact CA-O 3.31Å; L395-D408 WeakPolarHBondContact CA-O 3.3Å; Q396-D408 HydrophobicContact CG-CB 3.73Å; Q396-D408 PolarHBondContact N-O 3.48Å; Q396-D408 PolarHBondContact NE2-OD2 3.48Å; Q396-D408 PolarHBondContact O-N 3.2Å
409	F	97.9	Very high	95.2	Very high	0 Å²	0	21 Å²	21	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	167.7	-176.8	60.9	-86.7	0	0	0	111.9	A97 R100 F101 V394 L395 L407 F413 P415 A418	A97-F409 HydrophobicContact CB-CD2 4.12Å; A97-F409 HydrophobicContact CB-CE2 3.9Å; R100-F409 CarbonylContact C-O 3.49Å; R100-F409 WeakPolarHBondContact CA-O 3.45Å; F101-F409 HydrophobicContact CB-CD1 4.17Å; F101-F409 HydrophobicContact CB-CD2 4.11Å; F101-F409 HydrophobicContact CB-CE1 3.86Å; F101-F409 HydrophobicContact CB-CE2 3.78Å; F101-F409 HydrophobicContact CB-CG 4.29Å; F101-F409 HydrophobicContact CB-CZ 3.61Å; F101-F409 WeakPolarHBondContact CB-O 3.26Å; F101-F409 AromaticContact CD1-CD1 3.85Å; F101-F409 HydrophobicContact CD1-CD1 3.85Å; F101-F409 AromaticContact CD1-CE1 3.11Å; F101-F409 HydrophobicContact CD1-CE1 3.11Å; F101-F409 HydrophobicContact CD1-CE2 4.44Å; F101-F409 AromaticContact CD1-CZ 3.44Å; F101-F409 HydrophobicContact CD1-CZ 3.44Å; F101-F409 VanDerWaalsContact CD1-CZ 3.44Å; F101-F409 HydrophobicContact CD2-CE1 4.36Å; F101-F409 HydrophobicContact CD2-CE2 4.49Å; F101-F409 AromaticContact CD2-CZ 3.82Å; F101-F409 HydrophobicContact CD2-CZ 3.82Å; F101-F409 AromaticContact CE1-CE1 3.67Å; F101-F409 HydrophobicContact CE1-CE1 3.67Å; F101-F409 HydrophobicContact CE1-CZ 4.02Å; F101-F409 HydrophobicContact CE2-CZ 4.35Å; F101-F409 HydrophobicContact CG-CD1 4.27Å; F101-F409 AromaticContact CG-CE1 3.53Å; F101-F409 HydrophobicContact CG-CE1 3.53Å; F101-F409 HydrophobicContact CG-CE2 4.01Å; F101-F409 AromaticContact CG-CZ 3.33Å; F101-F409 HydrophobicContact CG-CZ 3.33Å; F101-F409 HydrophobicContact CZ-CE1 4.49Å; F101-F409 HydrophobicContact CZ-CZ 4.45Å; F101-F409 PolarHBondContact N-O 3.01Å; F101-F409 PolarHBondContact O-N 3.19Å; V394-F409 CarbonylContact O-C 3.59Å; V394-F409 WeakPolarHBondContact O-CA 3.41Å; L395-F409 HydrophobicContact CB-CB 4.02Å; L395-F409 HydrophobicContact CD1-CB 3.94Å; L395-F409 HydrophobicContact CG-CB 3.97Å; L407-F409 HydrophobicContact CD1-CD1 4.47Å; L407-F409 HydrophobicContact CG-CD1 4.02Å; L407-F409 HydrophobicContact CG-CE1 4.35Å; F409-F413 HydrophobicContact CB-CB 4.42Å; F409-F413 HydrophobicContact CD2-CB 3.9Å; F409-F413 HydrophobicContact CG-CB 4.44Å; F409-P415 HydrophobicContact CE2-CB 4.32Å; F409-P415 HydrophobicContact CE2-CG 3.97Å; F409-P415 VanDerWaalsContact CZ-CA 3.42Å; F409-P415 HydrophobicContact CZ-CB 3.8Å; F409-P415 HydrophobicContact CZ-CG 3.8Å; F409-A418 HydrophobicContact CB-CB 4.13Å; F409-A418 HydrophobicContact CD1-CB 3.44Å; F409-A418 VanDerWaalsContact CD1-CB 3.44Å; F409-A418 HydrophobicContact CD2-CB 3.85Å; F409-A418 HydrophobicContact CE1-CB 3.72Å; F409-A418 HydrophobicContact CE2-CB 4.11Å; F409-A418 HydrophobicContact CG-CB 3.51Å; F409-A418 HydrophobicContact CZ-CB 4.07Å
410	E	94.3	Very high	95.3	Very high	24 Å²	24	17 Å²	17	11%	0.112	12%	0.12	C	C	.	.			trans	-144	-178.6	172.3	52	173	-169.6	0	0	109.4	R100 K392 V394 F413	R100-E410 HydrophobicContact CB-CB 4.34Å; K392-E410 WeakPolarHBondContact CD-OE1 3.43Å; K392-E410 WeakPolarHBondContact CE-OE1 3.4Å; K392-E410 IonicContact NZ-OE1 2.74Å; K392-E410 PolarHBondContact NZ-OE1 3.35Å; K392-E410 IonicContact NZ-OE2 2.99Å; K392-E410 PolarHBondContact NZ-OE2 2.85Å; V394-E410 HydrophobicContact CB-CG 4.19Å; V394-E410 HydrophobicContact CG1-CG 4.33Å; V394-E410 WeakPolarHBondContact O-CG 3.44Å; V394-E410 PolarHBondContact O-N 2.81Å; E410-F413 WeakPolarHBondContact O-CB 3.43Å; E410-F413 PolarHBondContact O-N 3.1Å
411	A	92	Very high	95.5	Very high	49 Å²	49	15.2 Å²	15.2	41%	0.405	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.4	137.9	170.2	0	0	0	0	0	111	P96 A97 V394	P96-A411 HydrophobicContact CB-CB 4.4Å; A97-A411 PolarHBondContact O-N 3.39Å; V394-A411 WeakPolarHBondContact CG1-O 3.27Å
412	P	94.4	Very high	95.9	Very high	20 Å²	20	11.6 Å²	11.6	13%	0.13	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	cis	-87.2	4.4	15	34.5	-36.5	0	0	0	115.6	L239 L353 L355 Y389	L239-P412 HydrophobicContact CD2-CB 3.95Å; L239-P412 HydrophobicContact CD2-CG 3.78Å; L353-P412 HydrophobicContact CD1-CB 3.49Å; L353-P412 VanDerWaalsContact CD1-CB 3.49Å; L353-P412 HydrophobicContact CD1-CG 3.71Å; L355-P412 HydrophobicContact CD2-CG 4.12Å; Y389-P412 HydrophobicContact CD1-CG 4.2Å; Y389-P412 HydrophobicContact CE1-CG 4.47Å
413	F	96.8	Very high	96.3	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.064	C	C	.	.			trans	-76.3	134.7	-176.9	-71.8	-80	0	0	0	113.2	P96 A97 V237 L239 L355 I387 V394 L395 F409 E410 Q417 A418 L421	P96-F413 WeakPolarHBondContact CA-O 3.41Å; A97-F413 PolarHBondContact N-O 3.33Å; V237-F413 HydrophobicContact CG1-CE1 4.41Å; L239-F413 HydrophobicContact CD1-CD1 3.89Å; L239-F413 HydrophobicContact CD1-CE1 3.78Å; L239-F413 HydrophobicContact CD2-CD1 3.96Å; L239-F413 HydrophobicContact CD2-CE1 4.08Å; L239-F413 HydrophobicContact CD2-CG 4.31Å; L355-F413 HydrophobicContact CD2-CE2 3.67Å; L355-F413 HydrophobicContact CD2-CZ 3.88Å; I387-F413 HydrophobicContact CG2-CE2 4.21Å; I387-F413 HydrophobicContact CG2-CZ 4.27Å; V394-F413 HydrophobicContact CG2-CD2 4.27Å; V394-F413 HydrophobicContact CG2-CE2 3.85Å; L395-F413 HydrophobicContact CB-CD2 4.16Å; L395-F413 HydrophobicContact CB-CE2 3.97Å; L395-F413 HydrophobicContact CD1-CD1 4.39Å; L395-F413 HydrophobicContact CD1-CD2 4.16Å; L395-F413 HydrophobicContact CD1-CE1 4.38Å; L395-F413 HydrophobicContact CD1-CE2 4.14Å; L395-F413 HydrophobicContact CD1-CG 4.29Å; L395-F413 HydrophobicContact CD1-CZ 4.25Å; F409-F413 HydrophobicContact CB-CB 4.42Å; F409-F413 HydrophobicContact CD2-CB 3.9Å; F409-F413 HydrophobicContact CG-CB 4.44Å; E410-F413 WeakPolarHBondContact O-CB 3.43Å; E410-F413 PolarHBondContact O-N 3.1Å; F413-Q417 HydrophobicContact CD1-CB 4.05Å; F413-A418 HydrophobicContact CB-CB 4.2Å; F413-A418 HydrophobicContact CD1-CB 4.47Å; F413-A418 HydrophobicContact CG-CB 4.5Å; F413-L421 HydrophobicContact CE1-CD2 3.99Å; F413-L421 HydrophobicContact CZ-CD2 3.96Å
414	S	95.5	Very high	96.5	Very high	0 Å²	0	7 Å²	7	0%	0	5%	0.046	C	C	.	.			trans	-81.3	157.9	156.2	73.9	0	0	0	0	111.6	C94 R95 V416 Q417 A418	C94-S414 VanDerWaalsContact O-CB 3.31Å; C94-S414 WeakPolarHBondContact O-CB 3.28Å; R95-S414 VanDerWaalsContact O-CA 3.26Å; R95-S414 WeakPolarHBondContact O-CA 3.44Å; R95-S414 WeakPolarHBondContact O-CB 3.46Å; S414-V416 PolarHBondContact O-N 2.77Å; S414-Q417 PolarHBondContact O-N 3.09Å; S414-Q417 VanDerWaalsContact O-N 3.09Å; S414-Q417 WeakPolarHBondContact OG-CG 3.23Å; S414-Q417 PolarHBondContact OG-N 3.18Å; S414-Q417 PolarHBondContact OG-OE1 3.46Å; S414-A418 PolarHBondContact O-N 3.48Å
415	P	96.2	Very high	96.3	Very high	2 Å²	2	6.2 Å²	6.2	1%	0.013	4%	0.041	C	C	.	.	H	α-helix	trans	-53.6	-38.4	174	-28.8	35.1	0	0	0	114.4	F92 V93 R95 L131 F409 F419	F92-P415 HydrophobicContact CE1-CG 4.25Å; V93-P415 HydrophobicContact CB-CB 4.15Å; V93-P415 HydrophobicContact CG1-CB 4.39Å; V93-P415 VanDerWaalsContact O-CD 3.31Å; V93-P415 WeakPolarHBondContact O-CD 3.41Å; R95-P415 WeakPolarHBondContact O-CD 3.19Å; L131-P415 HydrophobicContact CD1-CB 4.45Å; F409-P415 HydrophobicContact CE2-CB 4.32Å; F409-P415 HydrophobicContact CE2-CG 3.97Å; F409-P415 VanDerWaalsContact CZ-CA 3.42Å; F409-P415 HydrophobicContact CZ-CB 3.8Å; F409-P415 HydrophobicContact CZ-CG 3.8Å; P415-F419 WeakPolarHBondContact O-CB 3.3Å; P415-F419 PolarHBondContact O-N 2.88Å
416	V	97	Very high	95.9	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-64.7	-44.9	176	171.5	0	0	0	0	111.5	V93 L131 V192 A193 L218 S414 A420	V93-V416 HydrophobicContact CB-CG2 3.95Å; V93-V416 HydrophobicContact CG2-CG2 3.86Å; V93-V416 VanDerWaalsContact O-CG2 3.22Å; V93-V416 WeakPolarHBondContact O-CG2 3.18Å; V93-V416 PolarHBondContact O-N 2.81Å; L131-V416 HydrophobicContact CD1-CB 4.45Å; L131-V416 HydrophobicContact CD1-CG2 3.86Å; L131-V416 HydrophobicContact CD2-CG2 4.16Å; V192-V416 HydrophobicContact CB-CG2 4.41Å; V192-V416 HydrophobicContact CG1-CB 4.46Å; V192-V416 HydrophobicContact CG1-CG1 4.19Å; V192-V416 HydrophobicContact CG1-CG2 3.45Å; V192-V416 VanDerWaalsContact CG1-CG2 3.45Å; A193-V416 HydrophobicContact CB-CG1 3.59Å; L218-V416 HydrophobicContact CD1-CG1 3.89Å; S414-V416 PolarHBondContact O-N 2.77Å; V416-A420 VanDerWaalsContact O-CB 3.31Å; V416-A420 WeakPolarHBondContact O-CB 3.5Å; V416-A420 PolarHBondContact O-N 3.4Å
417	Q	97.5	Very high	95.2	Very high	3 Å²	3	7 Å²	7	1%	0.014	5%	0.045	C	C	.	.	H	α-helix	trans	-66.1	-46.1	179.9	-73.9	169.2	-35	0	0	111.9	L218 L239 V240 F413 S414 F419 A420 L421	L218-Q417 HydrophobicContact CB-CG 4.15Å; L218-Q417 PolarHBondContact O-NE2 3.3Å; L218-Q417 VanDerWaalsContact O-NE2 3.1Å; L239-Q417 HydrophobicContact CD1-CB 3.87Å; L239-Q417 VanDerWaalsContact CD1-CD 3.43Å; L239-Q417 HydrophobicContact CD1-CG 3.86Å; V240-Q417 PolarHBondContact O-NE2 3.32Å; F413-Q417 HydrophobicContact CD1-CB 4.05Å; S414-Q417 PolarHBondContact O-N 3.09Å; S414-Q417 VanDerWaalsContact O-N 3.09Å; S414-Q417 WeakPolarHBondContact OG-CG 3.23Å; S414-Q417 PolarHBondContact OG-N 3.18Å; S414-Q417 PolarHBondContact OG-OE1 3.46Å; Q417-F419 VanDerWaalsContact C-N 3.34Å; Q417-F419 PolarHBondContact O-N 3.2Å; Q417-A420 PolarHBondContact O-N 3.22Å; Q417-L421 WeakPolarHBondContact O-CB 3.3Å; Q417-L421 PolarHBondContact O-N 3.2Å
418	A	98.6	Very high	93.8	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.4	-43.2	177.7	0	0	0	0	0	111.6	L395 L407 F409 F413 S414 L421 A422	L395-A418 HydrophobicContact CD1-CB 3.81Å; L407-A418 HydrophobicContact CD1-CB 4.49Å; L407-A418 HydrophobicContact CD2-CB 4.24Å; F409-A418 HydrophobicContact CB-CB 4.13Å; F409-A418 HydrophobicContact CD1-CB 3.44Å; F409-A418 VanDerWaalsContact CD1-CB 3.44Å; F409-A418 HydrophobicContact CD2-CB 3.85Å; F409-A418 HydrophobicContact CE1-CB 3.72Å; F409-A418 HydrophobicContact CE2-CB 4.11Å; F409-A418 HydrophobicContact CG-CB 3.51Å; F409-A418 HydrophobicContact CZ-CB 4.07Å; F413-A418 HydrophobicContact CB-CB 4.2Å; F413-A418 HydrophobicContact CD1-CB 4.47Å; F413-A418 HydrophobicContact CG-CB 4.5Å; S414-A418 PolarHBondContact O-N 3.48Å; A418-L421 PolarHBondContact O-N 3.06Å; A418-A422 PolarHBondContact O-N 3.41Å
419	F	98.6	Very high	91.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.6	-44.5	177.8	-171.8	-136.1	0	0	0	112	M105 W117 L119 L131 A133 I145 L407 P415 Q417 L421 A422 L423	M105-F419 HydrophobicContact CE-CD2 3.65Å; M105-F419 HydrophobicContact CE-CE2 3.48Å; M105-F419 VanDerWaalsContact CE-CE2 3.48Å; M105-F419 HydrophobicContact CG-CD2 4.11Å; M105-F419 HydrophobicContact CG-CE2 3.99Å; M105-F419 HydrophobicContact SD-CD2 3.85Å; M105-F419 HydrophobicContact SD-CE2 4.07Å; W117-F419 HydrophobicContact CB-CE2 4.24Å; W117-F419 HydrophobicContact CB-CZ 4.09Å; W117-F419 WeakPolarHBondContact O-CZ 3.37Å; L119-F419 HydrophobicContact CB-CD2 3.75Å; L119-F419 HydrophobicContact CB-CE2 3.75Å; L119-F419 HydrophobicContact CB-CG 4.17Å; L119-F419 HydrophobicContact CB-CZ 4.19Å; L119-F419 HydrophobicContact CD2-CB 4.13Å; L119-F419 HydrophobicContact CD2-CD2 4.38Å; L119-F419 HydrophobicContact CD2-CG 4.33Å; L119-F419 HydrophobicContact CG-CD2 4.44Å; L131-F419 HydrophobicContact CB-CD1 3.77Å; L131-F419 HydrophobicContact CB-CE1 3.81Å; L131-F419 HydrophobicContact CD1-CB 4.15Å; L131-F419 HydrophobicContact CD1-CD1 3.98Å; L131-F419 HydrophobicContact CD1-CG 4.38Å; A133-F419 HydrophobicContact CB-CE1 3.55Å; A133-F419 HydrophobicContact CB-CZ 3.75Å; I145-F419 HydrophobicContact CD1-CD1 4.21Å; I145-F419 HydrophobicContact CG1-CD1 4.39Å; I145-F419 HydrophobicContact CG2-CD1 4.04Å; I145-F419 HydrophobicContact CG2-CE1 4.28Å; L407-F419 HydrophobicContact CD2-CB 4.45Å; L407-F419 HydrophobicContact CD2-CD2 4.49Å; P415-F419 WeakPolarHBondContact O-CB 3.3Å; P415-F419 PolarHBondContact O-N 2.88Å; Q417-F419 VanDerWaalsContact C-N 3.34Å; Q417-F419 PolarHBondContact O-N 3.2Å; F419-L421 VanDerWaalsContact C-N 3.34Å; F419-L421 PolarHBondContact O-N 3.36Å; F419-A422 PolarHBondContact O-N 3.08Å; F419-L423 HydrophobicContact CD1-CD1 4.08Å; F419-L423 HydrophobicContact CD2-CG 4.5Å; F419-L423 HydrophobicContact CE1-CD1 4.05Å; F419-L423 HydrophobicContact CE2-CG 4.42Å; F419-L423 HydrophobicContact CG-CD1 4.34Å; F419-L423 HydrophobicContact CZ-CD1 4.27Å; F419-L423 HydrophobicContact CZ-CD2 4.48Å; F419-L423 VanDerWaalsContact O-CG 3.25Å; F419-L423 WeakPolarHBondContact O-CG 3.32Å; F419-L423 PolarHBondContact O-N 3.07Å
420	A	98.2	Very high	89.6	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-42.6	175.7	0	0	0	0	0	112	I145 L195 V206 V416 Q417 L423 T424	I145-A420 HydrophobicContact CD1-CB 3.88Å; L195-A420 WeakPolarHBondContact CD2-O 3.45Å; V206-A420 HydrophobicContact CB-CB 4.38Å; V206-A420 HydrophobicContact CG1-CB 3.71Å; V206-A420 HydrophobicContact CG2-CB 3.68Å; V416-A420 VanDerWaalsContact O-CB 3.31Å; V416-A420 WeakPolarHBondContact O-CB 3.5Å; V416-A420 PolarHBondContact O-N 3.4Å; Q417-A420 PolarHBondContact O-N 3.22Å; A420-L423 WeakPolarHBondContact O-CB 3.47Å; A420-L423 PolarHBondContact O-N 3.43Å; A420-T424 PolarHBondContact O-N 3.06Å
421	L	97.7	Very high	87.1	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-48.7	174.8	178.6	61.4	0	0	0	111.3	I221 L235 V237 F385 I387 L395 F413 Q417 A418 F419 L423 T424	I221-L421 HydrophobicContact CB-CD1 4.45Å; I221-L421 HydrophobicContact CG1-CD1 3.72Å; I221-L421 HydrophobicContact CG2-CD1 3.78Å; L235-L421 HydrophobicContact CD1-CD1 4.47Å; L235-L421 HydrophobicContact CD2-CD1 4.29Å; V237-L421 HydrophobicContact CG2-CD1 3.64Å; V237-L421 HydrophobicContact CG2-CD2 3.94Å; V237-L421 HydrophobicContact CG2-CG 4.47Å; F385-L421 HydrophobicContact CE2-CD2 4.1Å; F385-L421 HydrophobicContact CE2-CG 4.21Å; F385-L421 HydrophobicContact CZ-CG 4.17Å; I387-L421 HydrophobicContact CD1-CD2 4.31Å; I387-L421 HydrophobicContact CG1-CD2 3.95Å; L395-L421 HydrophobicContact CD1-CD2 4.05Å; L395-L421 HydrophobicContact CD2-CD2 4.45Å; F413-L421 HydrophobicContact CE1-CD2 3.99Å; F413-L421 HydrophobicContact CZ-CD2 3.96Å; Q417-L421 WeakPolarHBondContact O-CB 3.3Å; Q417-L421 PolarHBondContact O-N 3.2Å; A418-L421 PolarHBondContact O-N 3.06Å; F419-L421 VanDerWaalsContact C-N 3.34Å; F419-L421 PolarHBondContact O-N 3.36Å; L421-L423 VanDerWaalsContact C-N 3.27Å; L421-L423 PolarHBondContact O-N 3.5Å; L421-T424 WeakPolarHBondContact O-CB 3.46Å; L421-T424 PolarHBondContact O-N 2.86Å; L421-T424 PolarHBondContact O-OG1 3.37Å
422	A	97.4	Very high	86.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.1	-35.8	179.1	0	0	0	0	0	112.8	M105 F397 L407 A418 F419 T424 S425	M105-A422 HydrophobicContact CE-CB 3.75Å; M105-A422 HydrophobicContact SD-CB 3.42Å; M105-A422 WeakPolarHBondContact SD-CB 3.28Å; F397-A422 HydrophobicContact CD2-CB 3.74Å; F397-A422 HydrophobicContact CE2-CB 3.84Å; F397-A422 HydrophobicContact CG-CB 4.28Å; F397-A422 HydrophobicContact CZ-CB 4.46Å; L407-A422 HydrophobicContact CD1-CB 4.04Å; L407-A422 HydrophobicContact CD2-CB 3.99Å; A418-A422 PolarHBondContact O-N 3.41Å; F419-A422 PolarHBondContact O-N 3.08Å; A422-T424 PolarHBondContact O-N 3.39Å; A422-S425 WeakPolarHBondContact O-CB 3.32Å; A422-S425 PolarHBondContact O-N 2.9Å; A422-S425 VanDerWaalsContact O-N 3.12Å; A422-S425 PolarHBondContact O-OG 2.87Å
423	L	95.6	Very high	86.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-31.4	178	-76.6	165.9	0	0	0	113.5	M105 W117 A133 Y143 I145 L195 F419 A420 L421 S425 F426 M427	M105-L423 HydrophobicContact CE-CD2 4.33Å; M105-L423 HydrophobicContact CE-CG 4.38Å; W117-L423 HydrophobicContact CB-CD2 3.85Å; W117-L423 VanDerWaalsContact CD1-CD2 3.49Å; W117-L423 HydrophobicContact CG-CD2 3.78Å; A133-L423 HydrophobicContact CB-CD1 3.42Å; A133-L423 VanDerWaalsContact CB-CD1 3.42Å; A133-L423 HydrophobicContact CB-CD2 3.84Å; A133-L423 HydrophobicContact CB-CG 4.28Å; Y143-L423 HydrophobicContact CD1-CD2 4.21Å; Y143-L423 HydrophobicContact CD2-CB 4.28Å; Y143-L423 HydrophobicContact CD2-CD2 4.34Å; Y143-L423 HydrophobicContact CE1-CD2 4.25Å; Y143-L423 HydrophobicContact CE2-CD2 4.35Å; Y143-L423 HydrophobicContact CG-CD1 4.37Å; Y143-L423 HydrophobicContact CG-CD2 4.26Å; I145-L423 HydrophobicContact CD1-CD1 4.02Å; I145-L423 HydrophobicContact CG1-CD1 4.17Å; L195-L423 HydrophobicContact CD2-CB 3.46Å; L195-L423 VanDerWaalsContact CD2-CB 3.46Å; L195-L423 HydrophobicContact CD2-CD1 4.36Å; F419-L423 HydrophobicContact CD1-CD1 4.08Å; F419-L423 HydrophobicContact CD2-CG 4.5Å; F419-L423 HydrophobicContact CE1-CD1 4.05Å; F419-L423 HydrophobicContact CE2-CG 4.42Å; F419-L423 HydrophobicContact CG-CD1 4.34Å; F419-L423 HydrophobicContact CZ-CD1 4.27Å; F419-L423 HydrophobicContact CZ-CD2 4.48Å; F419-L423 VanDerWaalsContact O-CG 3.25Å; F419-L423 WeakPolarHBondContact O-CG 3.32Å; F419-L423 PolarHBondContact O-N 3.07Å; A420-L423 WeakPolarHBondContact O-CB 3.47Å; A420-L423 PolarHBondContact O-N 3.43Å; L421-L423 VanDerWaalsContact C-N 3.27Å; L421-L423 PolarHBondContact O-N 3.5Å; L423-S425 PolarHBondContact O-N 3.08Å; L423-F426 PolarHBondContact O-N 3.13Å; L423-M427 WeakPolarHBondContact O-CG 3.1Å
424	T	93.4	Very high	85.9	Confident	4 Å²	4	35.1 Å²	35.1	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-29.9	176.9	67.6	0	0	0	0	112.4	L195 F204 I221 Y223 A420 L421 A422 F426 M427	L195-T424 HydrophobicContact CD1-CG2 3.99Å; L195-T424 HydrophobicContact CD2-CG2 4.18Å; F204-T424 HydrophobicContact CB-CG2 3.99Å; F204-T424 HydrophobicContact CD1-CG2 3.78Å; F204-T424 HydrophobicContact CD2-CG2 3.99Å; F204-T424 HydrophobicContact CE1-CG2 4.26Å; F204-T424 HydrophobicContact CE2-CG2 4.45Å; F204-T424 HydrophobicContact CG-CG2 3.64Å; I221-T424 HydrophobicContact CD1-CG2 4.47Å; I221-T424 HydrophobicContact CG1-CG2 4.46Å; I221-T424 HydrophobicContact CG2-CG2 4.49Å; Y223-T424 PolarHBondContact OH-OG1 2.9Å; A420-T424 PolarHBondContact O-N 3.06Å; L421-T424 WeakPolarHBondContact O-CB 3.46Å; L421-T424 PolarHBondContact O-N 2.86Å; L421-T424 PolarHBondContact O-OG1 3.37Å; A422-T424 PolarHBondContact O-N 3.39Å; T424-F426 PolarHBondContact O-N 2.66Å; T424-M427 WeakPolarHBondContact O-CB 3.37Å; T424-M427 PolarHBondContact O-N 3.21Å; T424-M427 VanDerWaalsContact O-N 3.07Å
425	S	90.5	Very high	85.3	Confident	14 Å²	14	37.2 Å²	37.2	10%	0.098	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-19	177.5	76.8	0	0	0	0	113.9	K383 F397 A422 L423	K383-S425 WeakPolarHBondContact CD-O 3.25Å; K383-S425 VanDerWaalsContact CE-O 3.26Å; K383-S425 WeakPolarHBondContact CE-O 3.41Å; F397-S425 WeakPolarHBondContact CE1-OG 3.41Å; A422-S425 WeakPolarHBondContact O-CB 3.32Å; A422-S425 PolarHBondContact O-N 2.9Å; A422-S425 VanDerWaalsContact O-N 3.12Å; A422-S425 PolarHBondContact O-OG 2.87Å; L423-S425 PolarHBondContact O-N 3.08Å
426	F	88.5	Confident	84.6	Confident	19 Å²	19	39.4 Å²	39.4	8%	0.083	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-4.3	177.3	-56.5	-65.3	0	0	0	113.1	M105 W117 K383 F397 Y405 L423 T424 Q428	M105-F426 HydrophobicContact CE-CD2 4.5Å; M105-F426 HydrophobicContact CE-CE2 3.73Å; W117-F426 AromaticContact CD2-CD2 3.97Å; W117-F426 HydrophobicContact CD2-CD2 3.97Å; W117-F426 AromaticContact CD2-CE2 3.86Å; W117-F426 HydrophobicContact CD2-CE2 3.86Å; W117-F426 HydrophobicContact CD2-CG 4.43Å; W117-F426 HydrophobicContact CD2-CZ 4.21Å; W117-F426 AromaticContact CE2-CD1 3.88Å; W117-F426 AromaticContact CE2-CD2 3.57Å; W117-F426 AromaticContact CE2-CE2 3.83Å; W117-F426 AromaticContact CE2-CG 3.59Å; W117-F426 HydrophobicContact CE3-CD2 4.45Å; W117-F426 HydrophobicContact CE3-CE1 4.49Å; W117-F426 AromaticContact CE3-CE2 3.89Å; W117-F426 HydrophobicContact CE3-CE2 3.89Å; W117-F426 AromaticContact CE3-CZ 3.89Å; W117-F426 HydrophobicContact CE3-CZ 3.89Å; W117-F426 HydrophobicContact CG-CD2 4.46Å; W117-F426 AromaticContact CH2-CD1 3.54Å; W117-F426 HydrophobicContact CH2-CD1 3.54Å; W117-F426 HydrophobicContact CH2-CD2 4.3Å; W117-F426 AromaticContact CH2-CE1 3.13Å; W117-F426 HydrophobicContact CH2-CE1 3.13Å; W117-F426 AromaticContact CH2-CE2 3.96Å; W117-F426 HydrophobicContact CH2-CE2 3.96Å; W117-F426 HydrophobicContact CH2-CG 4.11Å; W117-F426 AromaticContact CH2-CZ 3.35Å; W117-F426 HydrophobicContact CH2-CZ 3.35Å; W117-F426 HydrophobicContact CZ2-CB 4.15Å; W117-F426 AromaticContact CZ2-CD1 3.2Å; W117-F426 HydrophobicContact CZ2-CD1 3.2Å; W117-F426 AromaticContact CZ2-CD2 3.78Å; W117-F426 HydrophobicContact CZ2-CD2 3.78Å; W117-F426 AromaticContact CZ2-CE1 3.36Å; W117-F426 HydrophobicContact CZ2-CE1 3.36Å; W117-F426 AromaticContact CZ2-CE2 3.92Å; W117-F426 HydrophobicContact CZ2-CE2 3.92Å; W117-F426 AromaticContact CZ2-CG 3.43Å; W117-F426 HydrophobicContact CZ2-CG 3.43Å; W117-F426 VanDerWaalsContact CZ2-CG 3.43Å; W117-F426 AromaticContact CZ2-CZ 3.7Å; W117-F426 HydrophobicContact CZ2-CZ 3.7Å; W117-F426 HydrophobicContact CZ3-CD1 4.43Å; W117-F426 AromaticContact CZ3-CE1 3.76Å; W117-F426 HydrophobicContact CZ3-CE1 3.76Å; W117-F426 AromaticContact CZ3-CE2 3.93Å; W117-F426 HydrophobicContact CZ3-CE2 3.93Å; W117-F426 AromaticContact CZ3-CZ 3.44Å; W117-F426 HydrophobicContact CZ3-CZ 3.44Å; W117-F426 VanDerWaalsContact CZ3-CZ 3.44Å; W117-F426 AromaticContact NE1-CD2 3.78Å; W117-F426 AromaticContact NE1-CG 3.81Å; K383-F426 HydrophobicContact CD-CD1 4.2Å; K383-F426 HydrophobicContact CD-CE1 4.11Å; F397-F426 HydrophobicContact CE2-CE2 4.42Å; F397-F426 HydrophobicContact CE2-CZ 4.36Å; F397-F426 AromaticContact CZ-CE2 3.85Å; F397-F426 HydrophobicContact CZ-CE2 3.85Å; F397-F426 AromaticContact CZ-CZ 3.59Å; F397-F426 HydrophobicContact CZ-CZ 3.59Å; Y405-F426 HydrophobicContact CD1-CZ 4.38Å; Y405-F426 HydrophobicContact CD2-CE1 4Å; Y405-F426 AromaticContact CD2-CZ 3.63Å; Y405-F426 HydrophobicContact CD2-CZ 3.63Å; Y405-F426 HydrophobicContact CE1-CE1 4.28Å; Y405-F426 HydrophobicContact CE1-CZ 4.38Å; Y405-F426 AromaticContact CE2-CE1 3.52Å; Y405-F426 HydrophobicContact CE2-CE1 3.52Å; Y405-F426 AromaticContact CE2-CZ 3.67Å; Y405-F426 HydrophobicContact CE2-CZ 3.67Å; Y405-F426 HydrophobicContact CG-CZ 4.04Å; Y405-F426 AromaticContact CZ-CE1 3.68Å; L423-F426 PolarHBondContact O-N 3.13Å; T424-F426 PolarHBondContact O-N 2.66Å; F426-Q428 PolarHBondContact O-N 3.34Å
427	M	83	Confident	83.8	Confident	8 Å²	8	42 Å²	42	4%	0.039	20%	0.202	C	C	.	.			trans	-94.3	91.8	-179.6	-60.5	171.8	86.3	0	0	107.9	P141 Y143 L195 A197 F204 L423 T424	P141-M427 HydrophobicContact CB-CB 3.97Å; P141-M427 HydrophobicContact CB-CE 3.47Å; P141-M427 VanDerWaalsContact CB-CE 3.47Å; P141-M427 HydrophobicContact CB-CG 3.82Å; P141-M427 HydrophobicContact CB-SD 4.48Å; P141-M427 HydrophobicContact CG-CB 3.73Å; P141-M427 HydrophobicContact CG-CE 3.76Å; P141-M427 HydrophobicContact CG-CG 4.12Å; P141-M427 WeakPolarHBondContact O-CE 3.41Å; Y143-M427 HydrophobicContact CD2-CE 4.07Å; Y143-M427 HydrophobicContact CD2-CG 4.07Å; Y143-M427 HydrophobicContact CD2-SD 3.78Å; Y143-M427 HydrophobicContact CE2-CE 4.45Å; Y143-M427 HydrophobicContact CE2-CG 3.59Å; Y143-M427 HydrophobicContact CE2-SD 3.96Å; L195-M427 HydrophobicContact CD2-CE 4.35Å; L195-M427 HydrophobicContact CD2-SD 3.51Å; L195-M427 VanDerWaalsContact CD2-SD 3.51Å; L195-M427 HydrophobicContact CG-CE 4.25Å; L195-M427 HydrophobicContact CG-SD 3.98Å; A197-M427 HydrophobicContact CB-CE 3.79Å; F204-M427 HydrophobicContact CD1-CE 3.99Å; F204-M427 HydrophobicContact CD1-SD 3.69Å; F204-M427 HydrophobicContact CE1-CB 3.59Å; F204-M427 HydrophobicContact CE1-CE 3.86Å; F204-M427 HydrophobicContact CE1-CG 4.08Å; F204-M427 HydrophobicContact CE1-SD 3.43Å; F204-M427 WeakPolarHBondContact CE1-SD 3.42Å; F204-M427 HydrophobicContact CZ-CB 4.02Å; L423-M427 WeakPolarHBondContact O-CG 3.1Å; T424-M427 WeakPolarHBondContact O-CB 3.37Å; T424-M427 PolarHBondContact O-N 3.21Å; T424-M427 VanDerWaalsContact O-N 3.07Å
428	Q	69.7	Low	82.8	Confident	124 Å²	124	44.8 Å²	44.8	58%	0.579	22%	0.216	S	C	*	.			trans	-114.5	151.9	177.7	-65.8	179.9	-13.7	0	0	110.2	F426	F426-Q428 PolarHBondContact O-N 3.34Å
429	R	57.8	Low	81.6	Confident	140 Å²	140	48.2 Å²	48.2	53%	0.528	23%	0.232	S	C	.	.			trans	-65.7	134.3	169.9	-159.5	179.7	67.8	177.4	3.2	108.9	L431	R429-L431 HydrophobicContact CG-CB 3.94Å; R429-L431 PolarHBondContact NE-O 2.94Å; R429-L431 PolarHBondContact NH2-O 3.36Å
430	L	49.4	Very low	80.2	Confident	136 Å²	136	52.3 Å²	52.3	71%	0.712	25%	0.251	S	S	*	.			trans	-84.3	7.1	171.4	-79.3	165.7	0	0	0	113.1
431	L	41	Very low	78.6	Confident	179 Å²	179	57 Å²	57	94%	0.937	27%	0.274	S	S	*	.			trans	-108.5	0	-178.2	-69	165.7	0	0	0	112.2	R429	R429-L431 HydrophobicContact CG-CB 3.94Å; R429-L431 PolarHBondContact NE-O 2.94Å; R429-L431 PolarHBondContact NH2-O 3.36Å

Retrieved 431 of 431 residues in 207.3 ms (Link to these results)

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