A0A024R3M2_HUMAN Loading...

GRAM domain containing 1B

AlphaFold DB , UniProt , Accession A0A024R3M2, Species HUMAN (Homo sapiens, Human), Gene GRAMD1B, Length 694 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	31.7	Very low	31.7	Very low	229 Å²	229	132.2 Å²	132.2	100%	1.128	74%	0.743	S	S	*	*				0	127.9	0	-79.6	154.8	66.6	0	0	107.3
2	V	33.2	Very low	31.5	Very low	120 Å²	120	136.2 Å²	136.2	73%	0.727	75%	0.747	S	S	*	*				73.6	96.4	118.3	178.7	0	0	0	0	111.2
3	E	35.5	Very low	31.1	Very low	146 Å²	146	133.8 Å²	133.8	68%	0.682	75%	0.746	S	S	*	*				68	147.8	92.7	-71.5	-164.2	146.5	0	0	113.3
4	K	32.8	Very low	32.3	Very low	167 Å²	167	132.2 Å²	132.2	73%	0.726	74%	0.744	S	S	*	*			cis	-145.9	166.5	-1.6	-109.8	151.7	-179.8	145.6	0	105.3
5	G	30.7	Very low	31.8	Very low	61 Å²	61	129.9 Å²	129.9	63%	0.629	74%	0.74	S	S	*	*			cis	108.2	128	35.7	0	0	0	0	0	109.9
6	S	31	Very low	31.5	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	74%	0.744	S	S	*	*			trans	50.5	141.7	147.7	59.1	0	0	0	0	121.4
7	D	31	Very low	32.2	Very low	127 Å²	127	128.3 Å²	128.3	68%	0.679	74%	0.739	S	S	*	*			cis	-173.1	165.8	-7.1	-113.3	-55	0	0	0	110.2
8	H	32.6	Very low	32	Very low	171 Å²	171	130.1 Å²	130.1	79%	0.792	74%	0.74	S	S	*	*			trans	61.6	164.3	157.1	-65	-18.7	0	0	0	118.7
9	S	31.1	Very low	31.7	Very low	96 Å²	96	132.5 Å²	132.5	67%	0.671	74%	0.744	S	S	*	*			cis	-163.4	164.9	-25.6	51.7	0	0	0	0	110.1
10	S	31.1	Very low	31.4	Very low	100 Å²	100	129.4 Å²	129.4	70%	0.699	74%	0.743	S	S	*	*			trans	20	141.2	152.4	55	0	0	0	0	121.2
11	D	28	Very low	31.2	Very low	131 Å²	131	129.4 Å²	129.4	70%	0.701	75%	0.745	S	S	*	*			cis	-164.4	-176.1	38	-142.8	-34.9	0	0	0	114.6
12	K	29.8	Very low	31	Very low	180 Å²	180	127.9 Å²	127.9	78%	0.783	74%	0.735	S	S	*	*			trans	-44.4	158.5	170.6	-71.8	154.8	-170.5	153.1	0	115
13	S	25.6	Very low	30.7	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	74%	0.74	S	S	*	*			cis	-175.4	-172.6	8.8	-108	0	0	0	0	108.1
14	P	48.2	Very low	30.2	Very low	111 Å²	111	130.9 Å²	130.9	72%	0.721	74%	0.744	S	S	*	*			cis	-133.7	-156.6	-44.1	41.2	-22.7	0	0	0	112.8
15	S	24.4	Very low	29.9	Very low	97 Å²	97	128.1 Å²	128.1	68%	0.678	75%	0.745	S	S	*	*			trans	77.5	106.8	158.5	50.7	0	0	0	0	123
16	T	27.2	Very low	29.7	Very low	131 Å²	131	130.5 Å²	130.5	80%	0.804	75%	0.752	S	S	*	*				24.4	158.2	114.8	53.6	0	0	0	0	121.9
17	P	44.4	Very low	29.5	Very low	102 Å²	102	130.4 Å²	130.4	66%	0.662	75%	0.751	S	S	*	*			cis	-142.7	-176.1	17.8	42	-22.4	0	0	0	118.1
18	E	27.1	Very low	29.5	Very low	160 Å²	160	133.3 Å²	133.3	75%	0.748	76%	0.761	S	S	*	*			trans	67.3	161.7	148.8	-82.2	174.5	-145.9	0	0	120
19	Q	26.3	Very low	29.3	Very low	176 Å²	176	130.9 Å²	130.9	82%	0.822	76%	0.763	S	S	*	*			cis	-150.5	162.2	3.9	-140.1	176.8	71.3	0	0	110.8
20	G	26	Very low	29.1	Very low	70 Å²	70	129.5 Å²	129.5	72%	0.722	76%	0.764	S	S	*	*			trans	157.3	117.6	166.5	0	0	0	0	0	115.4
21	V	27.8	Very low	29.1	Very low	130 Å²	130	136.7 Å²	136.7	79%	0.788	78%	0.776	S	S	*	*			trans	-139.8	141.3	-175.5	174.1	0	0	0	0	111.6
22	Q	28.1	Very low	29.1	Very low	198 Å²	198	136.3 Å²	136.3	93%	0.925	78%	0.783	S	S	*	*			trans	-141.4	155.9	151.2	-118.9	175.5	-3.9	0	0	111.4
23	R	26.3	Very low	28.9	Very low	217 Å²	217	131.5 Å²	131.5	82%	0.819	79%	0.785	S	S	*	*			trans	-151.5	142.3	-166.2	-99.4	-171.7	177.2	176.5	1	113.1
24	S	25.2	Very low	29.1	Very low	112 Å²	112	130.1 Å²	130.1	78%	0.783	79%	0.788	S	S	*	*			trans	-165	106.5	147.8	46.6	0	0	0	0	106.9
25	C	25.5	Very low	28.6	Very low	109 Å²	109	134.4 Å²	134.4	74%	0.736	80%	0.795	S	S	*	*				65.6	132.6	68.7	-61.6	0	0	0	0	112.4
26	S	26.9	Very low	29.1	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	80%	0.804	S	S	*	*			cis	-170.1	161.3	-7.5	35.6	0	0	0	0	107.2
27	S	26.1	Very low	29.3	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	80%	0.796	S	S	*	*				-166.8	140.6	53.5	46.3	0	0	0	0	110.1
28	Q	31	Very low	29.1	Very low	188 Å²	188	139.8 Å²	139.8	88%	0.879	80%	0.804	S	S	*	*				50.8	136.8	88.2	-61.7	-167.6	14.6	0	0	115.6
29	S	29.1	Very low	29.5	Very low	120 Å²	120	142 Å²	142	84%	0.839	81%	0.811	S	S	*	*			cis	-148	176.3	10.5	80.3	0	0	0	0	111.4
30	G	26.3	Very low	29.8	Very low	67 Å²	67	136.3 Å²	136.3	69%	0.691	79%	0.79	S	S	*	*			cis	-160.7	-154.9	16.8	0	0	0	0	0	116
31	R	30.9	Very low	30.2	Very low	251 Å²	251	137.3 Å²	137.3	95%	0.947	78%	0.776	S	S	*	*			trans	-117.8	176.2	-164.9	-51.3	150	91.5	174.7	7.3	108.7
32	S	28.1	Very low	30.6	Very low	122 Å²	122	136.3 Å²	136.3	85%	0.853	78%	0.775	S	S	*	*			cis	-167.9	164.3	19	43.2	0	0	0	0	108.8
33	G	25.5	Very low	30.9	Very low	80 Å²	80	133 Å²	133	83%	0.825	75%	0.754	S	S	*	*			cis	159.5	153.4	-1.4	0	0	0	0	0	111.1
34	G	30.9	Very low	31.1	Very low	77 Å²	77	128.8 Å²	128.8	79%	0.794	74%	0.739	S	S	*	*			trans	-110.7	149.5	-176.2	0	0	0	0	0	114.8
35	K	36.8	Very low	31.7	Very low	201 Å²	201	127.9 Å²	127.9	87%	0.874	73%	0.725	S	S	*	*			trans	-145.4	151.2	167.6	-83.2	-171.2	175	177.8	0	111.5
36	N	34.7	Very low	32.4	Very low	161 Å²	161	128.4 Å²	128.4	86%	0.861	73%	0.725	S	S	*	*	S	Bend	trans	73	86.9	167.4	-58.5	-5.6	0	0	0	118.6
37	S	32.7	Very low	33.1	Very low	92 Å²	92	128.9 Å²	128.9	64%	0.643	72%	0.718	S	S	*	*			trans	-151.7	-31.7	150.8	67.8	0	0	0	0	113.7	K39 S40	S37-K39 PolarHBondContact O-N 3.41Å; S37-S40 PolarHBondContact O-N 2.74Å; S37-S40 VanDerWaalsContact O-N 3.14Å
38	K	39.6	Very low	34.1	Very low	190 Å²	190	127.5 Å²	127.5	83%	0.826	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	27.3	-173	-64.2	-164.3	172.7	-168.5	0	118.2
39	K	34.8	Very low	35.8	Very low	207 Å²	207	121 Å²	121	90%	0.9	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	-2.4	164.6	-78.3	-165.4	172.8	-171.3	0	114.2	S37	S37-K39 PolarHBondContact O-N 3.41Å
40	S	32.8	Very low	38.2	Very low	56 Å²	56	117.5 Å²	117.5	39%	0.392	66%	0.656	S	S	.	*	S	Bend	trans	-89.2	-36.1	-178.6	-150.9	0	0	0	0	114.4	S37 S42 W43	S37-S40 PolarHBondContact O-N 2.74Å; S37-S40 VanDerWaalsContact O-N 3.14Å; S40-S42 VanDerWaalsContact C-N 3.26Å; S40-S42 PolarHBondContact O-N 2.78Å; S40-W43 PolarHBondContact O-NE1 2.81Å
41	Q	34.8	Very low	41.1	Very low	91 Å²	91	114.5 Å²	114.5	43%	0.425	62%	0.624	S	S	.	*	H	α-helix	trans	-61.6	-23.3	-167.5	-77	170.8	-57.3	0	0	115.6	W43 N45 E185	Q41-W43 VanDerWaalsContact C-N 3.25Å; Q41-W43 PolarHBondContact O-N 3.09Å; Q41-W43 VanDerWaalsContact O-N 3.13Å; Q41-N45 PolarHBondContact O-N 2.68Å; Q41-N45 PolarHBondContact O-OD1 3.11Å; Q41-E185 PolarHBondContact NE2-OE1 3.3Å
42	S	36.3	Very low	43.6	Very low	108 Å²	108	105.6 Å²	105.6	76%	0.755	59%	0.592	S	S	*	*	H	α-helix	trans	-66.5	-17	-171.2	-168	0	0	0	0	115.7	S40	S40-S42 VanDerWaalsContact C-N 3.26Å; S40-S42 PolarHBondContact O-N 2.78Å
43	W	34.5	Very low	46.3	Very low	130 Å²	130	104 Å²	104	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-109.2	-29.4	180	69.9	-87.4	0	0	0	113.3	S40 Q41 N45 V46 L47	S40-W43 PolarHBondContact O-NE1 2.81Å; Q41-W43 VanDerWaalsContact C-N 3.25Å; Q41-W43 PolarHBondContact O-N 3.09Å; Q41-W43 VanDerWaalsContact O-N 3.13Å; W43-N45 VanDerWaalsContact C-N 3.31Å; W43-N45 PolarHBondContact O-N 3.26Å; W43-V46 PolarHBondContact O-N 2.91Å; W43-L47 HydrophobicContact CE3-CD1 3.63Å; W43-L47 HydrophobicContact CZ3-CD1 3.58Å
44	Y	29.8	Very low	49.2	Very low	128 Å²	128	102.6 Å²	102.6	50%	0.502	54%	0.541	S	S	.	.	H	α-helix	trans	-60.9	-39.8	173.3	-78.2	-77.2	0	0	0	112.1	V46 L47 S48	Y44-V46 PolarHBondContact O-N 3.44Å; Y44-L47 PolarHBondContact O-N 3.14Å; Y44-S48 PolarHBondContact O-N 3.07Å
45	N	38.2	Very low	52	Low	92 Å²	92	100.2 Å²	100.2	49%	0.492	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-11	178.7	-64.8	9.8	0	0	0	113.9	Q41 W43	Q41-N45 PolarHBondContact O-N 2.68Å; Q41-N45 PolarHBondContact O-OD1 3.11Å; W43-N45 VanDerWaalsContact C-N 3.31Å; W43-N45 PolarHBondContact O-N 3.26Å
46	V	40	Very low	54.4	Low	121 Å²	121	94.9 Å²	94.9	73%	0.733	49%	0.488	S	S	*	.	H	α-helix	trans	-91.2	-21.3	174.9	-174.9	0	0	0	0	111.6	W43 Y44	W43-V46 PolarHBondContact O-N 2.91Å; Y44-V46 PolarHBondContact O-N 3.44Å
47	L	42.1	Very low	56.9	Low	120 Å²	120	90 Å²	90	63%	0.628	46%	0.462	S	S	*	.	H	α-helix	trans	-98.6	-11.8	-175.2	-65.4	175.6	0	0	0	114	W43 Y44	W43-L47 HydrophobicContact CE3-CD1 3.63Å; W43-L47 HydrophobicContact CZ3-CD1 3.58Å; Y44-L47 PolarHBondContact O-N 3.14Å
48	S	47	Very low	59.7	Low	76 Å²	76	85.7 Å²	85.7	53%	0.531	43%	0.432	S	S	.	.	S	Bend	trans	-138.4	103.7	176	-75.4	0	0	0	0	109.7	Y44 T50	Y44-S48 PolarHBondContact O-N 3.07Å; S48-T50 PolarHBondContact O-N 2.93Å
49	P	66.9	Low	62	Low	51 Å²	51	80.9 Å²	80.9	33%	0.331	41%	0.409	S	S	.	.			trans	-63	129.9	176.1	24.7	-32.5	0	0	0	109.8	Q53 R54	P49-Q53 HydrophobicContact CB-CB 4.42Å; P49-Q53 HydrophobicContact CB-CG 4.29Å; P49-Q53 VanDerWaalsContact CB-OE1 3.3Å; P49-R54 HydrophobicContact CB-CG 4.47Å; P49-R54 HydrophobicContact CG-CG 4.43Å; P49-R54 PolarHBondContact O-NE 3.37Å
50	T	79.9	Confident	64.6	Low	47 Å²	47	76.1 Å²	76.1	29%	0.288	39%	0.388	S	S	.	.			trans	-63	162.1	-175.7	58	0	0	0	0	111.6	S48 K52 Q53 R54	S48-T50 PolarHBondContact O-N 2.93Å; T50-K52 VanDerWaalsContact C-N 3.28Å; T50-K52 PolarHBondContact O-N 3.46Å; T50-Q53 PolarHBondContact O-N 3.13Å; T50-Q53 VanDerWaalsContact O-N 3.15Å; T50-R54 PolarHBondContact O-N 3.44Å
51	Y	86.1	Confident	67.3	Low	3 Å²	3	75.6 Å²	75.6	1%	0.012	38%	0.38	C	S	.	.	H	α-helix	trans	-55.8	-43.9	177.1	169.2	-98.7	0	0	0	112.1	Q53 R54 N55 R70 L71 W175 V178 Y182 L186 L188	Y51-Q53 VanDerWaalsContact C-N 3.32Å; Y51-Q53 PolarHBondContact O-N 2.7Å; Y51-R54 PolarHBondContact O-N 3.19Å; Y51-R54 VanDerWaalsContact O-N 3.11Å; Y51-N55 HydrophobicContact CE1-CB 4.31Å; Y51-N55 HydrophobicContact CE2-CB 4.42Å; Y51-N55 WeakPolarHBondContact O-CB 3.39Å; Y51-N55 PolarHBondContact O-N 3.12Å; Y51-R70 VanDerWaalsContact OH-CG 3.28Å; Y51-R70 WeakPolarHBondContact OH-CG 3.46Å; Y51-L71 HydrophobicContact CE2-CB 4.34Å; Y51-L71 HydrophobicContact CE2-CG 4.44Å; Y51-L71 WeakPolarHBondContact CE2-O 3.17Å; Y51-L71 PolarHBondContact OH-O 2.99Å; Y51-W175 HydrophobicContact CD1-CZ3 4.18Å; Y51-W175 AromaticContact CE1-CH2 3.87Å; Y51-W175 HydrophobicContact CE1-CH2 3.87Å; Y51-W175 AromaticContact CE1-CZ3 3.54Å; Y51-W175 HydrophobicContact CE1-CZ3 3.54Å; Y51-V178 HydrophobicContact CD1-CG1 3.88Å; Y51-V178 HydrophobicContact CD2-CG1 3.51Å; Y51-V178 HydrophobicContact CE1-CG1 3.95Å; Y51-V178 HydrophobicContact CE2-CB 4.39Å; Y51-V178 HydrophobicContact CE2-CG1 3.55Å; Y51-V178 HydrophobicContact CE2-CG2 3.87Å; Y51-V178 HydrophobicContact CG-CG1 3.66Å; Y51-Y182 AromaticContact CD2-CD2 3.54Å; Y51-Y182 HydrophobicContact CD2-CD2 3.54Å; Y51-Y182 AromaticContact CD2-CE2 3.63Å; Y51-Y182 HydrophobicContact CD2-CE2 3.63Å; Y51-Y182 HydrophobicContact CD2-CG 4.15Å; Y51-Y182 HydrophobicContact CE2-CD2 4.33Å; Y51-Y182 HydrophobicContact CE2-CE2 4.14Å; Y51-Y182 HydrophobicContact CG-CD2 4.3Å; Y51-L186 HydrophobicContact CD1-CB 4.38Å; Y51-L186 HydrophobicContact CD1-CD1 4.48Å; Y51-L186 HydrophobicContact CG-CD2 4.19Å; Y51-L186 PolarHBondContact N-O 3.33Å; Y51-L188 HydrophobicContact CD1-CD1 4.01Å; Y51-L188 HydrophobicContact CD1-CG 4.47Å; Y51-L188 HydrophobicContact CE1-CD1 4.18Å
52	K	84.6	Confident	70	Confident	64 Å²	64	71.7 Å²	71.7	28%	0.278	36%	0.362	S	S	.	.	H	α-helix	trans	-53.2	-48.7	175.9	-169.5	169	-165.8	159.2	0	111.9	T50 R54 N55 E56 L186 G187 L188 D192	T50-K52 VanDerWaalsContact C-N 3.28Å; T50-K52 PolarHBondContact O-N 3.46Å; K52-R54 PolarHBondContact O-N 3.47Å; K52-N55 PolarHBondContact O-N 3.13Å; K52-E56 PolarHBondContact O-N 3.33Å; K52-L186 PolarHBondContact N-O 2.83Å; K52-L186 VanDerWaalsContact N-O 3.13Å; K52-G187 VanDerWaalsContact CD-O 3.24Å; K52-G187 WeakPolarHBondContact CD-O 3.3Å; K52-L188 HydrophobicContact CB-CD2 4.11Å; K52-L188 HydrophobicContact CD-CD2 4.06Å; K52-L188 HydrophobicContact CG-CD2 4.09Å; K52-D192 WeakPolarHBondContact CE-OD1 3.44Å; K52-D192 IonicContact NZ-OD1 2.7Å; K52-D192 PolarHBondContact NZ-OD1 2.88Å; K52-D192 IonicContact NZ-OD2 3.32Å; K52-D192 PolarHBondContact NZ-OD2 2.94Å
53	Q	84.6	Confident	72.3	Confident	88 Å²	88	74.9 Å²	74.9	41%	0.411	36%	0.363	S	S	.	.	H	α-helix	trans	-63	-41.8	177.3	-172.4	176.7	5.1	0	0	112.4	P49 T50 Y51 E56 D57	P49-Q53 HydrophobicContact CB-CB 4.42Å; P49-Q53 HydrophobicContact CB-CG 4.29Å; P49-Q53 VanDerWaalsContact CB-OE1 3.3Å; T50-Q53 PolarHBondContact O-N 3.13Å; T50-Q53 VanDerWaalsContact O-N 3.15Å; Y51-Q53 VanDerWaalsContact C-N 3.32Å; Y51-Q53 PolarHBondContact O-N 2.7Å; Q53-E56 PolarHBondContact O-N 2.64Å; Q53-D57 WeakPolarHBondContact O-CB 3.22Å; Q53-D57 VanDerWaalsContact O-CG 3.24Å; Q53-D57 PolarHBondContact O-N 3.35Å
54	R	86.3	Confident	74.6	Confident	51 Å²	51	76.8 Å²	76.8	19%	0.192	38%	0.377	C	S	.	.	H	α-helix	trans	-68	-36.3	177.8	-64	-162.8	-163.7	-160.8	1.8	113.4	P49 T50 Y51 K52 D57 F58 L71 D74	P49-R54 HydrophobicContact CB-CG 4.47Å; P49-R54 HydrophobicContact CG-CG 4.43Å; P49-R54 PolarHBondContact O-NE 3.37Å; T50-R54 PolarHBondContact O-N 3.44Å; Y51-R54 PolarHBondContact O-N 3.19Å; Y51-R54 VanDerWaalsContact O-N 3.11Å; K52-R54 PolarHBondContact O-N 3.47Å; R54-D57 PolarHBondContact O-N 3.14Å; R54-F58 VanDerWaalsContact O-CB 3.28Å; R54-F58 WeakPolarHBondContact O-CB 3.27Å; R54-F58 PolarHBondContact O-N 3.49Å; R54-L71 HydrophobicContact CB-CD2 3.9Å; R54-D74 VanDerWaalsContact CD-OD1 3.22Å; R54-D74 WeakPolarHBondContact CD-OD1 3.44Å; R54-D74 IonicContact CZ-OD1 2.82Å; R54-D74 IonicContact NE-OD1 2.76Å; R54-D74 VanDerWaalsContact NH1-CG 3.33Å; R54-D74 IonicContact NH1-OD1 2.74Å; R54-D74 PolarHBondContact NH1-OD1 3.38Å; R54-D74 IonicContact NH1-OD2 3.22Å; R54-D74 PolarHBondContact NH1-OD2 3.49Å; R54-D74 VanDerWaalsContact NH1-OD2 3.1Å
55	N	88.6	Confident	77.3	Confident	27 Å²	27	71.9 Å²	71.9	14%	0.144	36%	0.359	C	S	.	.	H	α-helix	trans	-68.5	-39.1	175.5	-178.5	61.6	0	0	0	111.4	Y51 K52 R59 L71	Y51-N55 HydrophobicContact CE1-CB 4.31Å; Y51-N55 HydrophobicContact CE2-CB 4.42Å; Y51-N55 WeakPolarHBondContact O-CB 3.39Å; Y51-N55 PolarHBondContact O-N 3.12Å; K52-N55 PolarHBondContact O-N 3.13Å; N55-R59 WeakPolarHBondContact O-CG 3.24Å; N55-R59 PolarHBondContact O-N 2.85Å; N55-R59 VanDerWaalsContact O-N 3.07Å; N55-L71 HydrophobicContact CB-CB 4.14Å; N55-L71 WeakPolarHBondContact OD1-CB 3.4Å; N55-L71 PolarHBondContact OD1-N 3.01Å
56	E	87.7	Confident	79.7	Confident	89 Å²	89	70.5 Å²	70.5	42%	0.416	36%	0.355	S	S	.	.	H	α-helix	trans	-60.9	-47	169	-75.8	-176.9	-150.8	0	0	112.3	K52 Q53 F58 R59 K60	K52-E56 PolarHBondContact O-N 3.33Å; Q53-E56 PolarHBondContact O-N 2.64Å; E56-F58 VanDerWaalsContact C-N 3.34Å; E56-F58 PolarHBondContact O-N 2.73Å; E56-R59 CarbonylContact O-C 3.59Å; E56-R59 PolarHBondContact O-N 3.27Å; E56-R59 VanDerWaalsContact O-N 3.14Å; E56-K60 VanDerWaalsContact O-CG 3.28Å; E56-K60 WeakPolarHBondContact O-CG 3.44Å; E56-K60 PolarHBondContact O-N 3.27Å; E56-K60 IonicContact OE2-NZ 2.64Å; E56-K60 PolarHBondContact OE2-NZ 3.5Å
57	D	88.6	Confident	81.5	Confident	59 Å²	59	71.5 Å²	71.5	32%	0.316	36%	0.356	S	S	.	.	H	α-helix	trans	-68.5	-34.7	-177.2	-68.4	-15	0	0	0	111.6	Q53 R54 K60 L61	Q53-D57 WeakPolarHBondContact O-CB 3.22Å; Q53-D57 VanDerWaalsContact O-CG 3.24Å; Q53-D57 PolarHBondContact O-N 3.35Å; R54-D57 PolarHBondContact O-N 3.14Å; D57-K60 PolarHBondContact O-N 3.14Å; D57-K60 WeakPolarHBondContact OD1-CD 3.44Å; D57-K60 IonicContact OD1-NZ 2.68Å; D57-K60 PolarHBondContact OD1-NZ 3.14Å; D57-L61 WeakPolarHBondContact O-CB 3.36Å; D57-L61 VanDerWaalsContact O-CG 3.29Å; D57-L61 WeakPolarHBondContact O-CG 3.17Å; D57-L61 PolarHBondContact O-N 2.82Å
58	F	90.8	Very high	83.4	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.009	36%	0.357	C	S	.	.	H	α-helix	trans	-56.3	-49	166.2	168.8	-105.3	0	0	0	111.7	R54 E56 K60 L61 F62 L65 L71 Y90 C97	R54-F58 VanDerWaalsContact O-CB 3.28Å; R54-F58 WeakPolarHBondContact O-CB 3.27Å; R54-F58 PolarHBondContact O-N 3.49Å; E56-F58 VanDerWaalsContact C-N 3.34Å; E56-F58 PolarHBondContact O-N 2.73Å; F58-K60 VanDerWaalsContact C-N 3.35Å; F58-K60 PolarHBondContact O-N 3.35Å; F58-L61 PolarHBondContact O-N 3.41Å; F58-F62 AromaticContact CD2-CD2 3.48Å; F58-F62 HydrophobicContact CD2-CD2 3.48Å; F58-F62 VanDerWaalsContact CD2-CD2 3.48Å; F58-F62 AromaticContact CD2-CE2 3.94Å; F58-F62 HydrophobicContact CD2-CE2 3.94Å; F58-F62 HydrophobicContact CD2-CG 4.49Å; F58-F62 AromaticContact CE2-CD2 3.68Å; F58-F62 HydrophobicContact CE2-CD2 3.68Å; F58-F62 HydrophobicContact CE2-CE2 4.23Å; F58-F62 HydrophobicContact CE2-CG 4.34Å; F58-F62 HydrophobicContact CG-CD2 4.37Å; F58-F62 WeakPolarHBondContact O-CD2 3.28Å; F58-F62 PolarHBondContact O-N 3.03Å; F58-L65 HydrophobicContact CE1-CD1 4.15Å; F58-L65 HydrophobicContact CE2-CD1 4.06Å; F58-L65 HydrophobicContact CZ-CD1 3.46Å; F58-L65 VanDerWaalsContact CZ-CD1 3.46Å; F58-L71 HydrophobicContact CB-CB 4.41Å; F58-L71 HydrophobicContact CB-CD2 4.24Å; F58-L71 HydrophobicContact CD1-CB 3.97Å; F58-L71 HydrophobicContact CD2-CD1 4.18Å; F58-L71 HydrophobicContact CE1-CB 4.5Å; F58-L71 HydrophobicContact CG-CB 4.2Å; F58-L71 HydrophobicContact CG-CD1 4.22Å; F58-Y90 HydrophobicContact CB-CD1 4.35Å; F58-Y90 AromaticContact CD2-CD1 3.97Å; F58-Y90 HydrophobicContact CD2-CD1 3.97Å; F58-Y90 AromaticContact CD2-CG 3.89Å; F58-Y90 HydrophobicContact CD2-CG 3.89Å; F58-Y90 HydrophobicContact CE2-CG 4.48Å; F58-C97 HydrophobicContact CE2-CB 4.19Å
59	R	88.4	Confident	85.3	Confident	89 Å²	89	67.5 Å²	67.5	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-65.5	-33.3	176.1	-72	-179	175.3	-127.2	-3.5	113.2	N55 E56 D67 E69	N55-R59 WeakPolarHBondContact O-CG 3.24Å; N55-R59 PolarHBondContact O-N 2.85Å; N55-R59 VanDerWaalsContact O-N 3.07Å; E56-R59 CarbonylContact O-C 3.59Å; E56-R59 PolarHBondContact O-N 3.27Å; E56-R59 VanDerWaalsContact O-N 3.14Å; R59-D67 VanDerWaalsContact CZ-O 3.22Å; R59-D67 PolarHBondContact NH1-O 3.2Å; R59-D67 IonicContact NH1-OD1 2.73Å; R59-D67 PolarHBondContact NH2-O 2.88Å; R59-E69 PolarHBondContact NH2-O 2.98Å
60	K	88.9	Confident	86.2	Confident	106 Å²	106	67.1 Å²	67.1	46%	0.461	33%	0.325	S	S	.	.	H	α-helix	trans	-67.8	-35.4	174.1	-68.2	163.2	-153.7	156.1	0	112.2	E56 D57 F58 K63	E56-K60 VanDerWaalsContact O-CG 3.28Å; E56-K60 WeakPolarHBondContact O-CG 3.44Å; E56-K60 PolarHBondContact O-N 3.27Å; E56-K60 IonicContact OE2-NZ 2.64Å; E56-K60 PolarHBondContact OE2-NZ 3.5Å; D57-K60 PolarHBondContact O-N 3.14Å; D57-K60 WeakPolarHBondContact OD1-CD 3.44Å; D57-K60 IonicContact OD1-NZ 2.68Å; D57-K60 PolarHBondContact OD1-NZ 3.14Å; F58-K60 VanDerWaalsContact C-N 3.35Å; F58-K60 PolarHBondContact O-N 3.35Å; K60-K63 WeakPolarHBondContact O-CE 3.24Å
61	L	89.8	Confident	86.8	Confident	45 Å²	45	64.9 Å²	64.9	24%	0.236	31%	0.312	C	S	.	.	H	α-helix	trans	-76.9	-46.9	177.1	-71.3	170.7	0	0	0	112.4	D57 F58 Y90 Y99	D57-L61 WeakPolarHBondContact O-CB 3.36Å; D57-L61 VanDerWaalsContact O-CG 3.29Å; D57-L61 WeakPolarHBondContact O-CG 3.17Å; D57-L61 PolarHBondContact O-N 2.82Å; F58-L61 PolarHBondContact O-N 3.41Å; L61-Y90 HydrophobicContact CD1-CE2 4.38Å; L61-Y99 HydrophobicContact CD1-CD1 3.94Å; L61-Y99 HydrophobicContact CD1-CE1 4.37Å; L61-Y99 HydrophobicContact CD1-CG 4.08Å; L61-Y99 HydrophobicContact CD2-CD1 4.1Å; L61-Y99 HydrophobicContact CD2-CD2 3.83Å; L61-Y99 HydrophobicContact CD2-CE1 3.95Å; L61-Y99 HydrophobicContact CD2-CE2 3.65Å; L61-Y99 HydrophobicContact CD2-CG 4.02Å
62	F	90.4	Very high	87	Confident	10 Å²	10	64.7 Å²	64.7	4%	0.044	31%	0.311	C	S	.	.			trans	-108	51	-169.5	-59.2	-77.3	0	0	0	113.2	F58 Q64 L65 Y90 C97 L108 T110	F58-F62 AromaticContact CD2-CD2 3.48Å; F58-F62 HydrophobicContact CD2-CD2 3.48Å; F58-F62 VanDerWaalsContact CD2-CD2 3.48Å; F58-F62 AromaticContact CD2-CE2 3.94Å; F58-F62 HydrophobicContact CD2-CE2 3.94Å; F58-F62 HydrophobicContact CD2-CG 4.49Å; F58-F62 AromaticContact CE2-CD2 3.68Å; F58-F62 HydrophobicContact CE2-CD2 3.68Å; F58-F62 HydrophobicContact CE2-CE2 4.23Å; F58-F62 HydrophobicContact CE2-CG 4.34Å; F58-F62 HydrophobicContact CG-CD2 4.37Å; F58-F62 WeakPolarHBondContact O-CD2 3.28Å; F58-F62 PolarHBondContact O-N 3.03Å; F62-Q64 PolarHBondContact O-N 3.22Å; F62-L65 HydrophobicContact CB-CD1 3.62Å; F62-L65 HydrophobicContact CB-CG 3.98Å; F62-L65 HydrophobicContact CG-CD1 4.4Å; F62-L65 PolarHBondContact O-N 3.06Å; F62-Y90 AromaticContact CE2-CD2 3.65Å; F62-Y90 HydrophobicContact CE2-CD2 3.65Å; F62-Y90 HydrophobicContact CE2-CE2 4.07Å; F62-Y90 HydrophobicContact CE2-CG 4.14Å; F62-Y90 HydrophobicContact CZ-CD2 4.07Å; F62-Y90 HydrophobicContact CZ-CE2 4.49Å; F62-C97 HydrophobicContact CD1-CB 3.95Å; F62-C97 HydrophobicContact CD2-CB 4.17Å; F62-C97 HydrophobicContact CE1-CB 3.66Å; F62-C97 HydrophobicContact CE2-CB 3.9Å; F62-C97 HydrophobicContact CG-CB 4.2Å; F62-C97 HydrophobicContact CZ-CB 3.63Å; F62-L108 HydrophobicContact CD1-CD2 3.88Å; F62-L108 HydrophobicContact CE1-CD2 3.38Å; F62-L108 HydrophobicContact CZ-CD2 3.88Å; F62-T110 HydrophobicContact CD1-CG2 3.63Å; F62-T110 HydrophobicContact CE1-CG2 4.03Å
63	K	84.3	Confident	87.3	Confident	175 Å²	175	61.9 Å²	61.9	76%	0.761	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	3.1	179	-57.2	179.9	-177.1	177.2	0	116.4	K60	K60-K63 WeakPolarHBondContact O-CE 3.24Å
64	Q	83.6	Confident	87.7	Confident	170 Å²	170	58.5 Å²	58.5	79%	0.794	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-8.3	179	-58.3	179.9	47.9	0	0	112.2	F62	F62-Q64 PolarHBondContact O-N 3.22Å
65	L	87.3	Confident	88	Confident	24 Å²	24	57.5 Å²	57.5	13%	0.126	28%	0.28	C	S	.	.	S	Bend	trans	-82.5	154.3	176.7	-60.6	177.3	0	0	0	111.1	F58 F62 E69 W95	F58-L65 HydrophobicContact CE1-CD1 4.15Å; F58-L65 HydrophobicContact CE2-CD1 4.06Å; F58-L65 HydrophobicContact CZ-CD1 3.46Å; F58-L65 VanDerWaalsContact CZ-CD1 3.46Å; F62-L65 HydrophobicContact CB-CD1 3.62Å; F62-L65 HydrophobicContact CB-CG 3.98Å; F62-L65 HydrophobicContact CG-CD1 4.4Å; F62-L65 PolarHBondContact O-N 3.06Å; L65-E69 HydrophobicContact CB-CG 4.39Å; L65-W95 HydrophobicContact CD2-CB 4.19Å; L65-W95 HydrophobicContact CD2-CD2 3.59Å; L65-W95 HydrophobicContact CD2-CE3 4Å; L65-W95 HydrophobicContact CD2-CG 3.67Å
66	P	87	Confident	88.2	Confident	64 Å²	64	60 Å²	60	42%	0.416	30%	0.3	S	S	.	.			trans	-59.2	143.8	170.5	-22.9	34	0	0	0	112.6	T68 E69	P66-T68 PolarHBondContact O-N 3.36Å; P66-E69 HydrophobicContact CB-CG 4.46Å; P66-E69 HydrophobicContact CG-CG 4.49Å; P66-E69 WeakPolarHBondContact O-CB 3.44Å; P66-E69 PolarHBondContact O-N 3.24Å
67	D	78.9	Confident	88.5	Confident	141 Å²	141	55.9 Å²	55.9	75%	0.754	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-12.3	176.8	-74.7	-61.8	0	0	0	114.4	R59	R59-D67 VanDerWaalsContact CZ-O 3.22Å; R59-D67 PolarHBondContact NH1-O 3.2Å; R59-D67 IonicContact NH1-OD1 2.73Å; R59-D67 PolarHBondContact NH2-O 2.88Å
68	T	81.7	Confident	88.7	Confident	106 Å²	106	53.3 Å²	53.3	65%	0.65	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-22.3	171.8	53.7	0	0	0	0	113.2	P66 R70	P66-T68 PolarHBondContact O-N 3.36Å; T68-R70 PolarHBondContact O-N 2.96Å
69	E	86.8	Confident	88.8	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.028	27%	0.268	C	S	.	.			trans	-72	121	-177	-65.5	-66.4	142.8	0	0	111.5	R59 L65 P66 S92 E93 N94 W95	R59-E69 PolarHBondContact NH2-O 2.98Å; L65-E69 HydrophobicContact CB-CG 4.39Å; P66-E69 HydrophobicContact CB-CG 4.46Å; P66-E69 HydrophobicContact CG-CG 4.49Å; P66-E69 WeakPolarHBondContact O-CB 3.44Å; P66-E69 PolarHBondContact O-N 3.24Å; E69-S92 WeakPolarHBondContact OE2-CB 3.46Å; E69-S92 PolarHBondContact OE2-OG 3.09Å; E69-E93 PolarHBondContact OE2-N 3.1Å; E69-N94 WeakPolarHBondContact OE1-CB 3.32Å; E69-N94 PolarHBondContact OE1-ND2 3.07Å; E69-N94 PolarHBondContact OE2-N 3.34Å; E69-N94 VanDerWaalsContact OE2-N 3.08Å; E69-W95 VanDerWaalsContact CD-CD1 3.5Å
70	R	86.9	Confident	88.8	Confident	43 Å²	43	52.6 Å²	52.6	16%	0.162	27%	0.268	C	S	.	.			trans	-108	140	177.1	-175	175.4	-89.4	118.6	-13.2	109.5	Y51 T68 I72 S92 L174 E193 D194	Y51-R70 VanDerWaalsContact OH-CG 3.28Å; Y51-R70 WeakPolarHBondContact OH-CG 3.46Å; T68-R70 PolarHBondContact O-N 2.96Å; R70-I72 PolarHBondContact O-N 3.16Å; R70-S92 WeakPolarHBondContact O-CA 3.46Å; R70-S92 WeakPolarHBondContact O-CB 3.29Å; R70-L174 HydrophobicContact CB-CD1 4.43Å; R70-L174 HydrophobicContact CG-CD2 4.31Å; R70-E193 PolarHBondContact NH2-O 2.83Å; R70-D194 IonicContact CZ-OD2 3.22Å; R70-D194 VanDerWaalsContact CZ-OD2 3.22Å; R70-D194 IonicContact NH1-OD2 3.26Å; R70-D194 PolarHBondContact NH1-OD2 2.9Å; R70-D194 IonicContact NH2-OD2 2.82Å; R70-D194 PolarHBondContact NH2-OD2 3.38Å
71	L	91.1	Very high	88.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.265	C	S	.	.			trans	-66.1	128.1	176.5	177.1	64.3	0	0	0	109.6	Y51 R54 N55 F58 Y90	Y51-L71 HydrophobicContact CE2-CB 4.34Å; Y51-L71 HydrophobicContact CE2-CG 4.44Å; Y51-L71 WeakPolarHBondContact CE2-O 3.17Å; Y51-L71 PolarHBondContact OH-O 2.99Å; R54-L71 HydrophobicContact CB-CD2 3.9Å; N55-L71 HydrophobicContact CB-CB 4.14Å; N55-L71 WeakPolarHBondContact OD1-CB 3.4Å; N55-L71 PolarHBondContact OD1-N 3.01Å; F58-L71 HydrophobicContact CB-CB 4.41Å; F58-L71 HydrophobicContact CB-CD2 4.24Å; F58-L71 HydrophobicContact CD1-CB 3.97Å; F58-L71 HydrophobicContact CD2-CD1 4.18Å; F58-L71 HydrophobicContact CE1-CB 4.5Å; F58-L71 HydrophobicContact CG-CB 4.2Å; F58-L71 HydrophobicContact CG-CD1 4.22Å; L71-Y90 HydrophobicContact CD1-CD1 3.88Å; L71-Y90 HydrophobicContact CD1-CG 4.43Å; L71-Y90 HydrophobicContact CD2-CD1 4.48Å
72	I	90.4	Very high	88.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.296	C	S	.	.			trans	-96.4	-47.8	174.9	-58.2	176.2	0	0	0	110	R70 L91 E93 L159 L169 L174 F177	R70-I72 PolarHBondContact O-N 3.16Å; I72-L91 PolarHBondContact N-O 2.95Å; I72-E93 HydrophobicContact CD1-CG 4.04Å; I72-L159 HydrophobicContact CD1-CD1 4.19Å; I72-L159 HydrophobicContact CD1-CD2 3.55Å; I72-L169 HydrophobicContact CD1-CD1 3.72Å; I72-L174 HydrophobicContact CG1-CD1 4.29Å; I72-L174 HydrophobicContact CG1-CG 4.42Å; I72-F177 HydrophobicContact CG2-CB 3.9Å
73	V	91.3	Very high	88.1	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.03	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	149.7	-179.4	60.2	0	0	0	0	112.1	Y75 L91 M155 C181 Y182	V73-Y75 HydrophobicContact CB-CE2 4.36Å; V73-Y75 HydrophobicContact CG1-CD2 4.29Å; V73-Y75 HydrophobicContact CG1-CE2 3.49Å; V73-Y75 VanDerWaalsContact CG1-CE2 3.49Å; V73-Y75 HydrophobicContact CG2-CD1 4.37Å; V73-Y75 HydrophobicContact CG2-CD2 4.39Å; V73-Y75 HydrophobicContact CG2-CE1 3.86Å; V73-Y75 HydrophobicContact CG2-CE2 3.9Å; V73-L91 HydrophobicContact CG1-CB 4.06Å; V73-L91 HydrophobicContact CG1-CD1 3.87Å; V73-L91 HydrophobicContact CG1-CG 4.17Å; V73-L91 PolarHBondContact O-N 3.41Å; V73-M155 HydrophobicContact CG1-CG 3.98Å; V73-C181 HydrophobicContact CB-CB 4.34Å; V73-C181 HydrophobicContact CG2-CB 4.01Å; V73-C181 VanDerWaalsContact CG2-SG 3.59Å; V73-Y182 WeakPolarHBondContact CA-OH 3.25Å
74	D	92.8	Very high	88.2	Confident	16 Å²	16	58.8 Å²	58.8	9%	0.086	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.4	168.5	79.9	-81	0	0	0	112.7	R54 R88 L89 Y90 Y182	R54-D74 VanDerWaalsContact CD-OD1 3.22Å; R54-D74 WeakPolarHBondContact CD-OD1 3.44Å; R54-D74 IonicContact CZ-OD1 2.82Å; R54-D74 IonicContact NE-OD1 2.76Å; R54-D74 VanDerWaalsContact NH1-CG 3.33Å; R54-D74 IonicContact NH1-OD1 2.74Å; R54-D74 PolarHBondContact NH1-OD1 3.38Å; R54-D74 IonicContact NH1-OD2 3.22Å; R54-D74 PolarHBondContact NH1-OD2 3.49Å; R54-D74 VanDerWaalsContact NH1-OD2 3.1Å; D74-R88 WeakPolarHBondContact OD2-CD 3.36Å; D74-R88 IonicContact OD2-CZ 3.93Å; D74-R88 IonicContact OD2-NE 2.81Å; D74-R88 IonicContact OD2-NH1 3.67Å; D74-R88 PolarHBondContact OD2-NH1 3.11Å; D74-L89 CarbonylContact C-O 3.51Å; D74-L89 VanDerWaalsContact CA-O 3.27Å; D74-L89 WeakPolarHBondContact CA-O 3.48Å; D74-Y90 HydrophobicContact CB-CD1 3.63Å; D74-Y90 HydrophobicContact CB-CE1 3.83Å; D74-Y90 HydrophobicContact CB-CG 4.32Å; D74-Y182 PolarHBondContact N-OH 2.91Å; D74-Y182 WeakPolarHBondContact OD1-CE1 3.38Å; D74-Y182 PolarHBondContact OD1-OH 2.89Å
75	Y	93.5	Very high	88.6	Confident	31 Å²	31	51.7 Å²	51.7	12%	0.122	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.9	-179.3	-61.8	-70.6	0	0	0	111.1	V73 C77 R88 L89 L91 T152	V73-Y75 HydrophobicContact CB-CE2 4.36Å; V73-Y75 HydrophobicContact CG1-CD2 4.29Å; V73-Y75 HydrophobicContact CG1-CE2 3.49Å; V73-Y75 VanDerWaalsContact CG1-CE2 3.49Å; V73-Y75 HydrophobicContact CG2-CD1 4.37Å; V73-Y75 HydrophobicContact CG2-CD2 4.39Å; V73-Y75 HydrophobicContact CG2-CE1 3.86Å; V73-Y75 HydrophobicContact CG2-CE2 3.9Å; Y75-C77 PolarHBondContact O-N 3.17Å; Y75-R88 WeakPolarHBondContact O-CA 3.37Å; Y75-L89 PolarHBondContact N-O 3.38Å; Y75-L89 PolarHBondContact O-N 3.36Å; Y75-L91 HydrophobicContact CD2-CD1 4.31Å; Y75-L91 HydrophobicContact CE2-CD1 3.77Å; Y75-L91 HydrophobicContact CE2-CG 4.45Å; Y75-T152 HydrophobicContact CD1-CG2 4.36Å; Y75-T152 WeakPolarHBondContact CD1-OG1 3.29Å; Y75-T152 HydrophobicContact CD2-CG2 3.46Å; Y75-T152 VanDerWaalsContact CD2-CG2 3.46Å; Y75-T152 WeakPolarHBondContact CE1-OG1 3.33Å; Y75-T152 HydrophobicContact CE2-CG2 3.63Å; Y75-T152 HydrophobicContact CG-CG2 3.85Å
76	S	92.2	Very high	88.7	Confident	78 Å²	78	57.7 Å²	57.7	55%	0.545	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.6	166.7	-56.8	0	0	0	0	110.7
77	C	93.8	Very high	89.1	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.027	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	-179	176.5	73.2	0	0	0	0	110.8	Y75 G87 F98 T144 F146	Y75-C77 PolarHBondContact O-N 3.17Å; C77-G87 PolarHBondContact N-O 3.45Å; C77-G87 CarbonylContact O-C 3.49Å; C77-G87 PolarHBondContact O-N 3.26Å; C77-F98 VanDerWaalsContact SG-CE2 3.59Å; C77-T144 CarbonylContact C-O 3.56Å; C77-T144 WeakPolarHBondContact CA-O 3.44Å; C77-T144 VanDerWaalsContact CB-O 3.31Å; C77-T144 WeakPolarHBondContact CB-O 3.22Å; C77-F146 HydrophobicContact CB-CD1 3.66Å; C77-F146 HydrophobicContact CB-CE1 3.44Å; C77-F146 VanDerWaalsContact CB-CE1 3.44Å; C77-F146 HydrophobicContact CB-CE2 4.42Å; C77-F146 HydrophobicContact CB-CG 4.25Å; C77-F146 HydrophobicContact CB-CZ 3.87Å
78	A	92.8	Very high	89.8	Confident	5 Å²	5	53 Å²	53	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.1	169.1	0	0	0	0	0	111.1	L84 L85 Q86 F143 T144	A78-L84 HydrophobicContact CB-CD2 4.13Å; A78-L85 CarbonylContact C-O 3.6Å; A78-L85 WeakPolarHBondContact CA-O 3.46Å; A78-Q86 HydrophobicContact CB-CB 4.36Å; A78-F143 CarbonylContact O-C 3.47Å; A78-F143 WeakPolarHBondContact O-CA 3.25Å; A78-T144 PolarHBondContact N-O 2.95Å; A78-T144 PolarHBondContact O-N 3.38Å; A78-T144 PolarHBondContact O-OG1 3.16Å
79	L	92.9	Very high	90.4	Very high	1 Å²	1	48 Å²	48	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.1	172.5	174.4	62.1	0	0	0	109.3	R81 L85 F98 L109 H141 F143	L79-R81 HydrophobicContact CD2-CG 4.49Å; L79-R81 HydrophobicContact CG-CG 4.36Å; L79-R81 PolarHBondContact O-N 3.3Å; L79-L85 HydrophobicContact CB-CB 4.39Å; L79-L85 PolarHBondContact N-O 3.25Å; L79-L85 PolarHBondContact O-N 3.15Å; L79-F98 HydrophobicContact CB-CD1 4.08Å; L79-F98 HydrophobicContact CB-CE1 3.61Å; L79-F98 HydrophobicContact CB-CE2 4.31Å; L79-F98 HydrophobicContact CB-CZ 3.76Å; L79-F98 HydrophobicContact CD2-CD1 3.96Å; L79-F98 HydrophobicContact CD2-CE1 4.08Å; L79-L109 HydrophobicContact CD2-CD2 3.83Å; L79-H141 HydrophobicContact CD1-CB 4.21Å; L79-F143 HydrophobicContact CB-CD1 4.2Å; L79-F143 HydrophobicContact CB-CE1 4.3Å; L79-F143 HydrophobicContact CD1-CD1 3.98Å; L79-F143 HydrophobicContact CD1-CE1 3.83Å; L79-F143 HydrophobicContact CD1-CZ 4.26Å; L79-F143 HydrophobicContact CG-CE1 4.48Å
80	Q	89.4	Confident	90.8	Very high	75 Å²	75	48.7 Å²	48.7	35%	0.35	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.9	172	-178.1	74.8	71.4	0	0	109.6	L84 F142 T144	Q80-L84 HydrophobicContact CB-CD2 4.12Å; Q80-L84 VanDerWaalsContact OE1-CD2 3.31Å; Q80-F142 HydrophobicContact CB-CB 4.19Å; Q80-F142 HydrophobicContact CB-CD1 3.77Å; Q80-F142 HydrophobicContact CB-CG 4.45Å; Q80-F142 WeakPolarHBondContact CB-O 3.28Å; Q80-F142 HydrophobicContact CG-CD1 4.22Å; Q80-F142 PolarHBondContact N-O 3.04Å; Q80-T144 HydrophobicContact CB-CG2 4.22Å
81	R	85.9	Confident	91.1	Very high	100 Å²	100	46.7 Å²	46.7	38%	0.377	23%	0.234	S	C	.	.	S	Bend	trans	-118.9	-139.8	158.3	-72.7	179.6	164.2	162.2	-6.6	107	L79 I83	L79-R81 HydrophobicContact CD2-CG 4.49Å; L79-R81 HydrophobicContact CG-CG 4.36Å; L79-R81 PolarHBondContact O-N 3.3Å; R81-I83 CarbonylContact C-O 3.59Å; R81-I83 PolarHBondContact N-O 3.13Å; R81-I83 PolarHBondContact O-N 3.33Å
82	D	82.4	Confident	91.2	Very high	168 Å²	168	46.7 Å²	46.7	90%	0.898	23%	0.234	S	C	*	.	S	Bend	trans	-57.2	-28.1	172	-47.4	-63	0	0	0	112.4
83	I	85.4	Confident	91.2	Very high	113 Å²	113	48.5 Å²	48.5	58%	0.579	24%	0.243	S	C	*	.	S	Bend	trans	-128.8	165	170.2	60.8	171.4	0	0	0	110.6	R81 L85	R81-I83 CarbonylContact C-O 3.59Å; R81-I83 PolarHBondContact N-O 3.13Å; R81-I83 PolarHBondContact O-N 3.33Å; I83-L85 HydrophobicContact CD1-CD2 3.76Å; I83-L85 HydrophobicContact CG1-CD2 3.82Å; I83-L85 HydrophobicContact CG1-CG 4.29Å; I83-L85 PolarHBondContact O-N 3Å
84	L	85.9	Confident	91.1	Very high	85 Å²	85	50.8 Å²	50.8	45%	0.445	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	106.2	170.7	-80.4	167.8	0	0	0	110.4	A78 Q80 Q86 T144	A78-L84 HydrophobicContact CB-CD2 4.13Å; Q80-L84 HydrophobicContact CB-CD2 4.12Å; Q80-L84 VanDerWaalsContact OE1-CD2 3.31Å; L84-Q86 PolarHBondContact O-N 2.75Å; L84-T144 HydrophobicContact CD2-CG2 4.16Å; L84-T144 WeakPolarHBondContact CD2-OG1 3.41Å
85	L	91.7	Very high	91.2	Very high	20 Å²	20	52 Å²	52	11%	0.105	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	90.5	175.5	-60.9	175	0	0	0	109.3	A78 L79 I83 G87 F98 I102 T107	A78-L85 CarbonylContact C-O 3.6Å; A78-L85 WeakPolarHBondContact CA-O 3.46Å; L79-L85 HydrophobicContact CB-CB 4.39Å; L79-L85 PolarHBondContact N-O 3.25Å; L79-L85 PolarHBondContact O-N 3.15Å; I83-L85 HydrophobicContact CD1-CD2 3.76Å; I83-L85 HydrophobicContact CG1-CD2 3.82Å; I83-L85 HydrophobicContact CG1-CG 4.29Å; I83-L85 PolarHBondContact O-N 3Å; L85-G87 PolarHBondContact O-N 3.04Å; L85-F98 VanDerWaalsContact O-CZ 3.29Å; L85-F98 WeakPolarHBondContact O-CZ 3.42Å; L85-I102 HydrophobicContact CD2-CD1 4.42Å; L85-T107 HydrophobicContact CD1-CG2 4Å
86	Q	90.8	Very high	91.2	Very high	151 Å²	151	50.8 Å²	50.8	71%	0.706	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	125.5	171.7	-178.8	174.9	-28.3	0	0	112.2	A78 L84 S100 I102	A78-Q86 HydrophobicContact CB-CB 4.36Å; L84-Q86 PolarHBondContact O-N 2.75Å; Q86-S100 PolarHBondContact O-OG 2.87Å; Q86-I102 HydrophobicContact CB-CD1 4.24Å
87	G	93.7	Very high	91.4	Very high	17 Å²	17	47 Å²	47	18%	0.175	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	-146.6	-176.8	0	0	0	0	0	112.9	C77 L85 Y99	C77-G87 PolarHBondContact N-O 3.45Å; C77-G87 CarbonylContact O-C 3.49Å; C77-G87 PolarHBondContact O-N 3.26Å; L85-G87 PolarHBondContact O-N 3.04Å; G87-Y99 CarbonylContact C-O 3.46Å; G87-Y99 VanDerWaalsContact CA-O 3.3Å; G87-Y99 WeakPolarHBondContact CA-O 3.39Å
88	R	93.8	Very high	91.5	Very high	89 Å²	89	46.9 Å²	46.9	34%	0.336	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137	175.8	-69.7	-172	-179.6	-160.5	3.5	112	D74 Y75 Y90 F98 Y99	D74-R88 WeakPolarHBondContact OD2-CD 3.36Å; D74-R88 IonicContact OD2-CZ 3.93Å; D74-R88 IonicContact OD2-NE 2.81Å; D74-R88 IonicContact OD2-NH1 3.67Å; D74-R88 PolarHBondContact OD2-NH1 3.11Å; Y75-R88 WeakPolarHBondContact O-CA 3.37Å; R88-Y90 HydrophobicContact CB-CD2 4.33Å; R88-Y90 HydrophobicContact CB-CE2 3.63Å; R88-F98 WeakPolarHBondContact O-CA 3.41Å; R88-F98 VanDerWaalsContact O-CD2 3.25Å; R88-F98 WeakPolarHBondContact O-CD2 3.28Å; R88-Y99 PolarHBondContact N-O 3.24Å; R88-Y99 PolarHBondContact O-N 2.86Å
89	L	95	Very high	91.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	127.7	167.2	-164.3	74.5	0	0	0	108.5	D74 Y75 L91 I96 C97 F98 F143 F146 T152 M156	D74-L89 CarbonylContact C-O 3.51Å; D74-L89 VanDerWaalsContact CA-O 3.27Å; D74-L89 WeakPolarHBondContact CA-O 3.48Å; Y75-L89 PolarHBondContact N-O 3.38Å; Y75-L89 PolarHBondContact O-N 3.36Å; L89-L91 HydrophobicContact CD2-CD2 4.11Å; L89-L91 HydrophobicContact CG-CD2 4.19Å; L89-I96 HydrophobicContact CD1-CG2 3.55Å; L89-I96 HydrophobicContact CD2-CG2 4.42Å; L89-I96 HydrophobicContact CG-CG2 4.14Å; L89-C97 CarbonylContact C-O 3.5Å; L89-C97 WeakPolarHBondContact CA-O 3.45Å; L89-F98 HydrophobicContact CD1-CB 4.1Å; L89-F98 HydrophobicContact CD1-CD2 4.37Å; L89-F143 HydrophobicContact CD1-CD1 4.07Å; L89-F143 HydrophobicContact CD1-CE1 3.69Å; L89-F143 HydrophobicContact CD1-CE2 4.45Å; L89-F143 HydrophobicContact CD1-CZ 3.9Å; L89-F146 HydrophobicContact CD2-CE1 4.03Å; L89-F146 HydrophobicContact CD2-CZ 4.15Å; L89-T152 HydrophobicContact CD2-CG2 4.47Å; L89-M156 HydrophobicContact CD2-CE 3.94Å; L89-M156 HydrophobicContact CD2-SD 3.79Å
90	Y	95.2	Very high	91.6	Very high	22 Å²	22	48.6 Å²	48.6	9%	0.086	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.3	174.4	-58.6	-98.8	0	0	0	107.8	F58 L61 F62 L71 D74 R88 C97	F58-Y90 HydrophobicContact CB-CD1 4.35Å; F58-Y90 AromaticContact CD2-CD1 3.97Å; F58-Y90 HydrophobicContact CD2-CD1 3.97Å; F58-Y90 AromaticContact CD2-CG 3.89Å; F58-Y90 HydrophobicContact CD2-CG 3.89Å; F58-Y90 HydrophobicContact CE2-CG 4.48Å; L61-Y90 HydrophobicContact CD1-CE2 4.38Å; F62-Y90 AromaticContact CE2-CD2 3.65Å; F62-Y90 HydrophobicContact CE2-CD2 3.65Å; F62-Y90 HydrophobicContact CE2-CE2 4.07Å; F62-Y90 HydrophobicContact CE2-CG 4.14Å; F62-Y90 HydrophobicContact CZ-CD2 4.07Å; F62-Y90 HydrophobicContact CZ-CE2 4.49Å; L71-Y90 HydrophobicContact CD1-CD1 3.88Å; L71-Y90 HydrophobicContact CD1-CG 4.43Å; L71-Y90 HydrophobicContact CD2-CD1 4.48Å; D74-Y90 HydrophobicContact CB-CD1 3.63Å; D74-Y90 HydrophobicContact CB-CE1 3.83Å; D74-Y90 HydrophobicContact CB-CG 4.32Å; R88-Y90 HydrophobicContact CB-CD2 4.33Å; R88-Y90 HydrophobicContact CB-CE2 3.63Å; Y90-C97 PolarHBondContact N-O 3.3Å; Y90-C97 PolarHBondContact O-N 2.92Å
91	L	94.1	Very high	91.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.2	176.6	-54.2	-177	0	0	0	109.7	I72 V73 Y75 L89 I96 M155 M156 L159	I72-L91 PolarHBondContact N-O 2.95Å; V73-L91 HydrophobicContact CG1-CB 4.06Å; V73-L91 HydrophobicContact CG1-CD1 3.87Å; V73-L91 HydrophobicContact CG1-CG 4.17Å; V73-L91 PolarHBondContact O-N 3.41Å; Y75-L91 HydrophobicContact CD2-CD1 4.31Å; Y75-L91 HydrophobicContact CE2-CD1 3.77Å; Y75-L91 HydrophobicContact CE2-CG 4.45Å; L89-L91 HydrophobicContact CD2-CD2 4.11Å; L89-L91 HydrophobicContact CG-CD2 4.19Å; L91-I96 HydrophobicContact CD2-CB 4.29Å; L91-I96 HydrophobicContact CD2-CG1 4.06Å; L91-I96 HydrophobicContact CD2-CG2 3.93Å; L91-M155 HydrophobicContact CD1-CB 4.31Å; L91-M155 HydrophobicContact CD1-CG 3.8Å; L91-M156 HydrophobicContact CD1-CG 3.62Å; L91-M156 HydrophobicContact CD2-CG 3.94Å; L91-M156 HydrophobicContact CG-CG 4.46Å; L91-L159 HydrophobicContact CB-CD1 3.84Å; L91-L159 HydrophobicContact CD1-CD1 4.03Å
92	S	92.3	Very high	91.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.			trans	-114.6	-171.9	167.5	72.7	0	0	0	0	110	E69 R70 W95	E69-S92 WeakPolarHBondContact OE2-CB 3.46Å; E69-S92 PolarHBondContact OE2-OG 3.09Å; R70-S92 WeakPolarHBondContact O-CA 3.46Å; R70-S92 WeakPolarHBondContact O-CB 3.29Å; S92-W95 PolarHBondContact N-O 2.93Å; S92-W95 PolarHBondContact OG-N 3.02Å; S92-W95 PolarHBondContact OG-O 3.45Å
93	E	89.5	Confident	91.2	Very high	39 Å²	39	47.2 Å²	47.2	18%	0.182	23%	0.225	C	C	.	.	S	Bend	trans	-65.1	-41.3	-178.4	-69.1	179	-127.5	0	0	113.1	E69 I72 L113 L174	E69-E93 PolarHBondContact OE2-N 3.1Å; I72-E93 HydrophobicContact CD1-CG 4.04Å; E93-L113 VanDerWaalsContact O-CD1 3.32Å; E93-L113 WeakPolarHBondContact O-CD1 3.49Å; E93-L174 HydrophobicContact CG-CD1 3.88Å; E93-L174 WeakPolarHBondContact OE1-CD1 3.21Å
94	N	90.4	Very high	90.7	Very high	53 Å²	53	53 Å²	53	28%	0.283	24%	0.24	S	C	.	.	S	Bend	trans	-115.1	-3.6	-176.7	-59.1	-79.1	0	0	0	114.5	E69 R112 L113	E69-N94 WeakPolarHBondContact OE1-CB 3.32Å; E69-N94 PolarHBondContact OE1-ND2 3.07Å; E69-N94 PolarHBondContact OE2-N 3.34Å; E69-N94 VanDerWaalsContact OE2-N 3.08Å; N94-R112 WeakPolarHBondContact O-CG 3.44Å; N94-L113 WeakPolarHBondContact O-CB 3.28Å; N94-L113 PolarHBondContact O-N 2.86Å
95	W	93.8	Very high	90.5	Very high	42 Å²	42	58.6 Å²	58.6	16%	0.159	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	145.7	-172.3	-56.7	79.5	0	0	0	114.5	L65 E69 S92 V111 R112	L65-W95 HydrophobicContact CD2-CB 4.19Å; L65-W95 HydrophobicContact CD2-CD2 3.59Å; L65-W95 HydrophobicContact CD2-CE3 4Å; L65-W95 HydrophobicContact CD2-CG 3.67Å; E69-W95 VanDerWaalsContact CD-CD1 3.5Å; S92-W95 PolarHBondContact N-O 2.93Å; S92-W95 PolarHBondContact OG-N 3.02Å; S92-W95 PolarHBondContact OG-O 3.45Å; W95-V111 WeakPolarHBondContact CA-O 3.46Å; W95-R112 HydrophobicContact CD2-CB 4.12Å; W95-R112 HydrophobicContact CD2-CG 4.24Å; W95-R112 HydrophobicContact CE3-CB 3.77Å; W95-R112 HydrophobicContact CE3-CG 4.38Å; W95-R112 HydrophobicContact CH2-CB 4.04Å; W95-R112 HydrophobicContact CH2-CG 4.38Å; W95-R112 HydrophobicContact CZ2-CB 4.36Å; W95-R112 HydrophobicContact CZ2-CG 4.22Å; W95-R112 HydrophobicContact CZ3-CB 3.73Å; W95-R112 HydrophobicContact CZ3-CG 4.45Å
96	I	94.7	Very high	90.3	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.8	163.7	-54.4	-173	0	0	0	107.2	L89 L91 V111 L113 I116 V134 M156	L89-I96 HydrophobicContact CD1-CG2 3.55Å; L89-I96 HydrophobicContact CD2-CG2 4.42Å; L89-I96 HydrophobicContact CG-CG2 4.14Å; L91-I96 HydrophobicContact CD2-CB 4.29Å; L91-I96 HydrophobicContact CD2-CG1 4.06Å; L91-I96 HydrophobicContact CD2-CG2 3.93Å; I96-V111 PolarHBondContact N-O 3.45Å; I96-V111 PolarHBondContact O-N 3.17Å; I96-L113 HydrophobicContact CD1-CD2 3.64Å; I96-L113 HydrophobicContact CG1-CD2 3.47Å; I96-L113 VanDerWaalsContact CG1-CD2 3.47Å; I96-L113 HydrophobicContact CG1-CG 4.18Å; I96-I116 HydrophobicContact CD1-CD1 3.58Å; I96-I116 HydrophobicContact CG1-CD1 4.32Å; I96-V134 HydrophobicContact CD1-CG2 4.5Å; I96-M156 HydrophobicContact CD1-CE 3.82Å; I96-M156 HydrophobicContact CG2-CE 4.46Å
97	C	94.9	Very high	90.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	142.9	-176.8	-57.8	0	0	0	0	110	F58 F62 L89 Y90 L109 T110	F58-C97 HydrophobicContact CE2-CB 4.19Å; F62-C97 HydrophobicContact CD1-CB 3.95Å; F62-C97 HydrophobicContact CD2-CB 4.17Å; F62-C97 HydrophobicContact CE1-CB 3.66Å; F62-C97 HydrophobicContact CE2-CB 3.9Å; F62-C97 HydrophobicContact CG-CB 4.2Å; F62-C97 HydrophobicContact CZ-CB 3.63Å; L89-C97 CarbonylContact C-O 3.5Å; L89-C97 WeakPolarHBondContact CA-O 3.45Å; Y90-C97 PolarHBondContact N-O 3.3Å; Y90-C97 PolarHBondContact O-N 2.92Å; C97-L109 CarbonylContact C-O 3.51Å; C97-L109 WeakPolarHBondContact CA-O 3.23Å; C97-T110 HydrophobicContact CB-CG2 4.45Å
98	F	95.8	Very high	90.3	Very high	1 Å²	1	60.3 Å²	60.3	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.8	178.6	175.9	-94.3	0	0	0	110.5	C77 L79 L85 R88 L89 L108 L109 F143	C77-F98 VanDerWaalsContact SG-CE2 3.59Å; L79-F98 HydrophobicContact CB-CD1 4.08Å; L79-F98 HydrophobicContact CB-CE1 3.61Å; L79-F98 HydrophobicContact CB-CE2 4.31Å; L79-F98 HydrophobicContact CB-CZ 3.76Å; L79-F98 HydrophobicContact CD2-CD1 3.96Å; L79-F98 HydrophobicContact CD2-CE1 4.08Å; L85-F98 VanDerWaalsContact O-CZ 3.29Å; L85-F98 WeakPolarHBondContact O-CZ 3.42Å; R88-F98 WeakPolarHBondContact O-CA 3.41Å; R88-F98 VanDerWaalsContact O-CD2 3.25Å; R88-F98 WeakPolarHBondContact O-CD2 3.28Å; L89-F98 HydrophobicContact CD1-CB 4.1Å; L89-F98 HydrophobicContact CD1-CD2 4.37Å; F98-L108 WeakPolarHBondContact O-CA 3.15Å; F98-L109 HydrophobicContact CB-CB 4.26Å; F98-L109 PolarHBondContact N-O 3.15Å; F98-L109 PolarHBondContact O-N 2.54Å; F98-F143 HydrophobicContact CB-CE1 3.96Å; F98-F143 HydrophobicContact CD2-CD1 4.26Å; F98-F143 AromaticContact CD2-CE1 3.99Å; F98-F143 HydrophobicContact CD2-CE1 3.99Å; F98-F143 AromaticContact CG-CE1 3.95Å; F98-F143 HydrophobicContact CG-CE1 3.95Å
99	Y	94.9	Very high	90.2	Very high	41 Å²	41	57 Å²	57	16%	0.161	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.6	174.3	170.7	-104.3	0	0	0	110.5	L61 G87 R88 N101 E106 T107 L108	L61-Y99 HydrophobicContact CD1-CD1 3.94Å; L61-Y99 HydrophobicContact CD1-CE1 4.37Å; L61-Y99 HydrophobicContact CD1-CG 4.08Å; L61-Y99 HydrophobicContact CD2-CD1 4.1Å; L61-Y99 HydrophobicContact CD2-CD2 3.83Å; L61-Y99 HydrophobicContact CD2-CE1 3.95Å; L61-Y99 HydrophobicContact CD2-CE2 3.65Å; L61-Y99 HydrophobicContact CD2-CG 4.02Å; G87-Y99 CarbonylContact C-O 3.46Å; G87-Y99 VanDerWaalsContact CA-O 3.3Å; G87-Y99 WeakPolarHBondContact CA-O 3.39Å; R88-Y99 PolarHBondContact N-O 3.24Å; R88-Y99 PolarHBondContact O-N 2.86Å; Y99-N101 HydrophobicContact CE1-CB 4.09Å; Y99-N101 HydrophobicContact CE2-CB 4.42Å; Y99-N101 WeakPolarHBondContact OH-CB 3.48Å; Y99-N101 PolarHBondContact OH-ND2 2.75Å; Y99-N101 VanDerWaalsContact OH-ND2 3.15Å; Y99-E106 HydrophobicContact CE2-CB 4.21Å; Y99-E106 HydrophobicContact CE2-CG 4.24Å; Y99-E106 WeakPolarHBondContact CE2-OE1 3.49Å; Y99-E106 PolarHBondContact OH-OE1 2.91Å; Y99-T107 WeakPolarHBondContact CA-O 3.44Å; Y99-L108 HydrophobicContact CD2-CD2 3.65Å; Y99-L108 HydrophobicContact CD2-CG 4.18Å; Y99-L108 HydrophobicContact CG-CD2 4.31Å
100	S	93.6	Very high	90.1	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.007	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.3	174.5	157.9	0	0	0	0	108.7	Q86 E106 T107	Q86-S100 PolarHBondContact O-OG 2.87Å; S100-E106 CarbonylContact O-C 3.58Å; S100-E106 WeakPolarHBondContact O-CA 3.25Å; S100-T107 PolarHBondContact N-O 3.28Å; S100-T107 PolarHBondContact O-N 2.95Å
101	N	89.2	Confident	90.1	Very high	75 Å²	75	59 Å²	59	40%	0.401	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	105.3	172.2	-173.9	-21.6	0	0	0	108.6	Y99 R104 W105 E106	Y99-N101 HydrophobicContact CE1-CB 4.09Å; Y99-N101 HydrophobicContact CE2-CB 4.42Å; Y99-N101 WeakPolarHBondContact OH-CB 3.48Å; Y99-N101 PolarHBondContact OH-ND2 2.75Å; Y99-N101 VanDerWaalsContact OH-ND2 3.15Å; N101-R104 WeakPolarHBondContact OD1-CA 3.46Å; N101-W105 WeakPolarHBondContact CA-O 3.35Å; N101-E106 HydrophobicContact CB-CG 4.46Å; N101-E106 PolarHBondContact ND2-OE1 3.38Å; N101-E106 VanDerWaalsContact ND2-OE1 3.17Å
102	I	83.3	Confident	90	Very high	49 Å²	49	63.7 Å²	63.7	25%	0.251	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.8	-177.2	-50.5	173.5	0	0	0	107.3	L85 Q86 R104 W105	L85-I102 HydrophobicContact CD2-CD1 4.42Å; Q86-I102 HydrophobicContact CB-CD1 4.24Å; I102-R104 PolarHBondContact O-N 2.86Å; I102-R104 VanDerWaalsContact O-N 3.09Å; I102-W105 PolarHBondContact N-O 2.97Å; I102-W105 WeakPolarHBondContact O-CB 3.37Å; I102-W105 PolarHBondContact O-N 3.07Å
103	F	76.3	Confident	89.9	Confident	190 Å²	190	63.7 Å²	63.7	83%	0.833	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	28.6	-174.9	-52.9	-60.4	0	0	0	114.4	W105	F103-W105 VanDerWaalsContact C-N 3.3Å
104	R	76.3	Confident	89.8	Confident	233 Å²	233	66.1 Å²	66.1	88%	0.879	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	11.5	-171.9	-50.2	-177.1	179.2	-171.4	0.2	116.1	N101 I102	N101-R104 WeakPolarHBondContact OD1-CA 3.46Å; I102-R104 PolarHBondContact O-N 2.86Å; I102-R104 VanDerWaalsContact O-N 3.09Å
105	W	81.6	Confident	89.7	Confident	203 Å²	203	66.8 Å²	66.8	77%	0.769	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	108.6	170.9	-62.5	74.7	0	0	0	109.2	N101 I102 F103	N101-W105 WeakPolarHBondContact CA-O 3.35Å; I102-W105 PolarHBondContact N-O 2.97Å; I102-W105 WeakPolarHBondContact O-CB 3.37Å; I102-W105 PolarHBondContact O-N 3.07Å; F103-W105 VanDerWaalsContact C-N 3.3Å
106	E	88.1	Confident	89.5	Confident	121 Å²	121	65 Å²	65	57%	0.565	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	120.1	176.2	-58.2	-157.9	123.6	0	0	110.5	Y99 S100 N101	Y99-E106 HydrophobicContact CE2-CB 4.21Å; Y99-E106 HydrophobicContact CE2-CG 4.24Å; Y99-E106 WeakPolarHBondContact CE2-OE1 3.49Å; Y99-E106 PolarHBondContact OH-OE1 2.91Å; S100-E106 CarbonylContact O-C 3.58Å; S100-E106 WeakPolarHBondContact O-CA 3.25Å; N101-E106 HydrophobicContact CB-CG 4.46Å; N101-E106 PolarHBondContact ND2-OE1 3.38Å; N101-E106 VanDerWaalsContact ND2-OE1 3.17Å
107	T	90.1	Very high	88.9	Confident	27 Å²	27	67.9 Å²	67.9	17%	0.166	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.3	170.1	-60.1	0	0	0	0	108.8	L85 Y99 S100	L85-T107 HydrophobicContact CD1-CG2 4Å; Y99-T107 WeakPolarHBondContact CA-O 3.44Å; S100-T107 PolarHBondContact N-O 3.28Å; S100-T107 PolarHBondContact O-N 2.95Å
108	L	92.6	Very high	88.3	Confident	76 Å²	76	70.3 Å²	70.3	40%	0.398	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141.1	168	-70.8	162.5	0	0	0	109.1	F62 F98 Y99	F62-L108 HydrophobicContact CD1-CD2 3.88Å; F62-L108 HydrophobicContact CE1-CD2 3.38Å; F62-L108 HydrophobicContact CZ-CD2 3.88Å; F98-L108 WeakPolarHBondContact O-CA 3.15Å; Y99-L108 HydrophobicContact CD2-CD2 3.65Å; Y99-L108 HydrophobicContact CD2-CG 4.18Å; Y99-L108 HydrophobicContact CG-CD2 4.31Å
109	L	92.5	Very high	87.9	Confident	20 Å²	20	70.8 Å²	70.8	11%	0.105	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	133.4	171.2	169	65.4	0	0	0	108.2	L79 C97 F98 V111 H141 F143	L79-L109 HydrophobicContact CD2-CD2 3.83Å; C97-L109 CarbonylContact C-O 3.51Å; C97-L109 WeakPolarHBondContact CA-O 3.23Å; F98-L109 HydrophobicContact CB-CB 4.26Å; F98-L109 PolarHBondContact N-O 3.15Å; F98-L109 PolarHBondContact O-N 2.54Å; L109-V111 HydrophobicContact CD1-CG2 3.98Å; L109-V111 HydrophobicContact CG-CG2 4.16Å; L109-H141 HydrophobicContact CD2-CB 4.39Å; L109-F143 HydrophobicContact CD2-CE1 4.36Å; L109-F143 HydrophobicContact CD2-CZ 3.96Å
110	T	93.6	Very high	87.5	Confident	53 Å²	53	71.1 Å²	71.1	33%	0.325	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	117.9	-179.6	49.9	0	0	0	0	109.3	F62 C97	F62-T110 HydrophobicContact CD1-CG2 3.63Å; F62-T110 HydrophobicContact CE1-CG2 4.03Å; C97-T110 HydrophobicContact CB-CG2 4.45Å
111	V	93.7	Very high	87.4	Confident	10 Å²	10	74.8 Å²	74.8	6%	0.061	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.1	-177.9	-179	0	0	0	0	107.9	W95 I96 L109 I116 T136	W95-V111 WeakPolarHBondContact CA-O 3.46Å; I96-V111 PolarHBondContact N-O 3.45Å; I96-V111 PolarHBondContact O-N 3.17Å; L109-V111 HydrophobicContact CD1-CG2 3.98Å; L109-V111 HydrophobicContact CG-CG2 4.16Å; V111-I116 HydrophobicContact CG1-CD1 4.14Å; V111-I116 HydrophobicContact CG1-CG1 3.75Å; V111-T136 HydrophobicContact CG1-CG2 3.68Å
112	R	92.8	Very high	87.3	Confident	99 Å²	99	74.2 Å²	74.2	37%	0.374	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	138.5	174.4	-166.9	-171.1	-62.1	126.5	-5.8	109.1	N94 W95 K114 D115	N94-R112 WeakPolarHBondContact O-CG 3.44Å; W95-R112 HydrophobicContact CD2-CB 4.12Å; W95-R112 HydrophobicContact CD2-CG 4.24Å; W95-R112 HydrophobicContact CE3-CB 3.77Å; W95-R112 HydrophobicContact CE3-CG 4.38Å; W95-R112 HydrophobicContact CH2-CB 4.04Å; W95-R112 HydrophobicContact CH2-CG 4.38Å; W95-R112 HydrophobicContact CZ2-CB 4.36Å; W95-R112 HydrophobicContact CZ2-CG 4.22Å; W95-R112 HydrophobicContact CZ3-CB 3.73Å; W95-R112 HydrophobicContact CZ3-CG 4.45Å; R112-K114 VanDerWaalsContact C-N 3.3Å; R112-K114 HydrophobicContact CG-CB 4.48Å; R112-K114 PolarHBondContact O-N 2.76Å; R112-D115 HydrophobicContact CB-CB 4.28Å; R112-D115 WeakPolarHBondContact CD-OD1 3.48Å; R112-D115 IonicContact CZ-OD1 3.85Å; R112-D115 IonicContact CZ-OD2 3.53Å; R112-D115 VanDerWaalsContact NH1-CG 3.31Å; R112-D115 IonicContact NH1-OD1 2.7Å; R112-D115 PolarHBondContact NH1-OD1 2.9Å; R112-D115 IonicContact NH1-OD2 2.6Å; R112-D115 PolarHBondContact NH1-OD2 2.98Å; R112-D115 PolarHBondContact O-N 3.17Å
113	L	90	Very high	87.2	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-60.8	-37.7	-179.9	-72.2	166.7	0	0	0	112.4	E93 N94 I96 D115 I116 L159 W160 A163	E93-L113 VanDerWaalsContact O-CD1 3.32Å; E93-L113 WeakPolarHBondContact O-CD1 3.49Å; N94-L113 WeakPolarHBondContact O-CB 3.28Å; N94-L113 PolarHBondContact O-N 2.86Å; I96-L113 HydrophobicContact CD1-CD2 3.64Å; I96-L113 HydrophobicContact CG1-CD2 3.47Å; I96-L113 VanDerWaalsContact CG1-CD2 3.47Å; I96-L113 HydrophobicContact CG1-CG 4.18Å; L113-D115 PolarHBondContact O-N 3.37Å; L113-I116 HydrophobicContact CD2-CD1 3.94Å; L113-I116 PolarHBondContact O-N 3.42Å; L113-L159 HydrophobicContact CD1-CB 3.7Å; L113-W160 HydrophobicContact CD2-CB 4.08Å; L113-W160 PolarHBondContact O-NE1 2.74Å; L113-A163 HydrophobicContact CB-CB 3.55Å; L113-A163 HydrophobicContact CD1-CB 4.34Å
114	K	87.5	Confident	87.2	Confident	89 Å²	89	70 Å²	70	39%	0.387	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-62.8	-21.2	174.6	-67.1	-167.9	178.7	-178.3	0	114.1	R112 I116 A163 E166	R112-K114 VanDerWaalsContact C-N 3.3Å; R112-K114 HydrophobicContact CG-CB 4.48Å; R112-K114 PolarHBondContact O-N 2.76Å; K114-I116 VanDerWaalsContact C-N 3.35Å; K114-A163 WeakPolarHBondContact CE-O 3.47Å; K114-A163 HydrophobicContact CG-CB 4.16Å; K114-E166 IonicContact NZ-OE1 3.68Å; K114-E166 PolarHBondContact NZ-OE1 2.76Å
115	D	88.6	Confident	86.7	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.364	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-95.2	8.5	-175.7	-51	4.7	0	0	0	111.7	R112 L113 T136	R112-D115 HydrophobicContact CB-CB 4.28Å; R112-D115 WeakPolarHBondContact CD-OD1 3.48Å; R112-D115 IonicContact CZ-OD1 3.85Å; R112-D115 IonicContact CZ-OD2 3.53Å; R112-D115 VanDerWaalsContact NH1-CG 3.31Å; R112-D115 IonicContact NH1-OD1 2.7Å; R112-D115 PolarHBondContact NH1-OD1 2.9Å; R112-D115 IonicContact NH1-OD2 2.6Å; R112-D115 PolarHBondContact NH1-OD2 2.98Å; R112-D115 PolarHBondContact O-N 3.17Å; L113-D115 PolarHBondContact O-N 3.37Å; D115-T136 WeakPolarHBondContact O-CA 3.49Å; D115-T136 WeakPolarHBondContact O-CB 3.44Å; D115-T136 WeakPolarHBondContact O-CG2 3.47Å
116	I	89.8	Confident	85.6	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.1	177.9	-61.6	171.1	0	0	0	109.8	I96 V111 L113 K114 V134 W160	I96-I116 HydrophobicContact CD1-CD1 3.58Å; I96-I116 HydrophobicContact CG1-CD1 4.32Å; V111-I116 HydrophobicContact CG1-CD1 4.14Å; V111-I116 HydrophobicContact CG1-CG1 3.75Å; L113-I116 HydrophobicContact CD2-CD1 3.94Å; L113-I116 PolarHBondContact O-N 3.42Å; K114-I116 VanDerWaalsContact C-N 3.35Å; I116-V134 HydrophobicContact CB-CG1 4.39Å; I116-V134 HydrophobicContact CD1-CG1 3.67Å; I116-V134 HydrophobicContact CG1-CG1 3.7Å; I116-V134 HydrophobicContact CG2-CG1 3.83Å; I116-W160 HydrophobicContact CG2-CD2 4.37Å; I116-W160 HydrophobicContact CG2-CZ2 4.08Å; I116-W160 WeakPolarHBondContact O-CZ2 3.4Å; I116-W160 PolarHBondContact O-NE1 3.16Å
117	C	81.7	Confident	83.7	Confident	64 Å²	64	65.9 Å²	65.9	43%	0.432	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-27.2	-176	-46.6	0	0	0	0	111.9	C135 D137	C117-C135 PolarHBondContact N-O 2.74Å; C117-D137 PolarHBondContact SG-N 2.89Å; C117-D137 VanDerWaalsContact SG-N 3.44Å; C117-D137 PolarHBondContact SG-OD1 2.87Å
118	S	81.6	Confident	82.8	Confident	50 Å²	50	68.9 Å²	68.9	35%	0.35	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	152.2	169.1	54.8	0	0	0	0	112.5	C135	S118-C135 PolarHBondContact N-O 3.14Å; S118-C135 PolarHBondContact O-N 3.18Å
119	M	89.2	Confident	81.7	Confident	12 Å²	12	68 Å²	68	6%	0.059	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131	170.9	-172.8	177.1	60.7	0	0	110.2	I132 Q133 V134 Y153 M156 F157 W160	M119-I132 HydrophobicContact CG-CG2 3.75Å; M119-I132 HydrophobicContact SD-CG2 3.82Å; M119-Q133 CarbonylContact C-O 3.55Å; M119-Q133 VanDerWaalsContact CA-O 3.26Å; M119-Q133 WeakPolarHBondContact CA-O 3.46Å; M119-Q133 WeakPolarHBondContact CG-O 3.49Å; M119-V134 HydrophobicContact CG-CG2 4.04Å; M119-V134 HydrophobicContact SD-CG2 4.09Å; M119-Y153 HydrophobicContact CE-CD2 3.94Å; M119-Y153 HydrophobicContact CE-CE1 4.48Å; M119-Y153 HydrophobicContact CE-CE2 3.78Å; M119-Y153 HydrophobicContact CE-CG 4.38Å; M119-Y153 HydrophobicContact CG-CD2 4.36Å; M119-Y153 HydrophobicContact CG-CE2 3.96Å; M119-Y153 PolarHBondContact O-OH 3.26Å; M119-Y153 HydrophobicContact SD-CD2 4.4Å; M119-Y153 HydrophobicContact SD-CE2 4.42Å; M119-M156 HydrophobicContact CE-CB 3.78Å; M119-M156 HydrophobicContact SD-CB 3.73Å; M119-M156 HydrophobicContact SD-CE 3.75Å; M119-M156 HydrophobicContact SD-SD 4.33Å; M119-F157 HydrophobicContact CE-CB 3.65Å; M119-F157 HydrophobicContact CE-CD2 3.88Å; M119-F157 HydrophobicContact CE-CG 4.28Å; M119-W160 HydrophobicContact CB-CE3 4.47Å; M119-W160 HydrophobicContact CB-CZ3 4.39Å
120	T	86.4	Confident	81.3	Confident	48 Å²	48	70 Å²	70	29%	0.294	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153.5	-176.2	63.5	0	0	0	0	112.9	E122 I132 Q133	T120-E122 WeakPolarHBondContact CB-OE1 3.39Å; T120-E122 PolarHBondContact OG1-OE1 3.25Å; T120-I132 WeakPolarHBondContact O-CA 3.47Å; T120-Q133 PolarHBondContact N-O 3.02Å; T120-Q133 PolarHBondContact O-N 3.38Å
121	K	91.3	Very high	81.2	Confident	78 Å²	78	67.5 Å²	67.5	34%	0.339	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	111	173.1	-67.9	-175.5	-179.8	-173.5	0	109.7	D150 Y153	K121-D150 WeakPolarHBondContact CD-OD1 3.37Å; K121-D150 WeakPolarHBondContact CE-OD1 3.37Å; K121-D150 IonicContact NZ-OD1 3.72Å; K121-D150 PolarHBondContact NZ-OD1 3.35Å; K121-Y153 HydrophobicContact CD-CD1 4.28Å; K121-Y153 HydrophobicContact CD-CD2 4.4Å; K121-Y153 HydrophobicContact CD-CG 4.23Å; K121-Y153 HydrophobicContact CG-CD1 4.11Å; K121-Y153 HydrophobicContact CG-CD2 3.41Å; K121-Y153 VanDerWaalsContact CG-CD2 3.41Å; K121-Y153 HydrophobicContact CG-CE1 4.26Å; K121-Y153 HydrophobicContact CG-CE2 3.56Å; K121-Y153 HydrophobicContact CG-CG 3.7Å
122	E	86.3	Confident	81.2	Confident	63 Å²	63	67 Å²	67	29%	0.294	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	172.9	-171.5	-68.2	-56	148.2	0	0	113.7	T120 A131 Q133 F142 R149	T120-E122 WeakPolarHBondContact CB-OE1 3.39Å; T120-E122 PolarHBondContact OG1-OE1 3.25Å; E122-A131 HydrophobicContact CB-CB 3.82Å; E122-A131 PolarHBondContact N-O 3.23Å; E122-A131 PolarHBondContact O-N 2.89Å; E122-Q133 HydrophobicContact CG-CB 3.72Å; E122-F142 HydrophobicContact CB-CD2 4.46Å; E122-F142 HydrophobicContact CB-CE2 3.56Å; E122-F142 HydrophobicContact CB-CZ 3.99Å; E122-F142 HydrophobicContact CG-CD2 4.34Å; E122-F142 HydrophobicContact CG-CE2 3.75Å; E122-R149 PolarHBondContact O-NH1 2.62Å
123	K	82	Confident	81.2	Confident	119 Å²	119	64.3 Å²	64.3	52%	0.517	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117	172.9	-60.6	-176.7	-175.2	178.1	0	111	A125 R126 I128 P129	K123-A125 PolarHBondContact O-N 3.44Å; K123-R126 WeakPolarHBondContact CD-O 3.48Å; K123-R126 PolarHBondContact O-N 3.02Å; K123-R126 VanDerWaalsContact O-N 3.08Å; K123-I128 CarbonylContact C-O 3.51Å; K123-I128 VanDerWaalsContact CA-O 3.23Å; K123-I128 WeakPolarHBondContact CA-O 3.42Å; K123-P129 HydrophobicContact CG-CB 4.33Å
124	T	76.1	Confident	81.3	Confident	30 Å²	30	64.3 Å²	64.3	18%	0.184	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	125.2	169.4	-49.5	0	0	0	0	109.5	R126 L127 I128	T124-R126 PolarHBondContact O-N 2.96Å; T124-R126 VanDerWaalsContact O-N 3.11Å; T124-L127 PolarHBondContact O-N 3.06Å; T124-I128 PolarHBondContact N-O 3.35Å; T124-I128 PolarHBondContact O-N 2.84Å; T124-I128 VanDerWaalsContact O-N 3.07Å
125	A	64.6	Low	81.4	Confident	95 Å²	95	60.6 Å²	60.6	79%	0.785	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	33.5	-175.8	0	0	0	0	0	114.4	K123 L127	K123-A125 PolarHBondContact O-N 3.44Å; A125-L127 PolarHBondContact O-N 2.8Å
126	R	58.5	Low	81.3	Confident	229 Å²	229	58.3 Å²	58.3	86%	0.864	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	-12.3	-174.5	-59.3	-178.9	176.1	178.7	-1.4	116.4	K123 T124	K123-R126 WeakPolarHBondContact CD-O 3.48Å; K123-R126 PolarHBondContact O-N 3.02Å; K123-R126 VanDerWaalsContact O-N 3.08Å; T124-R126 PolarHBondContact O-N 2.96Å; T124-R126 VanDerWaalsContact O-N 3.11Å
127	L	48.4	Very low	80.8	Confident	147 Å²	147	65.4 Å²	65.4	77%	0.77	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-44.3	-173.2	-173.7	62.7	0	0	0	113.4	T124 A125	T124-L127 PolarHBondContact O-N 3.06Å; A125-L127 PolarHBondContact O-N 2.8Å
128	I	71.6	Confident	80.9	Confident	90 Å²	90	67.3 Å²	67.3	46%	0.462	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	117.5	-169.5	-59.1	174	0	0	0	110.2	K123 T124 N130	K123-I128 CarbonylContact C-O 3.51Å; K123-I128 VanDerWaalsContact CA-O 3.23Å; K123-I128 WeakPolarHBondContact CA-O 3.42Å; T124-I128 PolarHBondContact N-O 3.35Å; T124-I128 PolarHBondContact O-N 2.84Å; T124-I128 VanDerWaalsContact O-N 3.07Å; I128-N130 HydrophobicContact CG2-CB 3.96Å; I128-N130 PolarHBondContact O-N 2.78Å
129	P	69	Low	81.3	Confident	59 Å²	59	69.7 Å²	69.7	38%	0.383	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	49.6	-174.9	35.2	-38	0	0	0	113.7	K123 R149	K123-P129 HydrophobicContact CG-CB 4.33Å; P129-R149 WeakPolarHBondContact O-CD 3.43Å; P129-R149 PolarHBondContact O-NE 3.13Å; P129-R149 PolarHBondContact O-NH1 3.22Å
130	N	85.6	Confident	81.3	Confident	62 Å²	62	76.4 Å²	76.4	33%	0.332	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	27.9	-175.3	-65.5	7	0	0	0	113.3	I128 T144 S145 F146	I128-N130 HydrophobicContact CG2-CB 3.96Å; I128-N130 PolarHBondContact O-N 2.78Å; N130-T144 CarbonylContact O-C 3.52Å; N130-T144 WeakPolarHBondContact O-CA 3.36Å; N130-S145 PolarHBondContact O-N 3.41Å; N130-F146 PolarHBondContact O-N 2.6Å
131	A	89.6	Confident	81.6	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	151.8	-179.1	0	0	0	0	0	114	E122 F142 F143 T144 R149	E122-A131 HydrophobicContact CB-CB 3.82Å; E122-A131 PolarHBondContact N-O 3.23Å; E122-A131 PolarHBondContact O-N 2.89Å; A131-F142 HydrophobicContact CB-CE1 3.89Å; A131-F142 HydrophobicContact CB-CE2 4.38Å; A131-F142 HydrophobicContact CB-CZ 3.73Å; A131-F143 CarbonylContact C-O 3.13Å; A131-F143 WeakPolarHBondContact CA-O 3.21Å; A131-F143 WeakPolarHBondContact CB-O 3.48Å; A131-T144 HydrophobicContact CB-CG2 4.36Å; A131-R149 WeakPolarHBondContact O-CD 3.44Å
132	I	93.9	Very high	81.7	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127.5	173.3	-58.6	171	0	0	0	106.8	M119 T120 F143 F146 R149 T152 Y153 M156	M119-I132 HydrophobicContact CG-CG2 3.75Å; M119-I132 HydrophobicContact SD-CG2 3.82Å; T120-I132 WeakPolarHBondContact O-CA 3.47Å; I132-F143 PolarHBondContact N-O 3.34Å; I132-F143 PolarHBondContact O-N 3.02Å; I132-F146 HydrophobicContact CB-CD2 4.49Å; I132-F146 HydrophobicContact CB-CE2 3.75Å; I132-F146 HydrophobicContact CB-CZ 4.35Å; I132-F146 HydrophobicContact CD1-CD2 4.02Å; I132-F146 HydrophobicContact CD1-CE1 4.47Å; I132-F146 HydrophobicContact CD1-CE2 3.7Å; I132-F146 HydrophobicContact CD1-CZ 3.93Å; I132-F146 HydrophobicContact CG1-CD2 3.99Å; I132-F146 HydrophobicContact CG1-CE2 3.67Å; I132-F146 HydrophobicContact CG1-CZ 4.36Å; I132-R149 HydrophobicContact CD1-CG 4.2Å; I132-R149 HydrophobicContact CG1-CG 3.73Å; I132-T152 HydrophobicContact CD1-CG2 3.9Å; I132-Y153 HydrophobicContact CG1-CD2 4.36Å; I132-Y153 HydrophobicContact CG2-CD2 4.02Å; I132-M156 HydrophobicContact CD1-SD 3.79Å; I132-M156 HydrophobicContact CG2-CE 4.11Å; I132-M156 HydrophobicContact CG2-SD 4.32Å
133	Q	92.8	Very high	82.1	Confident	42 Å²	42	70 Å²	70	20%	0.196	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.9	174.3	-175.4	180	-57.5	0	0	109.7	M119 T120 E122 C135 H141 F142	M119-Q133 CarbonylContact C-O 3.55Å; M119-Q133 VanDerWaalsContact CA-O 3.26Å; M119-Q133 WeakPolarHBondContact CA-O 3.46Å; M119-Q133 WeakPolarHBondContact CG-O 3.49Å; T120-Q133 PolarHBondContact N-O 3.02Å; T120-Q133 PolarHBondContact O-N 3.38Å; E122-Q133 HydrophobicContact CG-CB 3.72Å; Q133-C135 PolarHBondContact NE2-SG 2.86Å; Q133-H141 WeakPolarHBondContact CA-O 3.22Å; Q133-F142 HydrophobicContact CB-CD2 3.99Å; Q133-F142 HydrophobicContact CG-CD2 4.22Å
134	V	93.8	Very high	82.6	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129	172.5	178.3	0	0	0	0	107.4	I96 I116 M119 H141 F143 M156	I96-V134 HydrophobicContact CD1-CG2 4.5Å; I116-V134 HydrophobicContact CB-CG1 4.39Å; I116-V134 HydrophobicContact CD1-CG1 3.67Å; I116-V134 HydrophobicContact CG1-CG1 3.7Å; I116-V134 HydrophobicContact CG2-CG1 3.83Å; M119-V134 HydrophobicContact CG-CG2 4.04Å; M119-V134 HydrophobicContact SD-CG2 4.09Å; V134-H141 PolarHBondContact N-O 2.9Å; V134-H141 PolarHBondContact O-N 2.85Å; V134-F143 HydrophobicContact CB-CE2 4.39Å; V134-F143 HydrophobicContact CG2-CD2 4.31Å; V134-F143 HydrophobicContact CG2-CE2 4.08Å; V134-M156 HydrophobicContact CG2-CE 3.83Å
135	C	87.8	Confident	83.3	Confident	10 Å²	10	66.2 Å²	66.2	7%	0.068	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123.8	174.4	-48.4	0	0	0	0	109.7	C117 S118 Q133 K140	C117-C135 PolarHBondContact N-O 2.74Å; S118-C135 PolarHBondContact N-O 3.14Å; S118-C135 PolarHBondContact O-N 3.18Å; Q133-C135 PolarHBondContact NE2-SG 2.86Å; C135-K140 HydrophobicContact CB-CG 4.13Å
136	T	88.3	Confident	84.5	Confident	21 Å²	21	61.7 Å²	61.7	13%	0.129	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-179.7	163	66.2	0	0	0	0	109.2	V111 D115 S138 E139	V111-T136 HydrophobicContact CG1-CG2 3.68Å; D115-T136 WeakPolarHBondContact O-CA 3.49Å; D115-T136 WeakPolarHBondContact O-CB 3.44Å; D115-T136 WeakPolarHBondContact O-CG2 3.47Å; T136-S138 PolarHBondContact O-N 2.86Å; T136-S138 PolarHBondContact OG1-N 2.85Å; T136-S138 PolarHBondContact OG1-OG 3.1Å; T136-S138 VanDerWaalsContact OG1-OG 3.09Å; T136-E139 PolarHBondContact N-O 3.41Å; T136-E139 PolarHBondContact OG1-N 2.75Å; T136-E139 PolarHBondContact OG1-O 2.7Å
137	D	78.7	Confident	85.7	Confident	153 Å²	153	54.8 Å²	54.8	82%	0.818	32%	0.315	S	S	*	.	S	Bend	trans	-64.8	-23.7	171.2	-73.2	-40.8	0	0	0	113.3	C117	C117-D137 PolarHBondContact SG-N 2.89Å; C117-D137 VanDerWaalsContact SG-N 3.44Å; C117-D137 PolarHBondContact SG-OD1 2.87Å
138	S	82.9	Confident	87.6	Confident	105 Å²	105	50.3 Å²	50.3	73%	0.734	30%	0.299	S	S	*	.	S	Bend	trans	-100.8	-40.6	-175.9	56.5	0	0	0	0	114.3	T136	T136-S138 PolarHBondContact O-N 2.86Å; T136-S138 PolarHBondContact OG1-N 2.85Å; T136-S138 PolarHBondContact OG1-OG 3.1Å; T136-S138 VanDerWaalsContact OG1-OG 3.09Å
139	E	89.7	Confident	88.5	Confident	99 Å²	99	47.8 Å²	47.8	46%	0.463	28%	0.284	S	S	.	.			trans	-140.5	161.6	-167.2	-76.6	-170.2	-141.6	0	0	113	T136 H141	T136-E139 PolarHBondContact N-O 3.41Å; T136-E139 PolarHBondContact OG1-N 2.75Å; T136-E139 PolarHBondContact OG1-O 2.7Å; E139-H141 IonicContact OE2-CE1 3.81Å; E139-H141 PolarHBondContact OE2-CE1 3.25Å; E139-H141 VanDerWaalsContact OE2-CE1 3.26Å; E139-H141 IonicContact OE2-ND1 2.74Å
140	K	90.1	Very high	89.3	Confident	153 Å²	153	47.6 Å²	47.6	67%	0.665	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.9	174.3	-63.3	-175	177.3	176.8	0	109.3	C135	C135-K140 HydrophobicContact CB-CG 4.13Å
141	H	93.4	Very high	89.3	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.046	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.1	-178.4	-50.4	-49.2	0	0	0	109.3	L79 L109 Q133 V134 E139 F143	L79-H141 HydrophobicContact CD1-CB 4.21Å; L109-H141 HydrophobicContact CD2-CB 4.39Å; Q133-H141 WeakPolarHBondContact CA-O 3.22Å; V134-H141 PolarHBondContact N-O 2.9Å; V134-H141 PolarHBondContact O-N 2.85Å; E139-H141 IonicContact OE2-CE1 3.81Å; E139-H141 PolarHBondContact OE2-CE1 3.25Å; E139-H141 VanDerWaalsContact OE2-CE1 3.26Å; E139-H141 IonicContact OE2-ND1 2.74Å; H141-F143 HydrophobicContact CB-CD2 4.39Å; H141-F143 HydrophobicContact CB-CE2 3.67Å; H141-F143 HydrophobicContact CB-CZ 3.98Å
142	F	93	Very high	89.4	Confident	43 Å²	43	49.4 Å²	49.4	19%	0.189	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	100.7	-177.3	-171.1	-90	0	0	0	109.3	Q80 E122 A131 Q133 T144	Q80-F142 HydrophobicContact CB-CB 4.19Å; Q80-F142 HydrophobicContact CB-CD1 3.77Å; Q80-F142 HydrophobicContact CB-CG 4.45Å; Q80-F142 WeakPolarHBondContact CB-O 3.28Å; Q80-F142 HydrophobicContact CG-CD1 4.22Å; Q80-F142 PolarHBondContact N-O 3.04Å; E122-F142 HydrophobicContact CB-CD2 4.46Å; E122-F142 HydrophobicContact CB-CE2 3.56Å; E122-F142 HydrophobicContact CB-CZ 3.99Å; E122-F142 HydrophobicContact CG-CD2 4.34Å; E122-F142 HydrophobicContact CG-CE2 3.75Å; A131-F142 HydrophobicContact CB-CE1 3.89Å; A131-F142 HydrophobicContact CB-CE2 4.38Å; A131-F142 HydrophobicContact CB-CZ 3.73Å; Q133-F142 HydrophobicContact CB-CD2 3.99Å; Q133-F142 HydrophobicContact CG-CD2 4.22Å; F142-T144 HydrophobicContact CD1-CG2 3.41Å; F142-T144 VanDerWaalsContact CD1-CG2 3.41Å; F142-T144 HydrophobicContact CE1-CG2 3.43Å; F142-T144 VanDerWaalsContact CE1-CG2 3.43Å
143	F	94.6	Very high	89.4	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.013	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	138.1	178.3	-58.4	-84.5	0	0	0	110	A78 L79 L89 F98 L109 A131 I132 V134 H141 F146	A78-F143 CarbonylContact O-C 3.47Å; A78-F143 WeakPolarHBondContact O-CA 3.25Å; L79-F143 HydrophobicContact CB-CD1 4.2Å; L79-F143 HydrophobicContact CB-CE1 4.3Å; L79-F143 HydrophobicContact CD1-CD1 3.98Å; L79-F143 HydrophobicContact CD1-CE1 3.83Å; L79-F143 HydrophobicContact CD1-CZ 4.26Å; L79-F143 HydrophobicContact CG-CE1 4.48Å; L89-F143 HydrophobicContact CD1-CD1 4.07Å; L89-F143 HydrophobicContact CD1-CE1 3.69Å; L89-F143 HydrophobicContact CD1-CE2 4.45Å; L89-F143 HydrophobicContact CD1-CZ 3.9Å; F98-F143 HydrophobicContact CB-CE1 3.96Å; F98-F143 HydrophobicContact CD2-CD1 4.26Å; F98-F143 AromaticContact CD2-CE1 3.99Å; F98-F143 HydrophobicContact CD2-CE1 3.99Å; F98-F143 AromaticContact CG-CE1 3.95Å; F98-F143 HydrophobicContact CG-CE1 3.95Å; L109-F143 HydrophobicContact CD2-CE1 4.36Å; L109-F143 HydrophobicContact CD2-CZ 3.96Å; A131-F143 CarbonylContact C-O 3.13Å; A131-F143 WeakPolarHBondContact CA-O 3.21Å; A131-F143 WeakPolarHBondContact CB-O 3.48Å; I132-F143 PolarHBondContact N-O 3.34Å; I132-F143 PolarHBondContact O-N 3.02Å; V134-F143 HydrophobicContact CB-CE2 4.39Å; V134-F143 HydrophobicContact CG2-CD2 4.31Å; V134-F143 HydrophobicContact CG2-CE2 4.08Å; H141-F143 HydrophobicContact CB-CD2 4.39Å; H141-F143 HydrophobicContact CB-CE2 3.67Å; H141-F143 HydrophobicContact CB-CZ 3.98Å; F143-F146 HydrophobicContact CB-CE2 3.48Å; F143-F146 VanDerWaalsContact CB-CE2 3.48Å; F143-F146 HydrophobicContact CB-CZ 3.45Å; F143-F146 VanDerWaalsContact CB-CZ 3.45Å; F143-F146 HydrophobicContact CG-CZ 4.33Å; F143-F146 WeakPolarHBondContact O-CE2 3.18Å
144	T	92.2	Very high	89.1	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	177.6	-171.7	83.1	0	0	0	0	112	C77 A78 Q80 L84 N130 A131 F142 F146	C77-T144 CarbonylContact C-O 3.56Å; C77-T144 WeakPolarHBondContact CA-O 3.44Å; C77-T144 VanDerWaalsContact CB-O 3.31Å; C77-T144 WeakPolarHBondContact CB-O 3.22Å; A78-T144 PolarHBondContact N-O 2.95Å; A78-T144 PolarHBondContact O-N 3.38Å; A78-T144 PolarHBondContact O-OG1 3.16Å; Q80-T144 HydrophobicContact CB-CG2 4.22Å; L84-T144 HydrophobicContact CD2-CG2 4.16Å; L84-T144 WeakPolarHBondContact CD2-OG1 3.41Å; N130-T144 CarbonylContact O-C 3.52Å; N130-T144 WeakPolarHBondContact O-CA 3.36Å; A131-T144 HydrophobicContact CB-CG2 4.36Å; F142-T144 HydrophobicContact CD1-CG2 3.41Å; F142-T144 VanDerWaalsContact CD1-CG2 3.41Å; F142-T144 HydrophobicContact CE1-CG2 3.43Å; F142-T144 VanDerWaalsContact CE1-CG2 3.43Å; T144-F146 PolarHBondContact O-N 3.01Å; T144-F146 VanDerWaalsContact O-N 3.13Å
145	S	90.1	Very high	89	Confident	68 Å²	68	52.6 Å²	52.6	48%	0.476	30%	0.297	S	S	.	.			trans	61.6	23.4	170.5	-49.4	0	0	0	0	114.1	N130 G147	N130-S145 PolarHBondContact O-N 3.41Å; S145-G147 PolarHBondContact O-N 3.14Å
146	F	90.9	Very high	89.2	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	29%	0.294	C	S	.	.			trans	-66.1	121.8	173.1	-67.1	-76	0	0	0	110.5	C77 L89 N130 I132 F143 T144 A148 R149 T152	C77-F146 HydrophobicContact CB-CD1 3.66Å; C77-F146 HydrophobicContact CB-CE1 3.44Å; C77-F146 VanDerWaalsContact CB-CE1 3.44Å; C77-F146 HydrophobicContact CB-CE2 4.42Å; C77-F146 HydrophobicContact CB-CG 4.25Å; C77-F146 HydrophobicContact CB-CZ 3.87Å; L89-F146 HydrophobicContact CD2-CE1 4.03Å; L89-F146 HydrophobicContact CD2-CZ 4.15Å; N130-F146 PolarHBondContact O-N 2.6Å; I132-F146 HydrophobicContact CB-CD2 4.49Å; I132-F146 HydrophobicContact CB-CE2 3.75Å; I132-F146 HydrophobicContact CB-CZ 4.35Å; I132-F146 HydrophobicContact CD1-CD2 4.02Å; I132-F146 HydrophobicContact CD1-CE1 4.47Å; I132-F146 HydrophobicContact CD1-CE2 3.7Å; I132-F146 HydrophobicContact CD1-CZ 3.93Å; I132-F146 HydrophobicContact CG1-CD2 3.99Å; I132-F146 HydrophobicContact CG1-CE2 3.67Å; I132-F146 HydrophobicContact CG1-CZ 4.36Å; F143-F146 HydrophobicContact CB-CE2 3.48Å; F143-F146 VanDerWaalsContact CB-CE2 3.48Å; F143-F146 HydrophobicContact CB-CZ 3.45Å; F143-F146 VanDerWaalsContact CB-CZ 3.45Å; F143-F146 HydrophobicContact CG-CZ 4.33Å; F143-F146 WeakPolarHBondContact O-CE2 3.18Å; T144-F146 PolarHBondContact O-N 3.01Å; T144-F146 VanDerWaalsContact O-N 3.13Å; F146-A148 PolarHBondContact O-N 3.29Å; F146-R149 HydrophobicContact CB-CB 4.07Å; F146-T152 HydrophobicContact CD1-CG2 3.76Å; F146-T152 HydrophobicContact CE1-CG2 3.55Å; F146-T152 HydrophobicContact CZ-CG2 4.24Å
147	G	84	Confident	89.3	Confident	83 Å²	83	53.9 Å²	53.9	86%	0.856	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.3	174.5	0	0	0	0	0	114.1	S145	S145-G147 PolarHBondContact O-N 3.14Å
148	A	87.2	Confident	89.7	Confident	54 Å²	54	48.6 Å²	48.6	45%	0.446	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.1	56.5	177.7	0	0	0	0	0	111.5	F146 D150 R151 T152	F146-A148 PolarHBondContact O-N 3.29Å; A148-D150 VanDerWaalsContact C-N 3.29Å; A148-D150 PolarHBondContact O-N 3.42Å; A148-D150 VanDerWaalsContact O-N 3.1Å; A148-R151 HydrophobicContact CB-CB 4.27Å; A148-R151 PolarHBondContact O-N 2.86Å; A148-T152 PolarHBondContact O-N 3.47Å; A148-T152 VanDerWaalsContact O-N 3.08Å; A148-T152 PolarHBondContact O-OG1 3.49Å
149	R	90.7	Very high	90	Very high	36 Å²	36	43.7 Å²	43.7	14%	0.136	23%	0.233	C	C	.	.	H	α-helix	trans	-40.6	-52.9	-174.7	-176.2	-155.6	55.4	179	-1.7	113.3	E122 P129 A131 I132 F146 R151 T152 Y153	E122-R149 PolarHBondContact O-NH1 2.62Å; P129-R149 WeakPolarHBondContact O-CD 3.43Å; P129-R149 PolarHBondContact O-NE 3.13Å; P129-R149 PolarHBondContact O-NH1 3.22Å; A131-R149 WeakPolarHBondContact O-CD 3.44Å; I132-R149 HydrophobicContact CD1-CG 4.2Å; I132-R149 HydrophobicContact CG1-CG 3.73Å; F146-R149 HydrophobicContact CB-CB 4.07Å; R149-R151 PolarHBondContact O-N 2.88Å; R149-T152 PolarHBondContact O-N 3.4Å; R149-Y153 WeakPolarHBondContact O-CB 3.47Å; R149-Y153 PolarHBondContact O-N 2.87Å
150	D	86.8	Confident	90	Very high	55 Å²	55	40.5 Å²	40.5	29%	0.294	22%	0.217	S	C	.	.	H	α-helix	trans	-68.5	-31.6	-173.2	-70.8	-89.9	0	0	0	113.5	K121 A148 M154	K121-D150 WeakPolarHBondContact CD-OD1 3.37Å; K121-D150 WeakPolarHBondContact CE-OD1 3.37Å; K121-D150 IonicContact NZ-OD1 3.72Å; K121-D150 PolarHBondContact NZ-OD1 3.35Å; A148-D150 VanDerWaalsContact C-N 3.29Å; A148-D150 PolarHBondContact O-N 3.42Å; A148-D150 VanDerWaalsContact O-N 3.1Å; D150-M154 VanDerWaalsContact O-CG 3.24Å; D150-M154 WeakPolarHBondContact O-CG 3.36Å; D150-M154 PolarHBondContact O-N 2.91Å; D150-M154 VanDerWaalsContact O-N 3.16Å
151	R	85.9	Confident	89.7	Confident	100 Å²	100	36.9 Å²	36.9	38%	0.377	20%	0.203	S	C	.	.	H	α-helix	trans	-68.4	-44.6	170.9	-173.9	178.5	-178.6	-169	-1.4	110.5	A148 R149 M154 M155 Q180	A148-R151 HydrophobicContact CB-CB 4.27Å; A148-R151 PolarHBondContact O-N 2.86Å; R149-R151 PolarHBondContact O-N 2.88Å; R151-M154 PolarHBondContact O-N 2.92Å; R151-M155 PolarHBondContact O-N 2.96Å; R151-M155 VanDerWaalsContact O-N 3.15Å; R151-Q180 PolarHBondContact NH2-O 3.01Å
152	T	91.5	Very high	89.3	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-46.3	178.3	-56.9	0	0	0	0	111.8	Y75 L89 I132 F146 A148 R149 M154 M155 M156	Y75-T152 HydrophobicContact CD1-CG2 4.36Å; Y75-T152 WeakPolarHBondContact CD1-OG1 3.29Å; Y75-T152 HydrophobicContact CD2-CG2 3.46Å; Y75-T152 VanDerWaalsContact CD2-CG2 3.46Å; Y75-T152 WeakPolarHBondContact CE1-OG1 3.33Å; Y75-T152 HydrophobicContact CE2-CG2 3.63Å; Y75-T152 HydrophobicContact CG-CG2 3.85Å; L89-T152 HydrophobicContact CD2-CG2 4.47Å; I132-T152 HydrophobicContact CD1-CG2 3.9Å; F146-T152 HydrophobicContact CD1-CG2 3.76Å; F146-T152 HydrophobicContact CE1-CG2 3.55Å; F146-T152 HydrophobicContact CZ-CG2 4.24Å; A148-T152 PolarHBondContact O-N 3.47Å; A148-T152 VanDerWaalsContact O-N 3.08Å; A148-T152 PolarHBondContact O-OG1 3.49Å; R149-T152 PolarHBondContact O-N 3.4Å; T152-M154 PolarHBondContact O-N 2.99Å; T152-M155 PolarHBondContact O-N 2.96Å; T152-M156 HydrophobicContact CG2-CG 4.43Å; T152-M156 HydrophobicContact CG2-SD 3.74Å; T152-M156 VanDerWaalsContact O-CG 3.31Å; T152-M156 WeakPolarHBondContact O-CG 3.33Å; T152-M156 PolarHBondContact O-N 2.64Å
153	Y	92.4	Very high	88.8	Confident	30 Å²	30	36.1 Å²	36.1	12%	0.118	20%	0.202	C	C	.	.	H	α-helix	trans	-57.9	-46.2	176	179.5	-82.6	0	0	0	111.8	M119 K121 I132 R149 M155 M156 F157	M119-Y153 HydrophobicContact CE-CD2 3.94Å; M119-Y153 HydrophobicContact CE-CE1 4.48Å; M119-Y153 HydrophobicContact CE-CE2 3.78Å; M119-Y153 HydrophobicContact CE-CG 4.38Å; M119-Y153 HydrophobicContact CG-CD2 4.36Å; M119-Y153 HydrophobicContact CG-CE2 3.96Å; M119-Y153 PolarHBondContact O-OH 3.26Å; M119-Y153 HydrophobicContact SD-CD2 4.4Å; M119-Y153 HydrophobicContact SD-CE2 4.42Å; K121-Y153 HydrophobicContact CD-CD1 4.28Å; K121-Y153 HydrophobicContact CD-CD2 4.4Å; K121-Y153 HydrophobicContact CD-CG 4.23Å; K121-Y153 HydrophobicContact CG-CD1 4.11Å; K121-Y153 HydrophobicContact CG-CD2 3.41Å; K121-Y153 VanDerWaalsContact CG-CD2 3.41Å; K121-Y153 HydrophobicContact CG-CE1 4.26Å; K121-Y153 HydrophobicContact CG-CE2 3.56Å; K121-Y153 HydrophobicContact CG-CG 3.7Å; I132-Y153 HydrophobicContact CG1-CD2 4.36Å; I132-Y153 HydrophobicContact CG2-CD2 4.02Å; R149-Y153 WeakPolarHBondContact O-CB 3.47Å; R149-Y153 PolarHBondContact O-N 2.87Å; Y153-M155 VanDerWaalsContact C-N 3.32Å; Y153-M155 PolarHBondContact O-N 3.36Å; Y153-M156 PolarHBondContact O-N 2.97Å; Y153-F157 HydrophobicContact CD1-CB 4.35Å; Y153-F157 HydrophobicContact CE1-CB 4.09Å; Y153-F157 AromaticContact CE1-CD2 3.91Å; Y153-F157 HydrophobicContact CE1-CD2 3.91Å; Y153-F157 HydrophobicContact CE1-CG 4.13Å; Y153-F157 AromaticContact CZ-CD2 3.88Å; Y153-F157 WeakPolarHBondContact O-CB 3.38Å; Y153-F157 PolarHBondContact O-N 2.81Å
154	M	88.1	Confident	88.1	Confident	65 Å²	65	40.4 Å²	40.4	32%	0.32	22%	0.224	S	C	.	.	H	α-helix	trans	-65.1	-35.8	-178.9	-72.3	-65.7	178.3	0	0	112.4	D150 R151 T152 R158 V472	D150-M154 VanDerWaalsContact O-CG 3.24Å; D150-M154 WeakPolarHBondContact O-CG 3.36Å; D150-M154 PolarHBondContact O-N 2.91Å; D150-M154 VanDerWaalsContact O-N 3.16Å; R151-M154 PolarHBondContact O-N 2.92Å; T152-M154 PolarHBondContact O-N 2.99Å; M154-R158 PolarHBondContact O-N 3.33Å; M154-V472 HydrophobicContact CE-CG2 4.47Å
155	M	90.2	Very high	87.3	Confident	14 Å²	14	45.9 Å²	45.9	7%	0.069	25%	0.253	C	S	.	.	H	α-helix	trans	-65.3	-52.2	172.4	-173.9	64.1	82	0	0	111.4	V73 L91 R151 T152 Y153 F157 R158 L159 F177	V73-M155 HydrophobicContact CG1-CG 3.98Å; L91-M155 HydrophobicContact CD1-CB 4.31Å; L91-M155 HydrophobicContact CD1-CG 3.8Å; R151-M155 PolarHBondContact O-N 2.96Å; R151-M155 VanDerWaalsContact O-N 3.15Å; T152-M155 PolarHBondContact O-N 2.96Å; Y153-M155 VanDerWaalsContact C-N 3.32Å; Y153-M155 PolarHBondContact O-N 3.36Å; M155-F157 PolarHBondContact O-N 3.49Å; M155-R158 PolarHBondContact O-N 2.86Å; M155-L159 HydrophobicContact CG-CD1 4.12Å; M155-L159 WeakPolarHBondContact O-CG 3.41Å; M155-L159 PolarHBondContact O-N 3.42Å; M155-L159 VanDerWaalsContact O-N 3.1Å; M155-L159 HydrophobicContact SD-CD1 4.44Å; M155-F177 HydrophobicContact CE-CB 4.21Å; M155-F177 HydrophobicContact CE-CD1 3.52Å; M155-F177 HydrophobicContact CE-CE1 4.04Å; M155-F177 HydrophobicContact CE-CG 3.94Å; M155-F177 HydrophobicContact SD-CD1 4.27Å; M155-F177 HydrophobicContact SD-CE1 4.43Å; M155-F177 HydrophobicContact SD-CG 4.42Å
156	M	92.3	Very high	86.8	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-56.2	-39	177.2	-66.8	167	75.3	0	0	111.8	L89 L91 I96 M119 I132 V134 T152 Y153 W160	L89-M156 HydrophobicContact CD2-CE 3.94Å; L89-M156 HydrophobicContact CD2-SD 3.79Å; L91-M156 HydrophobicContact CD1-CG 3.62Å; L91-M156 HydrophobicContact CD2-CG 3.94Å; L91-M156 HydrophobicContact CG-CG 4.46Å; I96-M156 HydrophobicContact CD1-CE 3.82Å; I96-M156 HydrophobicContact CG2-CE 4.46Å; M119-M156 HydrophobicContact CE-CB 3.78Å; M119-M156 HydrophobicContact SD-CB 3.73Å; M119-M156 HydrophobicContact SD-CE 3.75Å; M119-M156 HydrophobicContact SD-SD 4.33Å; I132-M156 HydrophobicContact CD1-SD 3.79Å; I132-M156 HydrophobicContact CG2-CE 4.11Å; I132-M156 HydrophobicContact CG2-SD 4.32Å; V134-M156 HydrophobicContact CG2-CE 3.83Å; T152-M156 HydrophobicContact CG2-CG 4.43Å; T152-M156 HydrophobicContact CG2-SD 3.74Å; T152-M156 VanDerWaalsContact O-CG 3.31Å; T152-M156 WeakPolarHBondContact O-CG 3.33Å; T152-M156 PolarHBondContact O-N 2.64Å; Y153-M156 PolarHBondContact O-N 2.97Å; M156-W160 VanDerWaalsContact O-CB 3.31Å; M156-W160 WeakPolarHBondContact O-CB 3.38Å; M156-W160 PolarHBondContact O-N 2.86Å
157	F	90.1	Very high	86.2	Confident	57 Å²	57	56 Å²	56	25%	0.25	29%	0.291	C	S	.	.	H	α-helix	trans	-72.1	-41.6	-177.8	-166.9	-92.1	0	0	0	111.9	M119 Y153 M155 W160 Q161	M119-F157 HydrophobicContact CE-CB 3.65Å; M119-F157 HydrophobicContact CE-CD2 3.88Å; M119-F157 HydrophobicContact CE-CG 4.28Å; Y153-F157 HydrophobicContact CD1-CB 4.35Å; Y153-F157 HydrophobicContact CE1-CB 4.09Å; Y153-F157 AromaticContact CE1-CD2 3.91Å; Y153-F157 HydrophobicContact CE1-CD2 3.91Å; Y153-F157 HydrophobicContact CE1-CG 4.13Å; Y153-F157 AromaticContact CZ-CD2 3.88Å; Y153-F157 WeakPolarHBondContact O-CB 3.38Å; Y153-F157 PolarHBondContact O-N 2.81Å; M155-F157 PolarHBondContact O-N 3.49Å; F157-W160 AromaticContact CD2-CE3 3.84Å; F157-W160 HydrophobicContact CD2-CE3 3.84Å; F157-W160 HydrophobicContact CD2-CZ3 4.07Å; F157-W160 AromaticContact CE2-CE3 3.92Å; F157-W160 HydrophobicContact CE2-CE3 3.92Å; F157-W160 AromaticContact CE2-CZ3 3.75Å; F157-W160 HydrophobicContact CE2-CZ3 3.75Å; F157-W160 PolarHBondContact O-N 2.82Å; F157-Q161 HydrophobicContact CD1-CG 4.09Å; F157-Q161 HydrophobicContact CE1-CG 3.9Å; F157-Q161 VanDerWaalsContact CE1-OE1 3.28Å; F157-Q161 HydrophobicContact CZ-CG 4.49Å; F157-Q161 WeakPolarHBondContact O-CG 3.38Å; F157-Q161 PolarHBondContact O-N 2.97Å
158	R	87.9	Confident	85.9	Confident	42 Å²	42	56.6 Å²	56.6	16%	0.158	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-46.7	173.6	178.8	175.4	173.9	143.3	-0.7	111.3	M154 M155 W160 Q161 N162 E173	M154-R158 PolarHBondContact O-N 3.33Å; M155-R158 PolarHBondContact O-N 2.86Å; R158-W160 VanDerWaalsContact C-N 3.33Å; R158-W160 PolarHBondContact O-N 3.08Å; R158-Q161 PolarHBondContact O-N 2.8Å; R158-N162 WeakPolarHBondContact O-CB 3.42Å; R158-N162 PolarHBondContact O-N 2.85Å; R158-N162 PolarHBondContact O-OD1 3.18Å; R158-E173 IonicContact CZ-OE1 3.67Å; R158-E173 IonicContact CZ-OE2 3.01Å; R158-E173 IonicContact NH2-OE1 3.44Å; R158-E173 PolarHBondContact NH2-OE1 3.46Å; R158-E173 IonicContact NH2-OE2 3.81Å; R158-E173 PolarHBondContact NH2-OE2 2.87Å
159	L	90.1	Very high	85.6	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-42	178.3	-63.7	171.3	0	0	0	111.1	I72 L91 L113 M155 N162 A163 L169	I72-L159 HydrophobicContact CD1-CD1 4.19Å; I72-L159 HydrophobicContact CD1-CD2 3.55Å; L91-L159 HydrophobicContact CB-CD1 3.84Å; L91-L159 HydrophobicContact CD1-CD1 4.03Å; L113-L159 HydrophobicContact CD1-CB 3.7Å; M155-L159 HydrophobicContact CG-CD1 4.12Å; M155-L159 WeakPolarHBondContact O-CG 3.41Å; M155-L159 PolarHBondContact O-N 3.42Å; M155-L159 VanDerWaalsContact O-N 3.1Å; M155-L159 HydrophobicContact SD-CD1 4.44Å; L159-N162 PolarHBondContact O-N 3.5Å; L159-A163 WeakPolarHBondContact O-CB 3.46Å; L159-A163 PolarHBondContact O-N 3.21Å; L159-L169 HydrophobicContact CD2-CD1 3.78Å
160	W	88.9	Confident	85.2	Confident	33 Å²	33	56 Å²	56	13%	0.125	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-47.4	174.3	-177.6	38.5	0	0	0	112.7	L113 I116 M119 M156 F157 R158 N162 A163 L164	L113-W160 HydrophobicContact CD2-CB 4.08Å; L113-W160 PolarHBondContact O-NE1 2.74Å; I116-W160 HydrophobicContact CG2-CD2 4.37Å; I116-W160 HydrophobicContact CG2-CZ2 4.08Å; I116-W160 WeakPolarHBondContact O-CZ2 3.4Å; I116-W160 PolarHBondContact O-NE1 3.16Å; M119-W160 HydrophobicContact CB-CE3 4.47Å; M119-W160 HydrophobicContact CB-CZ3 4.39Å; M156-W160 VanDerWaalsContact O-CB 3.31Å; M156-W160 WeakPolarHBondContact O-CB 3.38Å; M156-W160 PolarHBondContact O-N 2.86Å; F157-W160 AromaticContact CD2-CE3 3.84Å; F157-W160 HydrophobicContact CD2-CE3 3.84Å; F157-W160 HydrophobicContact CD2-CZ3 4.07Å; F157-W160 AromaticContact CE2-CE3 3.92Å; F157-W160 HydrophobicContact CE2-CE3 3.92Å; F157-W160 AromaticContact CE2-CZ3 3.75Å; F157-W160 HydrophobicContact CE2-CZ3 3.75Å; F157-W160 PolarHBondContact O-N 2.82Å; R158-W160 VanDerWaalsContact C-N 3.33Å; R158-W160 PolarHBondContact O-N 3.08Å; W160-N162 PolarHBondContact O-N 2.68Å; W160-A163 PolarHBondContact O-N 3.23Å; W160-L164 HydrophobicContact CD2-CD1 4.23Å; W160-L164 HydrophobicContact CG-CD1 4.4Å; W160-L164 HydrophobicContact CZ2-CD1 4.05Å; W160-L164 WeakPolarHBondContact O-CG 3.5Å; W160-L164 PolarHBondContact O-N 3.15Å
161	Q	83.6	Confident	85	Confident	77 Å²	77	56.8 Å²	56.8	36%	0.36	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-42.8	176.3	-71.6	-174.8	-67.4	0	0	112.5	F157 R158 A163 L164 L165	F157-Q161 HydrophobicContact CD1-CG 4.09Å; F157-Q161 HydrophobicContact CE1-CG 3.9Å; F157-Q161 VanDerWaalsContact CE1-OE1 3.28Å; F157-Q161 HydrophobicContact CZ-CG 4.49Å; F157-Q161 WeakPolarHBondContact O-CG 3.38Å; F157-Q161 PolarHBondContact O-N 2.97Å; R158-Q161 PolarHBondContact O-N 2.8Å; Q161-A163 PolarHBondContact O-N 3.06Å; Q161-L164 PolarHBondContact O-N 2.83Å; Q161-L165 WeakPolarHBondContact O-CB 3.44Å; Q161-L165 VanDerWaalsContact O-CG 3.28Å; Q161-L165 WeakPolarHBondContact O-CG 3.36Å; Q161-L165 PolarHBondContact O-N 2.93Å
162	N	84.3	Confident	84.8	Confident	31 Å²	31	57 Å²	57	17%	0.166	29%	0.288	C	S	.	.	H	α-helix	trans	-60.5	-44.5	176.6	-85.3	38.2	0	0	0	111.7	R158 L159 W160 L165 E166 K167 L169	R158-N162 WeakPolarHBondContact O-CB 3.42Å; R158-N162 PolarHBondContact O-N 2.85Å; R158-N162 PolarHBondContact O-OD1 3.18Å; L159-N162 PolarHBondContact O-N 3.5Å; W160-N162 PolarHBondContact O-N 2.68Å; N162-L165 PolarHBondContact O-N 3.01Å; N162-E166 PolarHBondContact O-N 2.74Å; N162-K167 VanDerWaalsContact CB-O 3.27Å; N162-K167 WeakPolarHBondContact CB-O 3.39Å; N162-K167 PolarHBondContact ND2-O 3.36Å; N162-K167 PolarHBondContact O-N 2.93Å; N162-L169 WeakPolarHBondContact ND2-CD2 3.27Å
163	A	83.9	Confident	84.4	Confident	6 Å²	6	60.6 Å²	60.6	5%	0.05	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-41	176.2	0	0	0	0	0	112.7	L113 K114 L159 W160 Q161 E166	L113-A163 HydrophobicContact CB-CB 3.55Å; L113-A163 HydrophobicContact CD1-CB 4.34Å; K114-A163 WeakPolarHBondContact CE-O 3.47Å; K114-A163 HydrophobicContact CG-CB 4.16Å; L159-A163 WeakPolarHBondContact O-CB 3.46Å; L159-A163 PolarHBondContact O-N 3.21Å; W160-A163 PolarHBondContact O-N 3.23Å; Q161-A163 PolarHBondContact O-N 3.06Å; A163-E166 PolarHBondContact O-N 3.18Å
164	L	78.9	Confident	84.1	Confident	93 Å²	93	59.4 Å²	59.4	49%	0.487	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-32.1	176.5	-73	178	0	0	0	113.6	W160 Q161 E166	W160-L164 HydrophobicContact CD2-CD1 4.23Å; W160-L164 HydrophobicContact CG-CD1 4.4Å; W160-L164 HydrophobicContact CZ2-CD1 4.05Å; W160-L164 WeakPolarHBondContact O-CG 3.5Å; W160-L164 PolarHBondContact O-N 3.15Å; Q161-L164 PolarHBondContact O-N 2.83Å; L164-E166 VanDerWaalsContact C-N 3.3Å
165	L	76.4	Confident	84	Confident	114 Å²	114	56.6 Å²	56.6	60%	0.597	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	0.8	178.1	-68	172.5	0	0	0	113.4	Q161 N162 K167	Q161-L165 WeakPolarHBondContact O-CB 3.44Å; Q161-L165 VanDerWaalsContact O-CG 3.28Å; Q161-L165 WeakPolarHBondContact O-CG 3.36Å; Q161-L165 PolarHBondContact O-N 2.93Å; N162-L165 PolarHBondContact O-N 3.01Å; L165-K167 HydrophobicContact CB-CB 4.47Å; L165-K167 HydrophobicContact CB-CD 4.37Å; L165-K167 HydrophobicContact CB-CG 4.33Å; L165-K167 PolarHBondContact O-N 3.48Å
166	E	78.2	Confident	83.7	Confident	143 Å²	143	60.9 Å²	60.9	67%	0.668	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	32.8	-172.9	-49	-152.8	126.8	0	0	113.6	K114 N162 A163 L164 P168	K114-E166 IonicContact NZ-OE1 3.68Å; K114-E166 PolarHBondContact NZ-OE1 2.76Å; N162-E166 PolarHBondContact O-N 2.74Å; A163-E166 PolarHBondContact O-N 3.18Å; L164-E166 VanDerWaalsContact C-N 3.3Å; E166-P168 VanDerWaalsContact O-CD 3.3Å; E166-P168 WeakPolarHBondContact O-CD 3.44Å
167	K	78.6	Confident	83.3	Confident	139 Å²	139	61.9 Å²	61.9	60%	0.604	31%	0.309	S	S	*	.			trans	-108.8	91.1	178.8	-72.5	-179.1	-178	-171.5	0	109.8	N162 L165	N162-K167 VanDerWaalsContact CB-O 3.27Å; N162-K167 WeakPolarHBondContact CB-O 3.39Å; N162-K167 PolarHBondContact ND2-O 3.36Å; N162-K167 PolarHBondContact O-N 2.93Å; L165-K167 HydrophobicContact CB-CB 4.47Å; L165-K167 HydrophobicContact CB-CD 4.37Å; L165-K167 HydrophobicContact CB-CG 4.33Å; L165-K167 PolarHBondContact O-N 3.48Å
168	P	77.3	Confident	83.2	Confident	95 Å²	95	59.1 Å²	59.1	62%	0.617	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-59.9	157.8	173.9	27.2	-34.8	0	0	0	110.7	E166	E166-P168 VanDerWaalsContact O-CD 3.3Å; E166-P168 WeakPolarHBondContact O-CD 3.44Å
169	L	80.6	Confident	82.9	Confident	13 Å²	13	58 Å²	58	7%	0.068	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-67.3	136.6	172.2	-70.3	172	0	0	0	108.8	I72 L159 N162 E173 L174 F177	I72-L169 HydrophobicContact CD1-CD1 3.72Å; L159-L169 HydrophobicContact CD2-CD1 3.78Å; N162-L169 WeakPolarHBondContact ND2-CD2 3.27Å; L169-E173 HydrophobicContact CD2-CB 4.16Å; L169-E173 WeakPolarHBondContact CD2-OE2 3.3Å; L169-L174 HydrophobicContact CB-CB 4.39Å; L169-F177 HydrophobicContact CD1-CD2 4.27Å; L169-F177 HydrophobicContact CD1-CE2 4.48Å; L169-F177 HydrophobicContact CD2-CE2 4.07Å
170	C	83.6	Confident	82.5	Confident	64 Å²	64	62.9 Å²	62.9	43%	0.432	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-71.1	152.2	167.1	77.7	0	0	0	0	109.3	K172 E173 L174	C170-K172 PolarHBondContact O-N 2.99Å; C170-K172 VanDerWaalsContact O-N 3.1Å; C170-E173 PolarHBondContact O-N 3Å; C170-L174 PolarHBondContact O-N 3.32Å; C170-L174 VanDerWaalsContact O-N 3.09Å
171	P	82	Confident	82.3	Confident	72 Å²	72	63.1 Å²	63.1	47%	0.468	32%	0.323	S	S	.	.	H	α-helix	trans	-54	-35.8	-177.2	-30	36.3	0	0	0	113.8	E173 L174 W175 V196	P171-E173 PolarHBondContact O-N 2.91Å; P171-L174 PolarHBondContact O-N 3.35Å; P171-W175 PolarHBondContact O-N 3.11Å; P171-V196 HydrophobicContact CB-CG2 4.39Å
172	K	81.3	Confident	82.2	Confident	106 Å²	106	61.7 Å²	61.7	46%	0.461	32%	0.315	S	S	.	.	H	α-helix	trans	-59.9	-44.2	174.8	-68.4	-146.9	168.3	-156.2	0	112.8	C170 H176 V196 D199	C170-K172 PolarHBondContact O-N 2.99Å; C170-K172 VanDerWaalsContact O-N 3.1Å; K172-H176 WeakPolarHBondContact O-CB 3.29Å; K172-H176 PolarHBondContact O-N 2.98Å; K172-V196 HydrophobicContact CG-CG1 4.25Å; K172-D199 IonicContact NZ-OD2 3.8Å; K172-D199 PolarHBondContact NZ-OD2 3.28Å
173	E	83.1	Confident	82	Confident	76 Å²	76	61.7 Å²	61.7	36%	0.355	32%	0.322	S	S	.	.	H	α-helix	trans	-69.3	-39.9	177.5	-73.3	-163.2	141.9	0	0	112.2	R158 L169 C170 P171 H176 F177	R158-E173 IonicContact CZ-OE1 3.67Å; R158-E173 IonicContact CZ-OE2 3.01Å; R158-E173 IonicContact NH2-OE1 3.44Å; R158-E173 PolarHBondContact NH2-OE1 3.46Å; R158-E173 IonicContact NH2-OE2 3.81Å; R158-E173 PolarHBondContact NH2-OE2 2.87Å; L169-E173 HydrophobicContact CD2-CB 4.16Å; L169-E173 WeakPolarHBondContact CD2-OE2 3.3Å; C170-E173 PolarHBondContact O-N 3Å; P171-E173 PolarHBondContact O-N 2.91Å; E173-H176 PolarHBondContact O-N 3.47Å; E173-F177 WeakPolarHBondContact O-CD2 3.36Å; E173-F177 PolarHBondContact O-N 3.05Å
174	L	86.8	Confident	81.6	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-60.5	-49.9	176.9	-176.2	148.5	0	0	0	110.9	R70 I72 E93 L169 C170 P171 H176 F177 V178	R70-L174 HydrophobicContact CB-CD1 4.43Å; R70-L174 HydrophobicContact CG-CD2 4.31Å; I72-L174 HydrophobicContact CG1-CD1 4.29Å; I72-L174 HydrophobicContact CG1-CG 4.42Å; E93-L174 HydrophobicContact CG-CD1 3.88Å; E93-L174 WeakPolarHBondContact OE1-CD1 3.21Å; L169-L174 HydrophobicContact CB-CB 4.39Å; C170-L174 PolarHBondContact O-N 3.32Å; C170-L174 VanDerWaalsContact O-N 3.09Å; P171-L174 PolarHBondContact O-N 3.35Å; L174-H176 VanDerWaalsContact C-N 3.35Å; L174-H176 PolarHBondContact O-N 3.18Å; L174-F177 PolarHBondContact O-N 2.79Å; L174-V178 HydrophobicContact CD2-CG2 4.04Å; L174-V178 WeakPolarHBondContact O-CG2 3.47Å; L174-V178 PolarHBondContact O-N 3.48Å
175	W	85.3	Confident	81.6	Confident	6 Å²	6	68.9 Å²	68.9	2%	0.023	36%	0.356	C	S	.	.	H	α-helix	trans	-66.6	-35.4	179.1	-70.4	119.7	0	0	0	112.7	Y51 P171 F177 V178 H179 L186 L188 D194 Y195 V196	Y51-W175 HydrophobicContact CD1-CZ3 4.18Å; Y51-W175 AromaticContact CE1-CH2 3.87Å; Y51-W175 HydrophobicContact CE1-CH2 3.87Å; Y51-W175 AromaticContact CE1-CZ3 3.54Å; Y51-W175 HydrophobicContact CE1-CZ3 3.54Å; P171-W175 PolarHBondContact O-N 3.11Å; W175-F177 VanDerWaalsContact C-N 3.33Å; W175-F177 PolarHBondContact O-N 3.39Å; W175-V178 HydrophobicContact CE3-CB 4.03Å; W175-V178 HydrophobicContact CE3-CG1 4.02Å; W175-V178 HydrophobicContact CE3-CG2 4.31Å; W175-V178 HydrophobicContact CZ3-CB 4.41Å; W175-V178 HydrophobicContact CZ3-CG1 4.01Å; W175-V178 HydrophobicContact CZ3-CG2 4.49Å; W175-V178 PolarHBondContact O-N 3.03Å; W175-H179 WeakPolarHBondContact O-CB 3.47Å; W175-H179 PolarHBondContact O-CD2 2.87Å; W175-H179 PolarHBondContact O-N 3.46Å; W175-L186 HydrophobicContact CE3-CD1 4.01Å; W175-L186 HydrophobicContact CZ3-CD1 4.02Å; W175-L188 HydrophobicContact CE3-CD1 4.31Å; W175-L188 HydrophobicContact CH2-CD1 3.39Å; W175-L188 HydrophobicContact CZ2-CD1 4.39Å; W175-L188 HydrophobicContact CZ3-CD1 3.34Å; W175-D194 PolarHBondContact NE1-O 2.87Å; W175-Y195 AromaticContact CD2-CD2 3.85Å; W175-Y195 HydrophobicContact CD2-CD2 3.85Å; W175-Y195 HydrophobicContact CD2-CE2 4.4Å; W175-Y195 AromaticContact CE2-CD2 3.97Å; W175-Y195 AromaticContact CE3-CD2 3.88Å; W175-Y195 HydrophobicContact CE3-CD2 3.88Å; W175-Y195 HydrophobicContact CE3-CE2 4.19Å; W175-Y195 HydrophobicContact CG-CD2 4.43Å; W175-Y195 HydrophobicContact CH2-CD2 4.19Å; W175-Y195 HydrophobicContact CZ2-CD2 4.14Å; W175-Y195 HydrophobicContact CZ3-CD2 4.06Å; W175-V196 VanDerWaalsContact CD1-N 3.34Å; W175-V196 HydrophobicContact CG-CB 4.39Å
176	H	83.9	Confident	81.6	Confident	105 Å²	105	63.6 Å²	63.6	49%	0.486	33%	0.328	S	S	.	.	H	α-helix	trans	-57.4	-44.6	170.9	-177.2	92.4	0	0	0	111.9	K172 E173 L174 H179 Q180	K172-H176 WeakPolarHBondContact O-CB 3.29Å; K172-H176 PolarHBondContact O-N 2.98Å; E173-H176 PolarHBondContact O-N 3.47Å; L174-H176 VanDerWaalsContact C-N 3.35Å; L174-H176 PolarHBondContact O-N 3.18Å; H176-H179 PolarHBondContact O-N 2.86Å; H176-Q180 WeakPolarHBondContact O-CB 3.37Å; H176-Q180 PolarHBondContact O-N 3.28Å
177	F	85.3	Confident	81.4	Confident	21 Å²	21	58.9 Å²	58.9	9%	0.092	32%	0.318	C	S	.	.	H	α-helix	trans	-66	-42.9	175.9	-73	-52.6	0	0	0	113.1	I72 M155 L169 E173 L174 W175 H179 Q180 C181	I72-F177 HydrophobicContact CG2-CB 3.9Å; M155-F177 HydrophobicContact CE-CB 4.21Å; M155-F177 HydrophobicContact CE-CD1 3.52Å; M155-F177 HydrophobicContact CE-CE1 4.04Å; M155-F177 HydrophobicContact CE-CG 3.94Å; M155-F177 HydrophobicContact SD-CD1 4.27Å; M155-F177 HydrophobicContact SD-CE1 4.43Å; M155-F177 HydrophobicContact SD-CG 4.42Å; L169-F177 HydrophobicContact CD1-CD2 4.27Å; L169-F177 HydrophobicContact CD1-CE2 4.48Å; L169-F177 HydrophobicContact CD2-CE2 4.07Å; E173-F177 WeakPolarHBondContact O-CD2 3.36Å; E173-F177 PolarHBondContact O-N 3.05Å; L174-F177 PolarHBondContact O-N 2.79Å; W175-F177 VanDerWaalsContact C-N 3.33Å; W175-F177 PolarHBondContact O-N 3.39Å; F177-H179 PolarHBondContact O-N 3.23Å; F177-Q180 PolarHBondContact O-N 3.31Å; F177-C181 WeakPolarHBondContact O-CB 3.27Å; F177-C181 PolarHBondContact O-N 2.84Å; F177-C181 PolarHBondContact O-SG 2.86Å
178	V	86.4	Confident	81.2	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.8	-45.8	176.4	171.5	0	0	0	0	110.5	Y51 L174 W175 Q180 C181 Y182 L186	Y51-V178 HydrophobicContact CD1-CG1 3.88Å; Y51-V178 HydrophobicContact CD2-CG1 3.51Å; Y51-V178 HydrophobicContact CE1-CG1 3.95Å; Y51-V178 HydrophobicContact CE2-CB 4.39Å; Y51-V178 HydrophobicContact CE2-CG1 3.55Å; Y51-V178 HydrophobicContact CE2-CG2 3.87Å; Y51-V178 HydrophobicContact CG-CG1 3.66Å; L174-V178 HydrophobicContact CD2-CG2 4.04Å; L174-V178 WeakPolarHBondContact O-CG2 3.47Å; L174-V178 PolarHBondContact O-N 3.48Å; W175-V178 HydrophobicContact CE3-CB 4.03Å; W175-V178 HydrophobicContact CE3-CG1 4.02Å; W175-V178 HydrophobicContact CE3-CG2 4.31Å; W175-V178 HydrophobicContact CZ3-CB 4.41Å; W175-V178 HydrophobicContact CZ3-CG1 4.01Å; W175-V178 HydrophobicContact CZ3-CG2 4.49Å; W175-V178 PolarHBondContact O-N 3.03Å; V178-Q180 PolarHBondContact O-N 2.84Å; V178-C181 PolarHBondContact O-N 3.09Å; V178-C181 VanDerWaalsContact O-N 3.15Å; V178-Y182 HydrophobicContact CG1-CD2 4.1Å; V178-Y182 WeakPolarHBondContact O-CD2 3.38Å; V178-Y182 PolarHBondContact O-N 3.1Å; V178-L186 HydrophobicContact CG1-CD1 3.66Å; V178-L186 HydrophobicContact CG1-CD2 3.71Å; V178-L186 HydrophobicContact CG1-CG 4.35Å
179	H	82.8	Confident	80.9	Confident	18 Å²	18	52.7 Å²	52.7	8%	0.083	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-38.9	173.9	-76.5	-58.9	0	0	0	113	W175 H176 F177 C181 G183 L186 Y195	W175-H179 WeakPolarHBondContact O-CB 3.47Å; W175-H179 PolarHBondContact O-CD2 2.87Å; W175-H179 PolarHBondContact O-N 3.46Å; H176-H179 PolarHBondContact O-N 2.86Å; F177-H179 PolarHBondContact O-N 3.23Å; H179-C181 PolarHBondContact O-N 2.95Å; H179-G183 PolarHBondContact ND1-O 3.5Å; H179-G183 VanDerWaalsContact O-CA 3.23Å; H179-G183 WeakPolarHBondContact O-CA 3.32Å; H179-G183 PolarHBondContact O-N 2.74Å; H179-L186 WeakPolarHBondContact CE1-CD1 3.16Å; H179-Y195 PolarHBondContact CE1-OH 3.36Å; H179-Y195 AromaticContact NE2-CE2 3.62Å; H179-Y195 AromaticContact NE2-CZ 3.94Å; H179-Y195 PolarHBondContact NE2-OH 2.83Å
180	Q	82.1	Confident	79.9	Confident	104 Å²	104	57.3 Å²	57.3	49%	0.486	32%	0.322	S	S	.	.	H	α-helix	trans	-68.7	-14.6	176	-154.2	-157.3	64.6	0	0	113.8	R151 H176 F177 V178	R151-Q180 PolarHBondContact NH2-O 3.01Å; H176-Q180 WeakPolarHBondContact O-CB 3.37Å; H176-Q180 PolarHBondContact O-N 3.28Å; F177-Q180 PolarHBondContact O-N 3.31Å; V178-Q180 PolarHBondContact O-N 2.84Å
181	C	83.1	Confident	78.8	Confident	38 Å²	38	60.3 Å²	60.3	26%	0.257	33%	0.333	S	S	.	.	H	α-helix	trans	-106.1	-33	-179.6	-74.5	0	0	0	0	113.7	V73 F177 V178 H179	V73-C181 HydrophobicContact CB-CB 4.34Å; V73-C181 HydrophobicContact CG2-CB 4.01Å; V73-C181 VanDerWaalsContact CG2-SG 3.59Å; F177-C181 WeakPolarHBondContact O-CB 3.27Å; F177-C181 PolarHBondContact O-N 2.84Å; F177-C181 PolarHBondContact O-SG 2.86Å; V178-C181 PolarHBondContact O-N 3.09Å; V178-C181 VanDerWaalsContact O-N 3.15Å; H179-C181 PolarHBondContact O-N 2.95Å
182	Y	82.3	Confident	78.5	Confident	48 Å²	48	58.7 Å²	58.7	19%	0.188	32%	0.321	C	S	.	.	H	α-helix	trans	-122.3	-5.3	-174.4	-59.7	-77.3	0	0	0	114.6	Y51 V73 D74 V178	Y51-Y182 AromaticContact CD2-CD2 3.54Å; Y51-Y182 HydrophobicContact CD2-CD2 3.54Å; Y51-Y182 AromaticContact CD2-CE2 3.63Å; Y51-Y182 HydrophobicContact CD2-CE2 3.63Å; Y51-Y182 HydrophobicContact CD2-CG 4.15Å; Y51-Y182 HydrophobicContact CE2-CD2 4.33Å; Y51-Y182 HydrophobicContact CE2-CE2 4.14Å; Y51-Y182 HydrophobicContact CG-CD2 4.3Å; V73-Y182 WeakPolarHBondContact CA-OH 3.25Å; D74-Y182 PolarHBondContact N-OH 2.91Å; D74-Y182 WeakPolarHBondContact OD1-CE1 3.38Å; D74-Y182 PolarHBondContact OD1-OH 2.89Å; V178-Y182 HydrophobicContact CG1-CD2 4.1Å; V178-Y182 WeakPolarHBondContact O-CD2 3.38Å; V178-Y182 PolarHBondContact O-N 3.1Å
183	G	81	Confident	77.5	Confident	30 Å²	30	61.4 Å²	61.4	31%	0.309	34%	0.335	S	S	.	.			trans	82.6	-167.7	-179	0	0	0	0	0	113.7	H179 L186	H179-G183 PolarHBondContact ND1-O 3.5Å; H179-G183 VanDerWaalsContact O-CA 3.23Å; H179-G183 WeakPolarHBondContact O-CA 3.32Å; H179-G183 PolarHBondContact O-N 2.74Å; G183-L186 WeakPolarHBondContact O-CD2 3.37Å
184	N	75.1	Confident	76.7	Confident	121 Å²	121	62.2 Å²	62.2	65%	0.647	34%	0.342	S	S	*	.	S	Bend	trans	-85.4	-23.6	-174.8	-62.9	11	0	0	0	112.7	L186	N184-L186 VanDerWaalsContact C-N 3.26Å; N184-L186 PolarHBondContact O-N 2.97Å
185	E	77.4	Confident	76.2	Confident	130 Å²	130	64.7 Å²	64.7	61%	0.607	35%	0.352	S	S	*	.			trans	-83.9	58.2	178.5	-62.8	-167.7	152.9	0	0	111.9	Q41 G187	Q41-E185 PolarHBondContact NE2-OE1 3.3Å; E185-G187 PolarHBondContact O-N 3.46Å; E185-G187 VanDerWaalsContact O-N 3.16Å
186	L	78	Confident	75.5	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	36%	0.361	C	S	.	.			trans	-65.3	-17.2	-176.2	-63.6	-173.7	0	0	0	114.8	Y51 K52 W175 V178 H179 G183 N184 L188 Y195	Y51-L186 HydrophobicContact CD1-CB 4.38Å; Y51-L186 HydrophobicContact CD1-CD1 4.48Å; Y51-L186 HydrophobicContact CG-CD2 4.19Å; Y51-L186 PolarHBondContact N-O 3.33Å; K52-L186 PolarHBondContact N-O 2.83Å; K52-L186 VanDerWaalsContact N-O 3.13Å; W175-L186 HydrophobicContact CE3-CD1 4.01Å; W175-L186 HydrophobicContact CZ3-CD1 4.02Å; V178-L186 HydrophobicContact CG1-CD1 3.66Å; V178-L186 HydrophobicContact CG1-CD2 3.71Å; V178-L186 HydrophobicContact CG1-CG 4.35Å; H179-L186 WeakPolarHBondContact CE1-CD1 3.16Å; G183-L186 WeakPolarHBondContact O-CD2 3.37Å; N184-L186 VanDerWaalsContact C-N 3.26Å; N184-L186 PolarHBondContact O-N 2.97Å; L186-L188 VanDerWaalsContact C-N 3.35Å; L186-L188 HydrophobicContact CB-CD1 4Å; L186-L188 HydrophobicContact CB-CG 4.15Å; L186-L188 HydrophobicContact CD1-CD1 3.93Å; L186-Y195 HydrophobicContact CD1-CE2 3.94Å
187	G	72.8	Confident	74.7	Confident	44 Å²	44	64.8 Å²	64.8	45%	0.454	36%	0.361	S	S	.	.	S	Bend	trans	78.8	15.8	-174.3	0	0	0	0	0	114.4	K52 E185	K52-G187 VanDerWaalsContact CD-O 3.24Å; K52-G187 WeakPolarHBondContact CD-O 3.3Å; E185-G187 PolarHBondContact O-N 3.46Å; E185-G187 VanDerWaalsContact O-N 3.16Å
188	L	75.7	Confident	73.6	Confident	35 Å²	35	67 Å²	67	18%	0.183	38%	0.378	C	S	.	.			trans	-94.2	157	175.9	-61.2	166.7	0	0	0	111.2	Y51 K52 W175 L186 D192 Y195	Y51-L188 HydrophobicContact CD1-CD1 4.01Å; Y51-L188 HydrophobicContact CD1-CG 4.47Å; Y51-L188 HydrophobicContact CE1-CD1 4.18Å; K52-L188 HydrophobicContact CB-CD2 4.11Å; K52-L188 HydrophobicContact CD-CD2 4.06Å; K52-L188 HydrophobicContact CG-CD2 4.09Å; W175-L188 HydrophobicContact CE3-CD1 4.31Å; W175-L188 HydrophobicContact CH2-CD1 3.39Å; W175-L188 HydrophobicContact CZ2-CD1 4.39Å; W175-L188 HydrophobicContact CZ3-CD1 3.34Å; L186-L188 VanDerWaalsContact C-N 3.35Å; L186-L188 HydrophobicContact CB-CD1 4Å; L186-L188 HydrophobicContact CB-CG 4.15Å; L186-L188 HydrophobicContact CD1-CD1 3.93Å; L188-D192 WeakPolarHBondContact CA-OD2 3.49Å; L188-D192 HydrophobicContact CB-CB 4.37Å; L188-D192 HydrophobicContact CD2-CB 3.98Å; L188-D192 WeakPolarHBondContact CD2-OD2 3.48Å; L188-Y195 HydrophobicContact CB-CD1 4.5Å; L188-Y195 HydrophobicContact CB-CG 4.39Å; L188-Y195 HydrophobicContact CD1-CD2 3.69Å; L188-Y195 HydrophobicContact CD1-CE2 4.08Å; L188-Y195 HydrophobicContact CD1-CG 4.22Å
189	T	69.8	Low	72.3	Confident	68 Å²	68	71 Å²	71	42%	0.417	40%	0.399	S	S	.	.			trans	-109.5	174	171.3	58	0	0	0	0	111.3	D191 D192	T189-D191 PolarHBondContact O-N 2.79Å; T189-D191 VanDerWaalsContact O-N 3.13Å; T189-D191 PolarHBondContact OG1-N 2.56Å; T189-D192 PolarHBondContact N-OD2 3.05Å; T189-D192 PolarHBondContact O-N 3.29Å
190	S	59.3	Low	70.8	Confident	110 Å²	110	78.3 Å²	78.3	77%	0.769	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-14	167.4	44	0	0	0	0	114.2
191	D	61.8	Low	69	Low	127 Å²	127	80.6 Å²	80.6	68%	0.679	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	4	-170.4	-32.9	-28.6	0	0	0	110.7	T189	T189-D191 PolarHBondContact O-N 2.79Å; T189-D191 VanDerWaalsContact O-N 3.13Å; T189-D191 PolarHBondContact OG1-N 2.56Å
192	D	74.7	Confident	67.1	Low	39 Å²	39	83.7 Å²	83.7	21%	0.209	46%	0.464	C	S	.	.	S	Bend	trans	-87	109.2	168.1	-77.1	-56.9	0	0	0	109.2	K52 L188 T189 Y195	K52-D192 WeakPolarHBondContact CE-OD1 3.44Å; K52-D192 IonicContact NZ-OD1 2.7Å; K52-D192 PolarHBondContact NZ-OD1 2.88Å; K52-D192 IonicContact NZ-OD2 3.32Å; K52-D192 PolarHBondContact NZ-OD2 2.94Å; L188-D192 WeakPolarHBondContact CA-OD2 3.49Å; L188-D192 HydrophobicContact CB-CB 4.37Å; L188-D192 HydrophobicContact CD2-CB 3.98Å; L188-D192 WeakPolarHBondContact CD2-OD2 3.48Å; T189-D192 PolarHBondContact N-OD2 3.05Å; T189-D192 PolarHBondContact O-N 3.29Å; D192-Y195 VanDerWaalsContact O-CB 3.27Å; D192-Y195 WeakPolarHBondContact O-CB 3.49Å; D192-Y195 PolarHBondContact O-N 2.85Å; D192-Y195 VanDerWaalsContact O-N 3.14Å
193	E	60.3	Low	65.1	Low	163 Å²	163	89.2 Å²	89.2	76%	0.762	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	143.9	-175.3	-62.3	-68	162.8	0	0	113.9	R70 Y195	R70-E193 PolarHBondContact NH2-O 2.83Å; E193-Y195 PolarHBondContact O-N 2.88Å
194	D	66.6	Low	63.1	Low	92 Å²	92	93.7 Å²	93.7	49%	0.492	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	-4.8	-169.4	-44.6	-53.5	0	0	0	117.6	R70 W175 V196	R70-D194 IonicContact CZ-OD2 3.22Å; R70-D194 VanDerWaalsContact CZ-OD2 3.22Å; R70-D194 IonicContact NH1-OD2 3.26Å; R70-D194 PolarHBondContact NH1-OD2 2.9Å; R70-D194 IonicContact NH2-OD2 2.82Å; R70-D194 PolarHBondContact NH2-OD2 3.38Å; W175-D194 PolarHBondContact NE1-O 2.87Å; D194-V196 PolarHBondContact O-N 3.36Å
195	Y	76.4	Confident	61.2	Low	57 Å²	57	93.7 Å²	93.7	22%	0.224	52%	0.516	C	S	.	.			trans	-64.3	118.8	-172.6	178.7	-120.3	0	0	0	113.4	W175 H179 L186 L188 D192 E193 P197	W175-Y195 AromaticContact CD2-CD2 3.85Å; W175-Y195 HydrophobicContact CD2-CD2 3.85Å; W175-Y195 HydrophobicContact CD2-CE2 4.4Å; W175-Y195 AromaticContact CE2-CD2 3.97Å; W175-Y195 AromaticContact CE3-CD2 3.88Å; W175-Y195 HydrophobicContact CE3-CD2 3.88Å; W175-Y195 HydrophobicContact CE3-CE2 4.19Å; W175-Y195 HydrophobicContact CG-CD2 4.43Å; W175-Y195 HydrophobicContact CH2-CD2 4.19Å; W175-Y195 HydrophobicContact CZ2-CD2 4.14Å; W175-Y195 HydrophobicContact CZ3-CD2 4.06Å; H179-Y195 PolarHBondContact CE1-OH 3.36Å; H179-Y195 AromaticContact NE2-CE2 3.62Å; H179-Y195 AromaticContact NE2-CZ 3.94Å; H179-Y195 PolarHBondContact NE2-OH 2.83Å; L186-Y195 HydrophobicContact CD1-CE2 3.94Å; L188-Y195 HydrophobicContact CB-CD1 4.5Å; L188-Y195 HydrophobicContact CB-CG 4.39Å; L188-Y195 HydrophobicContact CD1-CD2 3.69Å; L188-Y195 HydrophobicContact CD1-CE2 4.08Å; L188-Y195 HydrophobicContact CD1-CG 4.22Å; D192-Y195 VanDerWaalsContact O-CB 3.27Å; D192-Y195 WeakPolarHBondContact O-CB 3.49Å; D192-Y195 PolarHBondContact O-N 2.85Å; D192-Y195 VanDerWaalsContact O-N 3.14Å; E193-Y195 PolarHBondContact O-N 2.88Å; Y195-P197 HydrophobicContact CE1-CB 4.2Å
196	V	71.6	Confident	59.3	Low	38 Å²	38	90.3 Å²	90.3	23%	0.23	52%	0.516	C	S	.	.			trans	-107.6	113.9	173.2	-173.2	0	0	0	0	109.3	P171 K172 W175 D194	P171-V196 HydrophobicContact CB-CG2 4.39Å; K172-V196 HydrophobicContact CG-CG1 4.25Å; W175-V196 VanDerWaalsContact CD1-N 3.34Å; W175-V196 HydrophobicContact CG-CB 4.39Å; D194-V196 PolarHBondContact O-N 3.36Å
197	P	67	Low	57	Low	74 Å²	74	99.7 Å²	99.7	48%	0.481	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-68.3	157.4	173.6	30.2	-35.1	0	0	0	111.4	Y195 D199	Y195-P197 HydrophobicContact CE1-CB 4.2Å; P197-D199 PolarHBondContact O-N 2.84Å
198	P	62.2	Low	54.9	Low	69 Å²	69	103 Å²	103	45%	0.448	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-73.5	123.9	177.7	29.8	-31.5	0	0	0	110.6
199	D	58.5	Low	52.7	Low	83 Å²	83	110 Å²	110	44%	0.444	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-67.2	129.6	172.5	-62	-52	0	0	0	109.8	K172 P197 D201 F202	K172-D199 IonicContact NZ-OD2 3.8Å; K172-D199 PolarHBondContact NZ-OD2 3.28Å; P197-D199 PolarHBondContact O-N 2.84Å; D199-D201 PolarHBondContact O-N 3.44Å; D199-F202 HydrophobicContact CB-CD2 4.09Å; D199-F202 PolarHBondContact O-N 2.84Å
200	D	50.5	Low	50.7	Low	172 Å²	172	114.9 Å²	114.9	92%	0.92	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-23.3	-175.7	-84.5	-47.8	0	0	0	113.9
201	D	44.2	Very low	49.3	Very low	151 Å²	151	117 Å²	117	81%	0.807	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	13.7	-176.5	-79.3	-49	0	0	0	114.6	D199 N203	D199-D201 PolarHBondContact O-N 3.44Å; D201-N203 PolarHBondContact O-N 2.86Å
202	F	44	Very low	47.7	Very low	103 Å²	103	116.5 Å²	116.5	45%	0.452	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.8	44.8	-169.7	-137.6	-90.4	0	0	0	116.4	D199 M205	D199-F202 HydrophobicContact CB-CD2 4.09Å; D199-F202 PolarHBondContact O-N 2.84Å; F202-M205 HydrophobicContact CE1-CB 3.71Å; F202-M205 HydrophobicContact CE2-CB 3.98Å; F202-M205 HydrophobicContact CE2-CG 4.34Å; F202-M205 HydrophobicContact CZ-CB 3.39Å; F202-M205 HydrophobicContact CZ-CG 3.82Å
203	N	39.8	Very low	45.6	Very low	164 Å²	164	121.1 Å²	121.1	88%	0.877	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-3.6	161	-81.1	-60	0	0	0	112.9	D201	D201-N203 PolarHBondContact O-N 2.86Å
204	T	39.8	Very low	44.3	Very low	124 Å²	124	121.8 Å²	121.8	76%	0.761	65%	0.654	S	S	*	*			trans	-135.7	86.9	-178.5	-57.7	0	0	0	0	111.3
205	M	35.7	Very low	42.6	Very low	122 Å²	122	125.7 Å²	125.7	60%	0.601	67%	0.67	S	S	*	*			trans	-143	76.3	160.9	-158.7	74.4	-159.1	0	0	110.5	F202 Y207	F202-M205 HydrophobicContact CE1-CB 3.71Å; F202-M205 HydrophobicContact CE2-CB 3.98Å; F202-M205 HydrophobicContact CE2-CG 4.34Å; F202-M205 HydrophobicContact CZ-CB 3.39Å; F202-M205 HydrophobicContact CZ-CG 3.82Å; M205-Y207 WeakPolarHBondContact CE-O 3.44Å
206	G	35.9	Very low	40.3	Very low	59 Å²	59	130.3 Å²	130.3	61%	0.608	70%	0.698	S	S	*	*			trans	-82.8	158.4	154.1	0	0	0	0	0	109.6
207	Y	30.2	Very low	38.3	Very low	200 Å²	200	136.7 Å²	136.7	78%	0.784	73%	0.725	S	S	*	*			trans	61.7	120.2	-177.7	-81.3	-99.2	0	0	0	116.6	M205	M205-Y207 WeakPolarHBondContact CE-O 3.44Å
208	C	28.7	Very low	36.6	Very low	113 Å²	113	139.1 Å²	139.1	76%	0.764	74%	0.739	S	S	*	*			trans	-109.5	154.6	137.8	-68.7	0	0	0	0	106.9
209	E	28.7	Very low	34.8	Very low	182 Å²	182	143.7 Å²	143.7	85%	0.85	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-65.9	154.8	-160.2	-67	134.4	118	0	0	116
210	E	29.2	Very low	33.3	Very low	170 Å²	170	146.7 Å²	146.7	79%	0.794	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-72.2	138.4	160	-62.6	-177.5	136.8	0	0	109.4
211	I	30.3	Very low	32.1	Very low	156 Å²	156	143.1 Å²	143.1	80%	0.8	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-81.1	128.2	173.9	-57.1	175.8	0	0	0	107.8	V213	I211-V213 PolarHBondContact O-N 3.34Å
212	P	28.4	Very low	31.3	Very low	116 Å²	116	140.8 Å²	140.8	75%	0.753	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-58.8	134.9	173.8	-23.5	33.9	0	0	0	111.5
213	V	30.4	Very low	30.5	Very low	135 Å²	135	141.3 Å²	141.3	82%	0.818	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-81.5	116.4	169.6	179.8	0	0	0	0	107.8	I211 E215	I211-V213 PolarHBondContact O-N 3.34Å; V213-E215 PolarHBondContact O-N 3.34Å
214	E	32.7	Very low	29.9	Very low	178 Å²	178	143.1 Å²	143.1	83%	0.832	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.3	118	166.2	-76.3	-163	151.6	0	0	109.8
215	E	31	Very low	29.1	Very low	174 Å²	174	141.7 Å²	141.7	81%	0.813	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-73.1	142	172.3	-60.8	177.9	142.1	0	0	110.6	V213	V213-E215 PolarHBondContact O-N 3.34Å
216	N	28.1	Very low	28.7	Very low	153 Å²	153	141 Å²	141	82%	0.818	78%	0.778	S	S	*	*			trans	-147.6	71.6	164.2	-96.9	-73.7	0	0	0	110.3
217	E	29.2	Very low	28.3	Very low	172 Å²	172	146.1 Å²	146.1	80%	0.804	79%	0.79	S	S	*	*			trans	-63.3	153.2	146.7	-66.6	-161.9	154.4	0	0	109
218	V	30.4	Very low	28.1	Very low	126 Å²	126	145.1 Å²	145.1	76%	0.764	79%	0.792	S	S	*	*			cis	-158.4	154.2	2.2	-114.6	0	0	0	0	107.7
219	N	26	Very low	27.9	Very low	165 Å²	165	146.7 Å²	146.7	88%	0.882	80%	0.798	S	S	*	*				-163.8	170.5	129	-136.9	-28.4	0	0	0	113.6
220	D	25.7	Very low	27.7	Very low	145 Å²	145	147.3 Å²	147.3	78%	0.775	80%	0.798	S	S	*	*			trans	-106.5	178	-151.8	-125	-41.8	0	0	0	116.7
221	S	25.4	Very low	28.5	Very low	98 Å²	98	144.2 Å²	144.2	69%	0.685	79%	0.793	S	S	*	*			trans	93	101.2	147.1	75.1	0	0	0	0	123
222	S	27.1	Very low	28.1	Very low	101 Å²	101	143.8 Å²	143.8	71%	0.706	79%	0.793	S	S	*	*				44	113.9	126.6	67.1	0	0	0	0	123.7
223	S	26.9	Very low	27.9	Very low	115 Å²	115	142.7 Å²	142.7	80%	0.804	79%	0.793	S	S	*	*				58.1	142	117	-50	0	0	0	0	123.4
224	K	27.5	Very low	27.6	Very low	201 Å²	201	141.5 Å²	141.5	87%	0.874	79%	0.791	S	S	*	*			trans	75.4	148.3	170.7	-68.9	-178.4	177.8	176.9	0	115.9
225	S	24.5	Very low	27.9	Very low	94 Å²	94	138 Å²	138	66%	0.657	78%	0.784	S	S	*	*			cis	-165	144.5	-13.7	46.7	0	0	0	0	112.5
226	S	25.5	Very low	27.6	Very low	107 Å²	107	138 Å²	138	75%	0.748	78%	0.784	S	S	*	*			trans	23.6	130.9	148.3	61.1	0	0	0	0	121.7
227	I	27.5	Very low	27.3	Very low	168 Å²	168	137.7 Å²	137.7	86%	0.862	78%	0.781	S	S	*	*			trans	-135.4	139.6	135.5	-162.2	66.1	0	0	0	109.4
228	E	26.6	Very low	27.5	Very low	179 Å²	179	135.4 Å²	135.4	84%	0.836	78%	0.781	S	S	*	*			trans	-110.3	150.9	177.1	-66.1	-175.7	109.1	0	0	111
229	T	24.4	Very low	27.2	Very low	145 Å²	145	138.3 Å²	138.3	89%	0.89	78%	0.784	S	S	*	*			trans	-162.6	145.9	145.8	-1.5	0	0	0	0	112.1
230	K	24.1	Very low	27	Very low	195 Å²	195	140.5 Å²	140.5	85%	0.848	79%	0.785	S	S	*	*			trans	-168	170.4	-176.3	-128.1	-170.2	177.4	-178.4	0	107.4
231	P	46.9	Very low	26.8	Very low	106 Å²	106	138.6 Å²	138.6	69%	0.688	78%	0.783	S	S	*	*			cis	-109.2	-125.2	-17.8	19.3	6.6	0	0	0	108.4
232	D	22.8	Very low	26.8	Very low	147 Å²	147	141.7 Å²	141.7	79%	0.786	79%	0.79	S	S	*	*			cis	-164	-166.5	-6.8	-145.1	-50.8	0	0	0	109.9
233	A	23.5	Very low	26.6	Very low	93 Å²	93	142.3 Å²	142.3	77%	0.769	79%	0.79	S	S	*	*			trans	85.4	135.4	167.4	0	0	0	0	0	118.3
234	S	23	Very low	26.4	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	79%	0.792	S	S	*	*			trans	-140.6	175.4	-171.3	-174.1	0	0	0	0	109.8
235	P	40.2	Very low	26.2	Very low	106 Å²	106	139.8 Å²	139.8	69%	0.688	79%	0.786	S	S	*	*				-155.8	156.7	103.7	37	-17.8	0	0	0	119.6
236	Q	23.7	Very low	26.1	Very low	174 Å²	174	142 Å²	142	81%	0.813	80%	0.795	S	S	*	*			trans	63.7	119.7	146.7	-66.9	173.2	27.2	0	0	121.3
237	L	23.2	Very low	26.1	Very low	145 Å²	145	144 Å²	144	76%	0.759	80%	0.797	S	S	*	*				67.4	149.2	63.2	-76.2	171.6	0	0	0	115
238	P	33	Very low	26	Very low	125 Å²	125	141.6 Å²	141.6	81%	0.812	79%	0.79	S	S	*	*			cis	-137.7	173.9	31.9	42.4	-24.5	0	0	0	119.1
239	K	23.8	Very low	25.9	Very low	186 Å²	186	138.4 Å²	138.4	81%	0.809	79%	0.788	S	S	*	*			trans	-93.3	167.5	168.9	-58.5	176.1	180	178	0	111.4
240	K	22	Very low	26.1	Very low	211 Å²	211	137.5 Å²	137.5	92%	0.917	78%	0.782	S	S	*	*			trans	-128.5	141.6	140.4	-85	-165.7	175.7	-176.4	0	110.9
241	S	21.6	Very low	26.2	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	78%	0.777	S	S	*	*			trans	-116.5	176.9	167.8	52.8	0	0	0	0	108.6
242	I	24.3	Very low	25.2	Very low	163 Å²	163	132.2 Å²	132.2	84%	0.836	78%	0.783	S	S	*	*				-178.3	140.2	128.4	-95.8	157.3	0	0	0	109.5
243	T	23.1	Very low	25.5	Very low	115 Å²	115	129.6 Å²	129.6	71%	0.706	78%	0.777	S	S	*	*			trans	-97.8	156.6	166.4	51.1	0	0	0	0	109.6
244	N	23.4	Very low	25.6	Very low	156 Å²	156	133.6 Å²	133.6	83%	0.834	78%	0.78	S	S	*	*				-179.3	156.4	123.2	-88.3	-3.6	0	0	0	113.2
245	S	23.3	Very low	25.8	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	78%	0.777	S	S	*	*			trans	-69.4	157.9	-176	51.2	0	0	0	0	116.3
246	T	22.5	Very low	25.9	Very low	139 Å²	139	132.7 Å²	132.7	85%	0.853	78%	0.778	S	S	*	*			trans	-156.6	157.1	136.6	-75.4	0	0	0	0	110.5
247	L	25.5	Very low	26	Very low	151 Å²	151	131.3 Å²	131.3	79%	0.791	78%	0.782	S	S	*	*			trans	-65.6	177.9	-177.1	-58.1	153.2	0	0	0	112.9
248	T	24.6	Very low	26.1	Very low	116 Å²	116	129.7 Å²	129.7	71%	0.712	78%	0.782	S	S	*	*			cis	-167.6	154.2	27.1	-18.3	0	0	0	0	112.2
249	S	25.9	Very low	25.8	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	78%	0.784	S	S	*	*			trans	48.2	154.3	146.2	-96.9	0	0	0	0	122.5
250	T	26.8	Very low	25.8	Very low	126 Å²	126	130.5 Å²	130.5	77%	0.773	78%	0.78	S	S	*	*			cis	-124.5	150.8	-1.9	46.9	0	0	0	0	108.7
251	G	26.6	Very low	25.9	Very low	72 Å²	72	124.1 Å²	124.1	74%	0.742	77%	0.774	S	S	*	*			cis	93.2	135	49.7	0	0	0	0	0	108.7
252	S	27.4	Very low	26.1	Very low	117 Å²	117	127.2 Å²	127.2	82%	0.818	78%	0.782	S	S	*	*			cis	-164.9	167.9	11.3	34	0	0	0	0	107.4
253	S	27.2	Very low	26.4	Very low	92 Å²	92	124.5 Å²	124.5	64%	0.643	77%	0.774	S	S	*	*			cis	-177.3	173.7	-8.2	-92.5	0	0	0	0	106.9
254	E	26	Very low	26.6	Very low	178 Å²	178	125.3 Å²	125.3	83%	0.832	77%	0.774	S	S	*	*			cis	-157.7	-172	-3.8	-123.3	146.5	-114.1	0	0	110.4
255	A	27.7	Very low	26.9	Very low	86 Å²	86	125.4 Å²	125.4	71%	0.711	77%	0.769	S	S	*	*			trans	-145.6	175.1	170	0	0	0	0	0	107.7
256	P	42.7	Very low	27.3	Very low	110 Å²	110	127.6 Å²	127.6	71%	0.714	77%	0.768	S	S	*	*			cis	-159.7	-165.3	48.5	41.4	-15.5	0	0	0	118.4
257	V	25.3	Very low	27.6	Very low	145 Å²	145	129.3 Å²	129.3	88%	0.879	77%	0.766	S	S	*	*			trans	68.8	159.8	157.2	-65.4	0	0	0	0	122.5
258	S	26.3	Very low	27.6	Very low	111 Å²	111	125.2 Å²	125.2	78%	0.776	75%	0.754	S	S	*	*			trans	-116.1	152.2	-163.4	52.7	0	0	0	0	113.9
259	F	25.4	Very low	27.9	Very low	191 Å²	191	126.6 Å²	126.6	84%	0.838	76%	0.756	S	S	*	*			trans	-168.8	-178.2	133.3	-160.6	-119.2	0	0	0	111.7
260	D	24.9	Very low	28	Very low	137 Å²	137	130 Å²	130	73%	0.733	76%	0.759	S	S	*	*			trans	-63.6	155.9	-178.4	-71.2	-50	0	0	0	115.6
261	G	23.9	Very low	28	Very low	77 Å²	77	127.3 Å²	127.3	79%	0.794	76%	0.757	S	S	*	*			trans	145.9	112.9	155	0	0	0	0	0	117.8
262	L	24.8	Very low	28	Very low	170 Å²	170	132.4 Å²	132.4	89%	0.89	77%	0.767	S	S	*	*			trans	-79.1	163.3	148.7	-78.1	170.1	0	0	0	108.6
263	P	32.4	Very low	28	Very low	106 Å²	106	129.8 Å²	129.8	69%	0.688	76%	0.759	S	S	*	*			cis	-147.6	169.9	37.5	29.1	-2.7	0	0	0	119.9
264	L	26.9	Very low	27.9	Very low	132 Å²	132	130.8 Å²	130.8	69%	0.691	77%	0.766	S	S	*	*			trans	53	123.9	140.2	-60.4	170.8	0	0	0	121.5
265	E	29.3	Very low	28.1	Very low	158 Å²	158	129.7 Å²	129.7	74%	0.738	77%	0.765	S	S	*	*				93.7	162.6	105.5	-76.4	172.4	159.5	0	0	112.4
266	E	31	Very low	28.1	Very low	153 Å²	153	132.6 Å²	132.6	72%	0.715	76%	0.764	S	S	*	*			cis	-140.2	165.2	-1	-139.8	-178.1	146.7	0	0	107.4
267	E	28.4	Very low	27.4	Very low	175 Å²	175	134.8 Å²	134.8	82%	0.818	76%	0.762	S	S	*	*				177.2	158.4	78.1	-87.6	-163.5	164.6	0	0	106.5
268	A	27.2	Very low	27.3	Very low	64 Å²	64	134.9 Å²	134.9	53%	0.529	75%	0.753	S	S	.	*			cis	-162.5	145.4	5.6	0	0	0	0	0	112.1
269	L	30.9	Very low	27.2	Very low	145 Å²	145	137 Å²	137	76%	0.759	76%	0.755	S	S	*	*				60.4	139	126.4	-58.9	174.2	0	0	0	120.2
270	E	28	Very low	27.2	Very low	184 Å²	184	131.6 Å²	131.6	86%	0.86	75%	0.745	S	S	*	*			cis	-144.7	163.1	2	-55.9	-176	147	0	0	108.9
271	G	26.5	Very low	27.3	Very low	71 Å²	71	132.5 Å²	132.5	73%	0.732	75%	0.749	S	S	*	*			cis	172.4	152.5	-7.4	0	0	0	0	0	113.4
272	D	26	Very low	27.4	Very low	178 Å²	178	134.6 Å²	134.6	95%	0.952	74%	0.742	S	S	*	*			trans	62.4	142.1	150.2	-141.8	38.2	0	0	0	121.7
273	G	27.1	Very low	27.6	Very low	63 Å²	63	132.1 Å²	132.1	65%	0.649	73%	0.73	S	S	*	*			cis	-170.2	167.5	3.6	0	0	0	0	0	116.4
274	S	25.8	Very low	27.6	Very low	113 Å²	113	133.6 Å²	133.6	79%	0.79	73%	0.73	S	S	*	*			trans	-59.5	145.3	-179	178.6	0	0	0	0	114.5
275	L	29.7	Very low	27.8	Very low	154 Å²	154	136 Å²	136	81%	0.806	74%	0.74	S	S	*	*				86	132.4	50.8	-111.4	174.6	0	0	0	116.3
276	E	28.1	Very low	27.7	Very low	147 Å²	147	131.8 Å²	131.8	69%	0.687	74%	0.738	S	S	*	*			trans	75.5	128.8	167.8	-62.1	-143.1	171.1	0	0	124.7
277	K	26.6	Very low	27.8	Very low	156 Å²	156	132.2 Å²	132.2	68%	0.678	74%	0.741	S	S	*	*				100.9	115.1	130	-102	179.2	179.8	127.1	0	125.4
278	E	24.3	Very low	27.7	Very low	147 Å²	147	131.3 Å²	131.3	69%	0.687	73%	0.734	S	S	*	*			trans	64.2	118.1	134.9	-81.5	-179.8	111.5	0	0	124.3
279	L	24.5	Very low	27.8	Very low	155 Å²	155	134.2 Å²	134.2	81%	0.812	74%	0.739	S	S	*	*			trans	89.7	122.1	135.5	-68.1	168.3	0	0	0	122.7
280	A	24.9	Very low	27.6	Very low	78 Å²	78	135 Å²	135	65%	0.645	74%	0.739	S	S	*	*			trans	91.4	113.5	135.5	0	0	0	0	0	121.9
281	I	27.8	Very low	27.3	Very low	156 Å²	156	134.8 Å²	134.8	80%	0.8	74%	0.74	S	S	*	*			trans	71.9	127.6	132.1	-62.3	170.8	0	0	0	115.3
282	D	25.3	Very low	27.4	Very low	121 Å²	121	138.4 Å²	138.4	65%	0.647	74%	0.741	S	S	*	*			cis	-160.8	157.6	37.5	-144.9	1	0	0	0	114.6
283	N	28.7	Very low	27.4	Very low	119 Å²	119	133.9 Å²	133.9	64%	0.636	73%	0.729	S	S	*	*			trans	52.7	147	143	-76.4	-27.6	0	0	0	123.9
284	I	32.5	Very low	28.5	Very low	136 Å²	136	136.5 Å²	136.5	70%	0.697	73%	0.734	S	S	*	*			cis	-166.3	169.9	-15.9	-135.5	172.6	0	0	0	111.3
285	M	31	Very low	28.5	Very low	184 Å²	184	137 Å²	137	91%	0.906	73%	0.732	S	S	*	*			trans	70.5	129.5	170	-83.3	164.2	75.5	0	0	119.5
286	G	28.4	Very low	28.3	Very low	68 Å²	68	137 Å²	137	70%	0.701	73%	0.733	S	S	*	*			cis	172.9	146.9	-11	0	0	0	0	0	116.9
287	E	31.4	Very low	28.3	Very low	163 Å²	163	135 Å²	135	76%	0.762	74%	0.735	S	S	*	*			trans	57.3	149.1	157.4	-59.9	-162.7	100.1	0	0	120.1
288	K	27.4	Very low	28.7	Very low	156 Å²	156	133.6 Å²	133.6	68%	0.678	74%	0.742	S	S	*	*			cis	-148.4	123.2	5.2	-154.4	158.1	-179.3	150.5	0	108.2
289	I	29.2	Very low	28.9	Very low	124 Å²	124	131.3 Å²	131.3	64%	0.636	74%	0.742	S	S	*	*				58.1	127.8	83	-57.6	165.3	0	0	0	110.6
290	E	25.9	Very low	29.4	Very low	162 Å²	162	131 Å²	131	76%	0.757	74%	0.741	S	S	*	*				-155.6	145.1	51.1	-152	147	-102.1	0	0	115.8
291	M	22.6	Very low	29.6	Very low	179 Å²	179	133.2 Å²	133.2	88%	0.882	74%	0.742	S	S	*	*			trans	-155.7	140.2	155	-153.8	-146.9	-53.1	0	0	108.3
292	I	27.4	Very low	29.8	Very low	148 Å²	148	134.1 Å²	134.1	76%	0.759	74%	0.74	S	S	*	*			trans	-133.7	144.6	-179.4	-59.8	-179.9	0	0	0	109.6
293	A	25.8	Very low	30.1	Very low	83 Å²	83	133.9 Å²	133.9	69%	0.686	74%	0.739	S	S	*	*			trans	-124.3	-166.9	-170.8	0	0	0	0	0	111.8
294	P	51	Low	30.4	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	74%	0.74	S	S	*	*			trans	-90.4	-178.4	-139.9	41.3	-41.9	0	0	0	114.6
295	V	25.2	Very low	30.5	Very low	122 Å²	122	134 Å²	134	74%	0.739	74%	0.741	S	S	*	*			trans	-178	150.7	135.3	138	0	0	0	0	113.9
296	N	25.6	Very low	30.8	Very low	156 Å²	156	132.8 Å²	132.8	83%	0.834	73%	0.733	S	S	*	*			trans	74.5	147.1	161.2	-78.1	-8	0	0	0	123.6
297	S	28.8	Very low	31.1	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	74%	0.741	S	S	*	*			trans	-115.5	171.6	174.1	53.7	0	0	0	0	111.4
298	P	34.1	Very low	31.3	Very low	127 Å²	127	137.3 Å²	137.3	83%	0.825	74%	0.744	S	S	*	*			trans	-105.8	159.5	158.9	37	-29.4	0	0	0	112.7
299	S	28.8	Very low	32.4	Very low	100 Å²	100	134.9 Å²	134.9	70%	0.699	75%	0.745	S	S	*	*			trans	-149.5	174	172.8	57	0	0	0	0	110
300	L	35.2	Very low	32.7	Very low	149 Å²	149	135.6 Å²	135.6	78%	0.78	76%	0.755	S	S	*	*			trans	75.2	142.3	-178.6	-48.1	172.1	0	0	0	114.2
301	D	29.6	Very low	33	Very low	124 Å²	124	134.6 Å²	134.6	66%	0.663	75%	0.75	S	S	*	*			cis	-158.5	-176.3	-11.6	-123.4	6.3	0	0	0	112.9
302	F	31.1	Very low	33.7	Very low	174 Å²	174	133 Å²	133	76%	0.763	74%	0.744	S	S	*	*			trans	-47.8	169.2	175	-54.5	-88.9	0	0	0	116.3
303	N	33.3	Very low	34.1	Very low	116 Å²	116	131.8 Å²	131.8	62%	0.62	75%	0.749	S	S	*	*			cis	-161.1	170.3	19.2	-147.7	27.3	0	0	0	113.5
304	D	34.1	Very low	34.3	Very low	124 Å²	124	135.6 Å²	135.6	66%	0.663	76%	0.758	S	S	*	*			trans	61.9	159.5	149.8	-71	-23.6	0	0	0	121.1
305	N	35.4	Very low	33.8	Very low	133 Å²	133	134.9 Å²	134.9	71%	0.711	76%	0.756	S	S	*	*			cis	179.2	155.1	-38.6	-122.1	9.8	0	0	0	107.3
306	E	35.8	Very low	34.8	Very low	160 Å²	160	133.4 Å²	133.4	75%	0.748	75%	0.751	S	S	*	*			cis	-135.2	163.1	-7.7	-68.8	-178.1	82.8	0	0	107.9
307	D	35.5	Very low	35.2	Very low	161 Å²	161	134.2 Å²	134.2	86%	0.861	76%	0.755	S	S	*	*			trans	176.9	121.3	133.9	-97.7	-18.6	0	0	0	114
308	I	36.5	Very low	36	Very low	164 Å²	164	134.8 Å²	134.8	84%	0.841	76%	0.755	S	S	*	*			trans	-158.9	163.3	167.9	16.4	170.5	0	0	0	107.3
309	P	49	Very low	36.3	Very low	105 Å²	105	136 Å²	136	68%	0.682	75%	0.749	S	S	*	*			cis	-131.6	174.7	-4.6	40.1	-24.9	0	0	0	114.4
310	T	36.2	Very low	37	Very low	139 Å²	139	138.5 Å²	138.5	85%	0.853	75%	0.754	S	S	*	*			trans	-140.9	98.6	148	-57.6	0	0	0	0	111.1
311	E	32.4	Very low	37.9	Very low	142 Å²	142	137.5 Å²	137.5	66%	0.664	75%	0.746	S	S	*	*			trans	42.7	106.6	136.1	-60.7	-71.4	93.6	0	0	120.6
312	L	37.4	Very low	39.2	Very low	144 Å²	144	134 Å²	134	75%	0.754	74%	0.739	S	S	*	*				39.2	95.6	118.3	-60.9	172.8	0	0	0	118.7
313	S	35.9	Very low	41.2	Very low	123 Å²	123	128.6 Å²	128.6	86%	0.86	72%	0.716	S	S	*	*				178.8	127.6	112.8	-76.2	0	0	0	0	111.5
314	D	28.6	Very low	43.2	Very low	164 Å²	164	124.6 Å²	124.6	88%	0.877	70%	0.696	S	S	*	*				-146.1	159.6	119.5	-145.4	-15.9	0	0	0	110.7
315	S	41.4	Very low	44.9	Very low	103 Å²	103	125.2 Å²	125.2	72%	0.72	70%	0.695	S	S	*	*			trans	-138.6	136.1	-177.7	-176.4	0	0	0	0	108.9
316	S	45.3	Very low	46.5	Very low	90 Å²	90	119.3 Å²	119.3	63%	0.629	67%	0.665	S	S	*	*			trans	74.1	78.1	177.9	-175	0	0	0	0	116.2	T318	S316-T318 WeakPolarHBondContact OG-CG2 3.43Å
317	D	35.2	Very low	48.1	Very low	173 Å²	173	118 Å²	118	93%	0.925	66%	0.656	S	S	*	*			trans	-85.8	95.5	140.1	-109	-37.6	0	0	0	108.6	H319	D317-H319 VanDerWaalsContact C-N 3.29Å; D317-H319 PolarHBondContact O-N 3.48Å
318	T	46.1	Very low	49.9	Very low	116 Å²	116	114 Å²	114	71%	0.712	63%	0.63	S	S	*	*			trans	-75.8	81.9	168.6	42.8	0	0	0	0	109.4	S316 D320	S316-T318 WeakPolarHBondContact OG-CG2 3.43Å; T318-D320 VanDerWaalsContact C-N 3.29Å; T318-D320 PolarHBondContact O-N 3.36Å
319	H	40.1	Very low	51.8	Low	152 Å²	152	114.4 Å²	114.4	70%	0.704	63%	0.628	S	S	*	*			trans	-73.5	93.1	160.3	-143	-69.2	0	0	0	107.9	D317 E321	D317-H319 VanDerWaalsContact C-N 3.29Å; D317-H319 PolarHBondContact O-N 3.48Å; H319-E321 IonicContact CE1-OE1 2.83Å; H319-E321 PolarHBondContact CE1-OE1 3.2Å; H319-E321 IonicContact ND1-OE1 3.23Å; H319-E321 PolarHBondContact ND1-OE1 2.9Å; H319-E321 PolarHBondContact O-N 3.06Å
320	D	43.8	Very low	53.4	Low	152 Å²	152	111.7 Å²	111.7	81%	0.813	61%	0.608	S	S	*	*			trans	-73.9	62.3	176.2	-162.8	27.3	0	0	0	109.8	T318 G322	T318-D320 VanDerWaalsContact C-N 3.29Å; T318-D320 PolarHBondContact O-N 3.36Å; D320-G322 PolarHBondContact O-N 3.21Å
321	E	53.7	Low	55.7	Low	128 Å²	128	106.1 Å²	106.1	60%	0.598	57%	0.573	S	S	*	*			trans	-63.5	87.7	160.1	-69.8	-63.3	146.8	0	0	107.2	H319	H319-E321 IonicContact CE1-OE1 2.83Å; H319-E321 PolarHBondContact CE1-OE1 3.2Å; H319-E321 IonicContact ND1-OE1 3.23Å; H319-E321 PolarHBondContact ND1-OE1 2.9Å; H319-E321 PolarHBondContact O-N 3.06Å
322	G	56.3	Low	58.1	Low	50 Å²	50	104.5 Å²	104.5	52%	0.515	58%	0.577	S	S	.	*			trans	-52.7	145.7	178	0	0	0	0	0	111.5	D320 V324	D320-G322 PolarHBondContact O-N 3.21Å; G322-V324 PolarHBondContact O-N 2.77Å
323	E	72.8	Confident	60.3	Low	61 Å²	61	99.4 Å²	99.4	29%	0.285	56%	0.56	S	S	.	*			trans	-46.3	127.9	-177.1	179.3	176.3	137.6	0	0	111.5	Q325 V449 R455 R457	E323-Q325 PolarHBondContact O-N 3.21Å; E323-V449 HydrophobicContact CG-CG2 4.09Å; E323-R455 VanDerWaalsContact OE1-CD 3.32Å; E323-R455 WeakPolarHBondContact OE1-CD 3.36Å; E323-R455 IonicContact OE1-CZ 4Å; E323-R455 IonicContact OE1-NE 3.45Å; E323-R455 PolarHBondContact OE1-NE 3.48Å; E323-R455 IonicContact OE1-NH2 2.68Å; E323-R455 IonicContact OE2-CZ 3.86Å; E323-R455 VanDerWaalsContact OE2-CZ 3.28Å; E323-R455 IonicContact OE2-NE 2.66Å; E323-R455 PolarHBondContact OE2-NE 3.43Å; E323-R455 IonicContact OE2-NH2 2.67Å; E323-R455 PolarHBondContact OE2-NH2 3.39Å; E323-R457 IonicContact OE1-NH1 3.52Å
324	V	76.5	Confident	63	Low	33 Å²	33	98.6 Å²	98.6	20%	0.2	54%	0.538	C	S	.	.			trans	-64	100.2	-175.9	177	0	0	0	0	109.3	G322 A326 E419 C420 T447 R448	G322-V324 PolarHBondContact O-N 2.77Å; V324-A326 PolarHBondContact O-N 3.44Å; V324-A326 VanDerWaalsContact O-N 3.17Å; V324-E419 HydrophobicContact CG1-CB 4.45Å; V324-C420 HydrophobicContact CG1-CB 4.25Å; V324-T447 WeakPolarHBondContact O-CB 3.42Å; V324-T447 WeakPolarHBondContact O-CG2 3.44Å; V324-R448 HydrophobicContact CB-CB 4.48Å; V324-R448 HydrophobicContact CG2-CB 3.92Å; V324-R448 PolarHBondContact N-O 3.33Å; V324-R448 VanDerWaalsContact N-O 3.12Å
325	Q	70.2	Confident	66.1	Low	137 Å²	137	95.3 Å²	95.3	64%	0.64	52%	0.517	S	S	*	.			trans	-64	117.1	-176.7	-173.9	65.5	23	0	0	110.1	E323 F327	E323-Q325 PolarHBondContact O-N 3.21Å; Q325-F327 PolarHBondContact O-N 2.94Å
326	A	67.8	Low	68.5	Low	9 Å²	9	91.9 Å²	91.9	7%	0.074	49%	0.489	C	S	.	.			trans	-59.4	132.7	179.3	0	0	0	0	0	111.9	V324 Y328 T445 T447	V324-A326 PolarHBondContact O-N 3.44Å; V324-A326 VanDerWaalsContact O-N 3.17Å; A326-Y328 PolarHBondContact O-N 3.22Å; A326-Y328 VanDerWaalsContact O-N 3.11Å; A326-T445 HydrophobicContact CB-CG2 3.39Å; A326-T447 HydrophobicContact CB-CG2 3.98Å
327	F	70.4	Confident	70.9	Confident	131 Å²	131	87.9 Å²	87.9	58%	0.575	46%	0.46	S	S	*	.	S	Bend	trans	-69	-4.9	-178.4	-59.2	-76.4	0	0	0	115.1	Q325 A414	Q325-F327 PolarHBondContact O-N 2.94Å; F327-A414 HydrophobicContact CD2-CB 4.43Å
328	Y	72.1	Confident	73.8	Confident	78 Å²	78	82.4 Å²	82.4	31%	0.306	43%	0.431	S	S	.	.	S	Bend	trans	-125.2	136.4	176.8	-69.4	-78.3	0	0	0	109.8	A326 Y412 A414 V422	A326-Y328 PolarHBondContact O-N 3.22Å; A326-Y328 VanDerWaalsContact O-N 3.11Å; Y328-Y412 HydrophobicContact CD2-CD2 4.46Å; Y328-Y412 HydrophobicContact CD2-CG 4.43Å; Y328-Y412 HydrophobicContact CE2-CD1 4.15Å; Y328-Y412 HydrophobicContact CE2-CD2 4.26Å; Y328-Y412 AromaticContact CE2-CG 3.8Å; Y328-Y412 HydrophobicContact CE2-CG 3.8Å; Y328-Y412 AromaticContact CZ-CD1 3.94Å; Y328-A414 HydrophobicContact CE2-CB 4.19Å; Y328-V422 HydrophobicContact CD2-CB 4.34Å; Y328-V422 HydrophobicContact CD2-CG1 4.15Å; Y328-V422 HydrophobicContact CD2-CG2 4.34Å
329	E	76.6	Confident	76.1	Confident	172 Å²	172	81.5 Å²	81.5	80%	0.804	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-64.3	149.8	169.7	-63.5	179.5	162	0	0	110.5	R443	E329-R443 PolarHBondContact O-NH1 2.95Å
330	D	82.1	Confident	78.8	Confident	49 Å²	49	76.6 Å²	76.6	26%	0.262	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-68.8	157	174	-69.3	-67.2	0	0	0	110.9	T445 R457	D330-T445 PolarHBondContact OD1-OG1 2.96Å; D330-R457 IonicContact OD1-NE 2.68Å; D330-R457 IonicContact OD2-CZ 3.77Å; D330-R457 VanDerWaalsContact OD2-CZ 3.26Å; D330-R457 IonicContact OD2-NE 3.74Å; D330-R457 PolarHBondContact OD2-NE 2.85Å; D330-R457 IonicContact OD2-NH2 3.26Å; D330-R457 PolarHBondContact OD2-NH2 2.97Å
331	L	85.4	Confident	81.3	Confident	22 Å²	22	69.8 Å²	69.8	12%	0.115	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-67.1	146.3	-174.7	-63.8	176.1	0	0	0	111.8	G333 I441 R443 S459 E461	L331-G333 PolarHBondContact O-N 2.87Å; L331-I441 HydrophobicContact CD1-CB 4.16Å; L331-I441 HydrophobicContact CD1-CG2 3.81Å; L331-I441 WeakPolarHBondContact CD1-O 3.44Å; L331-R443 HydrophobicContact CD1-CB 3.66Å; L331-R443 HydrophobicContact CD2-CB 4.47Å; L331-R443 HydrophobicContact CG-CB 3.68Å; L331-S459 PolarHBondContact N-OG 3.4Å; L331-E461 HydrophobicContact CB-CB 4.26Å; L331-E461 HydrophobicContact CD1-CB 4.1Å
332	S	81.7	Confident	83.3	Confident	108 Å²	108	66.1 Å²	66.1	76%	0.755	35%	0.347	S	S	*	.	S	Bend	trans	-66.8	10.2	179.9	55.3	0	0	0	0	115.7
333	G	84.6	Confident	85.1	Confident	37 Å²	37	63.8 Å²	63.8	38%	0.381	32%	0.323	S	S	.	.	S	Bend	trans	-94.9	-136.2	176.6	0	0	0	0	0	112.8	L331 T460	L331-G333 PolarHBondContact O-N 2.87Å; G333-T460 WeakPolarHBondContact CA-O 3.46Å
334	R	91.8	Very high	86.1	Confident	105 Å²	105	62.2 Å²	62.2	40%	0.396	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.7	179.8	-179.8	-178.7	-103.1	-161.7	-10.6	110.5	Y336 T460 W481 E485	R334-Y336 HydrophobicContact CB-CE2 4.23Å; R334-Y336 VanDerWaalsContact CD-CZ 3.41Å; R334-Y336 HydrophobicContact CG-CD2 4.34Å; R334-Y336 HydrophobicContact CG-CE1 4.48Å; R334-Y336 HydrophobicContact CG-CE2 4.11Å; R334-T460 PolarHBondContact N-O 2.74Å; R334-T460 PolarHBondContact O-N 3.39Å; R334-W481 HydrophobicContact CB-CE3 4.2Å; R334-W481 HydrophobicContact CB-CH2 4.22Å; R334-W481 HydrophobicContact CB-CZ3 3.71Å; R334-E485 IonicContact CZ-OE2 2.67Å; R334-E485 IonicContact NH1-OE2 3.92Å; R334-E485 PolarHBondContact NH1-OE2 2.67Å
335	Q	93.7	Very high	87.1	Confident	95 Å²	95	60.8 Å²	60.8	44%	0.444	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	134.1	164.9	-172	179.8	-98.1	0	0	109.7	V458	Q335-V458 WeakPolarHBondContact CA-O 3.4Å
336	Y	93.3	Very high	88.3	Confident	32 Å²	32	56 Å²	56	13%	0.125	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	-27.1	-176.5	-87.3	-68.2	0	0	0	114.2	R334 V458 W481 L484 E485 F488	R334-Y336 HydrophobicContact CB-CE2 4.23Å; R334-Y336 VanDerWaalsContact CD-CZ 3.41Å; R334-Y336 HydrophobicContact CG-CD2 4.34Å; R334-Y336 HydrophobicContact CG-CE1 4.48Å; R334-Y336 HydrophobicContact CG-CE2 4.11Å; Y336-V458 PolarHBondContact N-O 3.3Å; Y336-W481 HydrophobicContact CE2-CE3 4.17Å; Y336-W481 HydrophobicContact CE2-CZ3 4.3Å; Y336-W481 PolarHBondContact OH-O 3.45Å; Y336-L484 HydrophobicContact CE2-CB 3.83Å; Y336-L484 HydrophobicContact CE2-CD1 4.44Å; Y336-E485 VanDerWaalsContact CE1-CA 3.43Å; Y336-E485 HydrophobicContact CE1-CB 3.68Å; Y336-E485 HydrophobicContact CE1-CG 4.08Å; Y336-F488 HydrophobicContact CD1-CB 4.34Å; Y336-F488 HydrophobicContact CD1-CD2 4.04Å; Y336-F488 AromaticContact CD2-CD2 3.57Å; Y336-F488 HydrophobicContact CD2-CD2 3.57Å; Y336-F488 AromaticContact CD2-CE2 3.83Å; Y336-F488 HydrophobicContact CD2-CE2 3.83Å; Y336-F488 HydrophobicContact CE2-CD2 4.23Å; Y336-F488 HydrophobicContact CE2-CE2 4.41Å; Y336-F488 HydrophobicContact CG-CB 4.22Å; Y336-F488 AromaticContact CG-CD2 3.44Å; Y336-F488 HydrophobicContact CG-CD2 3.44Å; Y336-F488 VanDerWaalsContact CG-CD2 3.44Å; Y336-F488 HydrophobicContact CG-CE2 4.16Å; Y336-F488 HydrophobicContact CG-CG 4.12Å
337	V	95.2	Very high	89.6	Confident	6 Å²	6	59.2 Å²	59.2	4%	0.036	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	143.2	176	-172.1	0	0	0	0	108.5	E339 L456 R457 V458 F488	V337-E339 HydrophobicContact CG1-CB 4.37Å; V337-L456 HydrophobicContact CG1-CB 4.47Å; V337-L456 HydrophobicContact CG1-CD2 4.21Å; V337-L456 HydrophobicContact CG1-CG 4.19Å; V337-R457 CarbonylContact O-C 3.36Å; V337-R457 VanDerWaalsContact O-CA 3.32Å; V337-R457 WeakPolarHBondContact O-CA 3.32Å; V337-V458 HydrophobicContact CB-CB 4.13Å; V337-V458 HydrophobicContact CB-CG2 4.04Å; V337-V458 HydrophobicContact CG2-CB 4.27Å; V337-V458 HydrophobicContact CG2-CG2 4.2Å; V337-V458 PolarHBondContact N-O 2.7Å; V337-V458 PolarHBondContact O-N 3.3Å; V337-F488 HydrophobicContact CG2-CB 4.12Å
338	N	95.3	Very high	90.8	Very high	57 Å²	57	53 Å²	53	31%	0.305	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	37.3	174.8	-174.6	22.7	0	0	0	112	R455 L456 R457	N338-R455 PolarHBondContact O-NH1 3.34Å; N338-R455 WeakPolarHBondContact OD1-CD 3.34Å; N338-R455 PolarHBondContact OD1-NH1 3.43Å; N338-L456 CarbonylContact C-O 3.43Å; N338-L456 VanDerWaalsContact CA-O 3.29Å; N338-L456 WeakPolarHBondContact CA-O 3.32Å; N338-L456 PolarHBondContact N-O 3.26Å; N338-R457 WeakPolarHBondContact OD1-CD 3.38Å; N338-R457 VanDerWaalsContact OD1-CG 3.32Å; N338-R457 WeakPolarHBondContact OD1-CG 3.22Å
339	E	95.9	Very high	91.9	Very high	97 Å²	97	50.7 Å²	50.7	45%	0.453	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	153.4	-166.5	-68.8	-51.6	132.6	0	0	113.8	V337 F341 R455 L456	V337-E339 HydrophobicContact CG1-CB 4.37Å; E339-F341 HydrophobicContact CB-CE2 3.93Å; E339-F341 HydrophobicContact CB-CZ 4.05Å; E339-R455 CarbonylContact O-C 3.55Å; E339-R455 WeakPolarHBondContact O-CA 3.5Å; E339-L456 PolarHBondContact N-O 3.1Å; E339-L456 VanDerWaalsContact N-O 3.11Å; E339-L456 PolarHBondContact O-N 3.39Å
340	V	96.2	Very high	92.8	Very high	50 Å²	50	45.9 Å²	45.9	30%	0.303	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	105.5	-179.2	-177.2	0	0	0	0	110	V449 K453 S454 R455	V340-V449 HydrophobicContact CG1-CB 4.31Å; V340-V449 HydrophobicContact CG1-CG1 4.29Å; V340-V449 HydrophobicContact CG1-CG2 4.12Å; V340-V449 HydrophobicContact CG2-CG2 4.44Å; V340-K453 HydrophobicContact CG1-CB 4.36Å; V340-S454 WeakPolarHBondContact CA-O 3.38Å; V340-R455 HydrophobicContact CG2-CB 4.07Å; V340-R455 HydrophobicContact CG2-CG 4.17Å
341	F	95.9	Very high	93.5	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.035	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	147.7	178.8	-60.8	-82.9	0	0	0	111.2	E339 F343 K453 S454 L456 L495 A496	E339-F341 HydrophobicContact CB-CE2 3.93Å; E339-F341 HydrophobicContact CB-CZ 4.05Å; F341-F343 HydrophobicContact CB-CD2 3.58Å; F341-F343 HydrophobicContact CB-CE2 4.01Å; F341-F343 HydrophobicContact CB-CG 4.44Å; F341-F343 HydrophobicContact CD1-CE2 4.48Å; F341-F343 HydrophobicContact CG-CD2 4.32Å; F341-F343 HydrophobicContact CG-CE2 4.38Å; F341-F343 PolarHBondContact O-N 2.86Å; F341-K453 WeakPolarHBondContact O-CA 3.42Å; F341-S454 PolarHBondContact N-O 2.89Å; F341-S454 PolarHBondContact O-N 3.23Å; F341-L456 HydrophobicContact CD2-CB 4.17Å; F341-L456 HydrophobicContact CE2-CB 3.98Å; F341-L456 HydrophobicContact CE2-CD2 4.18Å; F341-L495 HydrophobicContact CD1-CB 4.27Å; F341-L495 HydrophobicContact CE1-CB 3.68Å; F341-L495 HydrophobicContact CE2-CD1 4.09Å; F341-L495 HydrophobicContact CZ-CB 3.82Å; F341-L495 HydrophobicContact CZ-CD1 4.03Å; F341-A496 HydrophobicContact CE1-CB 4.49Å
342	N	95.3	Very high	94	Very high	51 Å²	51	43.3 Å²	43.3	27%	0.273	23%	0.231	S	C	.	.	S	Bend	trans	-78.4	47.9	174.9	-65.2	-88.2	0	0	0	112.3	N452 K453 E499 Y502 L503	N342-N452 CarbonylContact C-O 3.59Å; N342-N452 VanDerWaalsContact CA-O 3.29Å; N342-N452 WeakPolarHBondContact CA-O 3.44Å; N342-K453 WeakPolarHBondContact OD1-CE 3.43Å; N342-E499 HydrophobicContact CB-CG 4.25Å; N342-E499 WeakPolarHBondContact CB-OE1 3.35Å; N342-E499 PolarHBondContact N-OE1 3.38Å; N342-E499 PolarHBondContact ND2-OE1 3.45Å; N342-Y502 WeakPolarHBondContact O-CE1 3.31Å; N342-L503 HydrophobicContact CB-CD1 4.17Å; N342-L503 HydrophobicContact CB-CD2 4.01Å; N342-L503 HydrophobicContact CB-CG 4.39Å
343	F	94.3	Very high	94.7	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	20%	0.195	C	C	.	.	S	Bend	trans	-114.3	150.1	168.3	-56.9	-56.4	0	0	0	109.8	F341 K347 L348 L351 N452 K453 S454 L495 T498 E499 Y502	F341-F343 HydrophobicContact CB-CD2 3.58Å; F341-F343 HydrophobicContact CB-CE2 4.01Å; F341-F343 HydrophobicContact CB-CG 4.44Å; F341-F343 HydrophobicContact CD1-CE2 4.48Å; F341-F343 HydrophobicContact CG-CD2 4.32Å; F341-F343 HydrophobicContact CG-CE2 4.38Å; F341-F343 PolarHBondContact O-N 2.86Å; F343-K347 HydrophobicContact CB-CB 4.32Å; F343-K347 HydrophobicContact CB-CG 4.41Å; F343-K347 HydrophobicContact CD1-CG 4.24Å; F343-L348 HydrophobicContact CB-CB 4.35Å; F343-L348 HydrophobicContact CD2-CD1 4.26Å; F343-L351 HydrophobicContact CD1-CD1 4.4Å; F343-L351 HydrophobicContact CD2-CD1 4.18Å; F343-L351 HydrophobicContact CE1-CD1 4.11Å; F343-L351 HydrophobicContact CE2-CD1 3.88Å; F343-L351 HydrophobicContact CG-CD1 4.43Å; F343-L351 HydrophobicContact CZ-CD1 3.83Å; F343-N452 CarbonylContact C-O 3.58Å; F343-N452 PolarHBondContact N-O 3.11Å; F343-N452 CarbonylContact O-C 3.55Å; F343-K453 CarbonylContact O-C 3.06Å; F343-K453 WeakPolarHBondContact O-CA 3.43Å; F343-K453 PolarHBondContact O-N 2.92Å; F343-S454 PolarHBondContact O-N 3.01Å; F343-S454 PolarHBondContact O-OG 3.28Å; F343-L495 HydrophobicContact CE2-CD2 4.43Å; F343-T498 HydrophobicContact CE1-CG2 4.48Å; F343-T498 HydrophobicContact CZ-CG2 4.01Å; F343-E499 HydrophobicContact CE1-CB 4.26Å; F343-E499 HydrophobicContact CE2-CB 4.13Å; F343-E499 VanDerWaalsContact CZ-CA 3.5Å; F343-E499 HydrophobicContact CZ-CB 3.71Å; F343-Y502 AromaticContact CD1-CD1 3.77Å; F343-Y502 HydrophobicContact CD1-CD1 3.77Å; F343-Y502 HydrophobicContact CD1-CE1 4.11Å; F343-Y502 HydrophobicContact CD1-CG 4.33Å; F343-Y502 AromaticContact CE1-CD1 3.88Å; F343-Y502 HydrophobicContact CE1-CD1 3.88Å; F343-Y502 HydrophobicContact CE1-CG 4.08Å
344	S	94.8	Very high	95	Very high	29 Å²	29	38.7 Å²	38.7	20%	0.203	19%	0.19	C	C	.	.			trans	-63.1	152.7	159.3	64.1	0	0	0	0	109.8	D346 K347 L348 R451	S344-D346 PolarHBondContact O-N 3.18Å; S344-K347 PolarHBondContact O-N 3Å; S344-K347 VanDerWaalsContact OG-CB 3.32Å; S344-K347 WeakPolarHBondContact OG-CB 3.42Å; S344-K347 PolarHBondContact OG-N 3.34Å; S344-L348 PolarHBondContact O-N 2.87Å; S344-R451 WeakPolarHBondContact CB-O 3.37Å
345	V	95.6	Very high	94.8	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-60.1	-34.2	-177.7	72.1	0	0	0	0	112.1	L348 Y349 S418 Y421 L446 R448	V345-L348 PolarHBondContact O-N 2.96Å; V345-Y349 PolarHBondContact O-N 3.23Å; V345-S418 WeakPolarHBondContact CG1-O 3.4Å; V345-Y421 HydrophobicContact CG2-CD2 4.22Å; V345-L446 HydrophobicContact CG2-CB 3.88Å; V345-R448 HydrophobicContact CG1-CB 4.44Å
346	D	95.6	Very high	94.8	Very high	37 Å²	37	34.6 Å²	34.6	20%	0.198	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-39.9	174.5	-47.5	-46.8	0	0	0	111.8	S344 L348 Y349 D350 S418 Y421	S344-D346 PolarHBondContact O-N 3.18Å; D346-L348 VanDerWaalsContact C-N 3.35Å; D346-Y349 PolarHBondContact O-N 3.5Å; D346-D350 WeakPolarHBondContact O-CB 3.27Å; D346-D350 PolarHBondContact O-N 3.38Å; D346-S418 WeakPolarHBondContact OD1-CA 3.49Å; D346-S418 PolarHBondContact OD1-N 3Å; D346-S418 VanDerWaalsContact OD2-CA 3.3Å; D346-S418 WeakPolarHBondContact OD2-CA 3.43Å; D346-S418 WeakPolarHBondContact OD2-CB 3.29Å; D346-S418 PolarHBondContact OD2-OG 3.37Å; D346-Y421 PolarHBondContact OD1-OH 3.25Å
347	K	94.9	Very high	94.9	Very high	77 Å²	77	37 Å²	37	34%	0.335	20%	0.2	S	C	.	.	H	α-helix	trans	-69.5	-35.2	178.2	-178.2	57.1	-179.3	173.2	0	111.7	F343 S344 L351	F343-K347 HydrophobicContact CB-CB 4.32Å; F343-K347 HydrophobicContact CB-CG 4.41Å; F343-K347 HydrophobicContact CD1-CG 4.24Å; S344-K347 PolarHBondContact O-N 3Å; S344-K347 VanDerWaalsContact OG-CB 3.32Å; S344-K347 WeakPolarHBondContact OG-CB 3.42Å; S344-K347 PolarHBondContact OG-N 3.34Å; K347-L351 VanDerWaalsContact O-CG 3.25Å; K347-L351 WeakPolarHBondContact O-CG 3.41Å; K347-L351 PolarHBondContact O-N 3.29Å; K347-L351 VanDerWaalsContact O-N 3.08Å
348	L	96.1	Very high	94.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-40.6	172.5	179.9	63	0	0	0	111.5	F343 S344 V345 D346 L351 L352 L446 L456 L495	F343-L348 HydrophobicContact CB-CB 4.35Å; F343-L348 HydrophobicContact CD2-CD1 4.26Å; S344-L348 PolarHBondContact O-N 2.87Å; V345-L348 PolarHBondContact O-N 2.96Å; D346-L348 VanDerWaalsContact C-N 3.35Å; L348-L351 PolarHBondContact O-N 3.22Å; L348-L352 HydrophobicContact CD1-CD1 3.94Å; L348-L352 HydrophobicContact CD1-CG 4.47Å; L348-L352 HydrophobicContact CG-CD1 4.31Å; L348-L352 PolarHBondContact O-N 2.96Å; L348-L446 HydrophobicContact CB-CD2 4.26Å; L348-L446 HydrophobicContact CD2-CB 4.45Å; L348-L446 HydrophobicContact CD2-CD2 4.07Å; L348-L446 HydrophobicContact CD2-CG 3.83Å; L348-L446 HydrophobicContact CG-CD2 3.79Å; L348-L446 HydrophobicContact CG-CG 4.09Å; L348-L456 HydrophobicContact CD2-CB 4.05Å; L348-L495 HydrophobicContact CD1-CD2 4.26Å
349	Y	96.2	Very high	94.7	Very high	29 Å²	29	35.5 Å²	35.5	11%	0.114	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-47.5	171.6	167.9	-97.1	0	0	0	111.6	V345 D346 L351 L352 F353 T354 W376 M411 Y421 I423	V345-Y349 PolarHBondContact O-N 3.23Å; D346-Y349 PolarHBondContact O-N 3.5Å; Y349-L351 VanDerWaalsContact C-N 3.33Å; Y349-L351 PolarHBondContact O-N 3.35Å; Y349-L352 PolarHBondContact O-N 3.39Å; Y349-F353 HydrophobicContact CD2-CB 3.69Å; Y349-F353 AromaticContact CD2-CD2 3.75Å; Y349-F353 HydrophobicContact CD2-CD2 3.75Å; Y349-F353 HydrophobicContact CD2-CG 4.01Å; Y349-F353 HydrophobicContact CE2-CB 3.37Å; Y349-F353 HydrophobicContact CE2-CD2 4.21Å; Y349-F353 AromaticContact CE2-CG 3.98Å; Y349-F353 HydrophobicContact CE2-CG 3.98Å; Y349-F353 HydrophobicContact CG-CB 4.5Å; Y349-F353 WeakPolarHBondContact O-CA 3.35Å; Y349-F353 WeakPolarHBondContact O-CB 3.31Å; Y349-F353 PolarHBondContact O-N 3.19Å; Y349-T354 HydrophobicContact CE1-CG2 4.44Å; Y349-W376 PolarHBondContact OH-NE1 3.35Å; Y349-M411 HydrophobicContact CD2-CE 4.38Å; Y349-M411 HydrophobicContact CE2-CE 3.4Å; Y349-M411 VanDerWaalsContact CE2-CE 3.4Å; Y349-M411 WeakPolarHBondContact OH-CE 3.45Å; Y349-Y421 HydrophobicContact CD1-CE1 4.4Å; Y349-Y421 AromaticContact CD2-CD1 3.95Å; Y349-Y421 HydrophobicContact CD2-CD1 3.95Å; Y349-Y421 HydrophobicContact CD2-CD2 4.31Å; Y349-Y421 HydrophobicContact CD2-CE1 4.23Å; Y349-Y421 AromaticContact CD2-CG 3.99Å; Y349-Y421 HydrophobicContact CD2-CG 3.99Å; Y349-Y421 HydrophobicContact CE2-CD1 4.33Å; Y349-Y421 HydrophobicContact CG-CD1 4.28Å; Y349-Y421 HydrophobicContact CG-CD2 4.11Å; Y349-Y421 HydrophobicContact CG-CE1 4.18Å; Y349-Y421 HydrophobicContact CG-CE2 4.01Å; Y349-Y421 HydrophobicContact CG-CG 4.24Å; Y349-I423 HydrophobicContact CD2-CD1 4Å; Y349-I423 HydrophobicContact CE2-CD1 3.84Å
350	D	95.6	Very high	94.6	Very high	72 Å²	72	36.9 Å²	36.9	39%	0.385	19%	0.191	S	C	.	.	H	α-helix	trans	-55.4	-46.5	176.8	-88	-14.7	0	0	0	112	D346 T354 S356	D346-D350 WeakPolarHBondContact O-CB 3.27Å; D346-D350 PolarHBondContact O-N 3.38Å; D350-T354 WeakPolarHBondContact O-CB 3.36Å; D350-T354 PolarHBondContact O-N 3.26Å; D350-T354 PolarHBondContact O-OG1 3.4Å; D350-S356 WeakPolarHBondContact O-CB 3.44Å
351	L	96.2	Very high	94.5	Very high	11 Å²	11	38 Å²	38	6%	0.058	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-48	-179.1	-75.2	166.7	0	0	0	111.7	F343 K347 L348 Y349 S356 F358 T498	F343-L351 HydrophobicContact CD1-CD1 4.4Å; F343-L351 HydrophobicContact CD2-CD1 4.18Å; F343-L351 HydrophobicContact CE1-CD1 4.11Å; F343-L351 HydrophobicContact CE2-CD1 3.88Å; F343-L351 HydrophobicContact CG-CD1 4.43Å; F343-L351 HydrophobicContact CZ-CD1 3.83Å; K347-L351 VanDerWaalsContact O-CG 3.25Å; K347-L351 WeakPolarHBondContact O-CG 3.41Å; K347-L351 PolarHBondContact O-N 3.29Å; K347-L351 VanDerWaalsContact O-N 3.08Å; L348-L351 PolarHBondContact O-N 3.22Å; Y349-L351 VanDerWaalsContact C-N 3.33Å; Y349-L351 PolarHBondContact O-N 3.35Å; L351-S356 PolarHBondContact O-OG 3.02Å; L351-F358 HydrophobicContact CB-CD1 4.28Å; L351-F358 HydrophobicContact CB-CG 4.49Å; L351-F358 HydrophobicContact CD2-CB 3.57Å; L351-F358 HydrophobicContact CD2-CG 4Å; L351-T498 HydrophobicContact CD1-CG2 4.36Å; L351-T498 HydrophobicContact CD2-CG2 4.2Å
352	L	95.9	Very high	94.4	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-88.8	-32.6	-171.5	-64.2	174.7	0	0	0	114.4	L348 Y349 F358 L456 L491 L495	L348-L352 HydrophobicContact CD1-CD1 3.94Å; L348-L352 HydrophobicContact CD1-CG 4.47Å; L348-L352 HydrophobicContact CG-CD1 4.31Å; L348-L352 PolarHBondContact O-N 2.96Å; Y349-L352 PolarHBondContact O-N 3.39Å; L352-F358 HydrophobicContact CD2-CE1 3.94Å; L352-L456 HydrophobicContact CD1-CD1 4.09Å; L352-L456 HydrophobicContact CD1-CD2 4.07Å; L352-L491 HydrophobicContact CD2-CD1 3.84Å; L352-L491 HydrophobicContact CD2-CD2 4.37Å; L352-L491 HydrophobicContact CD2-CG 4.45Å; L352-L495 HydrophobicContact CD2-CD1 4.45Å; L352-L495 HydrophobicContact CD2-CD2 4.3Å
353	F	95.3	Very high	94.3	Very high	3 Å²	3	35.3 Å²	35.3	1%	0.013	18%	0.181	C	C	.	.	H	α-helix	trans	-118.6	4.9	-166.3	-61.7	-76.7	0	0	0	114.8	Y349 W376 R386 I423 Y444 L446	Y349-F353 HydrophobicContact CD2-CB 3.69Å; Y349-F353 AromaticContact CD2-CD2 3.75Å; Y349-F353 HydrophobicContact CD2-CD2 3.75Å; Y349-F353 HydrophobicContact CD2-CG 4.01Å; Y349-F353 HydrophobicContact CE2-CB 3.37Å; Y349-F353 HydrophobicContact CE2-CD2 4.21Å; Y349-F353 AromaticContact CE2-CG 3.98Å; Y349-F353 HydrophobicContact CE2-CG 3.98Å; Y349-F353 HydrophobicContact CG-CB 4.5Å; Y349-F353 WeakPolarHBondContact O-CA 3.35Å; Y349-F353 WeakPolarHBondContact O-CB 3.31Å; Y349-F353 PolarHBondContact O-N 3.19Å; F353-W376 HydrophobicContact CB-CZ2 4.47Å; F353-R386 PolarHBondContact O-NH1 3.39Å; F353-R386 PolarHBondContact O-NH2 2.81Å; F353-I423 HydrophobicContact CB-CD1 4.35Å; F353-I423 HydrophobicContact CD1-CD1 3.61Å; F353-I423 HydrophobicContact CD1-CG2 4.24Å; F353-I423 HydrophobicContact CD2-CD1 3.7Å; F353-I423 HydrophobicContact CE1-CB 4.16Å; F353-I423 HydrophobicContact CE1-CD1 3.79Å; F353-I423 HydrophobicContact CE1-CG2 3.83Å; F353-I423 HydrophobicContact CE2-CD1 3.86Å; F353-I423 HydrophobicContact CG-CD1 3.58Å; F353-I423 HydrophobicContact CZ-CB 4.31Å; F353-I423 HydrophobicContact CZ-CD1 3.92Å; F353-I423 HydrophobicContact CZ-CG2 4.46Å; F353-Y444 HydrophobicContact CE1-CD2 4.26Å; F353-Y444 HydrophobicContact CE1-CG 4.42Å; F353-Y444 HydrophobicContact CZ-CD1 4.02Å; F353-Y444 AromaticContact CZ-CD2 3.93Å; F353-Y444 HydrophobicContact CZ-CD2 3.93Å; F353-Y444 AromaticContact CZ-CG 3.64Å; F353-Y444 HydrophobicContact CZ-CG 3.64Å; F353-L446 HydrophobicContact CD2-CD2 4.49Å; F353-L446 HydrophobicContact CE2-CD1 4Å; F353-L446 HydrophobicContact CE2-CD2 4.23Å
354	T	92	Very high	94.2	Very high	45 Å²	45	42.1 Å²	42.1	28%	0.276	21%	0.213	S	C	.	.	S	Bend	trans	-109.4	175.9	165.4	76	0	0	0	0	111.2	Y349 D350 S356	Y349-T354 HydrophobicContact CE1-CG2 4.44Å; D350-T354 WeakPolarHBondContact O-CB 3.36Å; D350-T354 PolarHBondContact O-N 3.26Å; D350-T354 PolarHBondContact O-OG1 3.4Å; T354-S356 PolarHBondContact O-N 2.59Å
355	N	88.3	Confident	94.1	Very high	105 Å²	105	45.4 Å²	45.4	56%	0.561	23%	0.225	S	C	*	.	S	Bend	trans	-77.8	58.1	169.5	-172.3	14.9	0	0	0	110	R360	N355-R360 WeakPolarHBondContact OD1-CD 3.31Å; N355-R360 WeakPolarHBondContact OD1-CG 3.38Å
356	S	93.7	Very high	93.8	Very high	8 Å²	8	48.2 Å²	48.2	6%	0.056	24%	0.236	C	C	.	.			trans	-75.3	160.2	-175	82	0	0	0	0	111.2	D350 L351 T354 F358 Q359 R360	D350-S356 WeakPolarHBondContact O-CB 3.44Å; L351-S356 PolarHBondContact O-OG 3.02Å; T354-S356 PolarHBondContact O-N 2.59Å; S356-F358 VanDerWaalsContact C-N 3.29Å; S356-F358 PolarHBondContact O-N 2.91Å; S356-F358 PolarHBondContact OG-N 3.39Å; S356-Q359 PolarHBondContact O-N 3.44Å; S356-Q359 WeakPolarHBondContact OG-CB 3.47Å; S356-Q359 PolarHBondContact OG-N 3.23Å; S356-R360 PolarHBondContact O-N 2.91Å
357	P	93.8	Very high	93.7	Very high	84 Å²	84	55.4 Å²	55.4	55%	0.545	26%	0.26	S	S	.	.	H	α-helix	trans	-55.7	-46.5	169.6	-23.9	34.4	0	0	0	111.2	Q359 R360 D361	P357-Q359 PolarHBondContact O-N 3.48Å; P357-R360 PolarHBondContact O-N 2.92Å; P357-D361 WeakPolarHBondContact O-CB 3.34Å; P357-D361 PolarHBondContact O-N 3.09Å
358	F	95.2	Very high	93.6	Very high	18 Å²	18	53.2 Å²	53.2	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-52.6	-49.7	176.4	174.5	-89.3	0	0	0	112.7	L351 L352 S356 R360 D361 F362 L491 E494 L495 T498	L351-F358 HydrophobicContact CB-CD1 4.28Å; L351-F358 HydrophobicContact CB-CG 4.49Å; L351-F358 HydrophobicContact CD2-CB 3.57Å; L351-F358 HydrophobicContact CD2-CG 4Å; L352-F358 HydrophobicContact CD2-CE1 3.94Å; S356-F358 VanDerWaalsContact C-N 3.29Å; S356-F358 PolarHBondContact O-N 2.91Å; S356-F358 PolarHBondContact OG-N 3.39Å; F358-R360 VanDerWaalsContact C-N 3.35Å; F358-R360 PolarHBondContact O-N 3.44Å; F358-D361 PolarHBondContact O-N 3.26Å; F358-F362 WeakPolarHBondContact O-CB 3.42Å; F358-F362 PolarHBondContact O-N 2.9Å; F358-L491 HydrophobicContact CE1-CD1 4.01Å; F358-L491 HydrophobicContact CZ-CD1 4.05Å; F358-E494 HydrophobicContact CE2-CB 3.71Å; F358-E494 HydrophobicContact CZ-CB 4.06Å; F358-L495 HydrophobicContact CE1-CD2 4.08Å; F358-L495 HydrophobicContact CE2-CD2 4.07Å; F358-L495 HydrophobicContact CE2-CG 4.36Å; F358-L495 HydrophobicContact CZ-CD2 3.66Å; F358-L495 HydrophobicContact CZ-CG 3.81Å; F358-T498 HydrophobicContact CD2-CG2 4.33Å; F358-T498 VanDerWaalsContact CD2-OG1 3.32Å; F358-T498 WeakPolarHBondContact CD2-OG1 3.34Å; F358-T498 WeakPolarHBondContact CE2-OG1 3.48Å
359	Q	92.8	Very high	93.5	Very high	13 Å²	13	55.7 Å²	55.7	6%	0.061	27%	0.268	C	S	.	.	H	α-helix	trans	-66.9	-38.4	-175.2	-166.4	65.6	5.3	0	0	111.8	S356 P357 M363 F373	S356-Q359 PolarHBondContact O-N 3.44Å; S356-Q359 WeakPolarHBondContact OG-CB 3.47Å; S356-Q359 PolarHBondContact OG-N 3.23Å; P357-Q359 PolarHBondContact O-N 3.48Å; Q359-M363 HydrophobicContact CG-CE 4.34Å; Q359-M363 HydrophobicContact CG-SD 4.39Å; Q359-M363 WeakPolarHBondContact O-CB 3.44Å; Q359-M363 VanDerWaalsContact O-CG 3.25Å; Q359-M363 WeakPolarHBondContact O-CG 3.27Å; Q359-M363 PolarHBondContact O-N 3.46Å; Q359-F373 HydrophobicContact CG-CZ 4.25Å
360	R	92.3	Very high	93.3	Very high	126 Å²	126	59.7 Å²	59.7	48%	0.475	29%	0.291	S	S	.	.	H	α-helix	trans	-64.6	-53	173.5	-76.3	170.5	38.6	-129.1	-34	111.7	N355 S356 P357 F358 F362 M363 E364	N355-R360 WeakPolarHBondContact OD1-CD 3.31Å; N355-R360 WeakPolarHBondContact OD1-CG 3.38Å; S356-R360 PolarHBondContact O-N 2.91Å; P357-R360 PolarHBondContact O-N 2.92Å; F358-R360 VanDerWaalsContact C-N 3.35Å; F358-R360 PolarHBondContact O-N 3.44Å; R360-F362 VanDerWaalsContact C-N 3.3Å; R360-F362 PolarHBondContact O-N 3.24Å; R360-M363 PolarHBondContact O-N 2.84Å; R360-M363 VanDerWaalsContact O-N 3.13Å; R360-E364 PolarHBondContact O-N 2.8Å
361	D	94.1	Very high	93.2	Very high	72 Å²	72	59 Å²	59	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-37.7	-174.7	-58.5	-7.7	0	0	0	110.2	P357 F358 E364 Q365	P357-D361 WeakPolarHBondContact O-CB 3.34Å; P357-D361 PolarHBondContact O-N 3.09Å; F358-D361 PolarHBondContact O-N 3.26Å; D361-E364 PolarHBondContact O-N 2.92Å; D361-Q365 WeakPolarHBondContact O-CB 3.46Å; D361-Q365 VanDerWaalsContact O-CG 3.28Å; D361-Q365 WeakPolarHBondContact O-CG 3.13Å; D361-Q365 PolarHBondContact O-N 2.79Å
362	F	94.8	Very high	93.1	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-60.3	-49.4	170	174	-95.7	0	0	0	112.1	F358 R360 E364 Q365 R366 Y487 H490 L491 E494	F358-F362 WeakPolarHBondContact O-CB 3.42Å; F358-F362 PolarHBondContact O-N 2.9Å; R360-F362 VanDerWaalsContact C-N 3.3Å; R360-F362 PolarHBondContact O-N 3.24Å; F362-E364 VanDerWaalsContact C-N 3.33Å; F362-E364 PolarHBondContact O-N 2.89Å; F362-Q365 PolarHBondContact O-N 3.39Å; F362-R366 HydrophobicContact CE1-CG 4.24Å; F362-R366 HydrophobicContact CE2-CG 4.34Å; F362-R366 HydrophobicContact CZ-CG 4.15Å; F362-R366 WeakPolarHBondContact O-CB 3.34Å; F362-R366 WeakPolarHBondContact O-CG 3.48Å; F362-R366 PolarHBondContact O-N 2.72Å; F362-Y487 AromaticContact CE1-CE2 3.71Å; F362-Y487 HydrophobicContact CE1-CE2 3.71Å; F362-Y487 AromaticContact CE1-CZ 3.83Å; F362-Y487 HydrophobicContact CZ-CD2 4.28Å; F362-Y487 AromaticContact CZ-CE2 3.79Å; F362-Y487 HydrophobicContact CZ-CE2 3.79Å; F362-Y487 AromaticContact CZ-CZ 3.95Å; F362-H490 AromaticContact CD2-CD2 3.86Å; F362-H490 HydrophobicContact CE2-CB 4.47Å; F362-H490 AromaticContact CE2-CD2 3.62Å; F362-L491 HydrophobicContact CD2-CD1 4.09Å; F362-L491 HydrophobicContact CE1-CD1 4.19Å; F362-L491 HydrophobicContact CE2-CB 3.85Å; F362-L491 HydrophobicContact CE2-CD1 3.71Å; F362-L491 HydrophobicContact CE2-CG 4.42Å; F362-L491 HydrophobicContact CG-CD1 4.48Å; F362-L491 HydrophobicContact CZ-CB 3.99Å; F362-L491 HydrophobicContact CZ-CD1 3.77Å; F362-L491 HydrophobicContact CZ-CG 4.47Å; F362-E494 HydrophobicContact CD2-CB 4.45Å; F362-E494 HydrophobicContact CD2-CG 4.2Å
363	M	92.4	Very high	93	Very high	2 Å²	2	65 Å²	65	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-36.9	177.8	-76.5	174.6	167.2	0	0	112.6	Q359 R360 R366 R367 F368 I371 F373	Q359-M363 HydrophobicContact CG-CE 4.34Å; Q359-M363 HydrophobicContact CG-SD 4.39Å; Q359-M363 WeakPolarHBondContact O-CB 3.44Å; Q359-M363 VanDerWaalsContact O-CG 3.25Å; Q359-M363 WeakPolarHBondContact O-CG 3.27Å; Q359-M363 PolarHBondContact O-N 3.46Å; R360-M363 PolarHBondContact O-N 2.84Å; R360-M363 VanDerWaalsContact O-N 3.13Å; M363-R366 CarbonylContact O-C 3.49Å; M363-R366 PolarHBondContact O-N 2.93Å; M363-R367 PolarHBondContact O-N 2.96Å; M363-F368 HydrophobicContact CB-CB 4.26Å; M363-F368 HydrophobicContact CB-CD2 4.33Å; M363-F368 HydrophobicContact CG-CD2 3.96Å; M363-F368 PolarHBondContact O-N 3.45Å; M363-I371 HydrophobicContact CB-CD1 3.75Å; M363-I371 HydrophobicContact CG-CD1 4.37Å; M363-I371 HydrophobicContact SD-CD1 3.95Å; M363-I371 HydrophobicContact SD-CG2 3.98Å; M363-F373 HydrophobicContact CE-CE1 4.32Å; M363-F373 HydrophobicContact CE-CZ 4Å; M363-F373 HydrophobicContact SD-CE2 4.44Å; M363-F373 HydrophobicContact SD-CZ 3.77Å
364	E	92.3	Very high	93	Very high	144 Å²	144	68.5 Å²	68.5	67%	0.673	33%	0.332	S	S	*	.	H	α-helix	trans	-67.3	-46.5	175.8	-173.7	173	175.3	0	0	111.8	R360 D361 F362 R366 R367	R360-E364 PolarHBondContact O-N 2.8Å; D361-E364 PolarHBondContact O-N 2.92Å; F362-E364 VanDerWaalsContact C-N 3.33Å; F362-E364 PolarHBondContact O-N 2.89Å; E364-R366 PolarHBondContact O-N 3.5Å; E364-R367 WeakPolarHBondContact O-CA 3.4Å; E364-R367 PolarHBondContact O-N 3.31Å
365	Q	92.3	Very high	93.1	Very high	98 Å²	98	70.7 Å²	70.7	46%	0.458	35%	0.347	S	S	.	.	H	α-helix	trans	-55.1	-38.5	171.8	-73.9	-178.1	29.4	0	0	111.9	D361 F362 R367 H490 E494	D361-Q365 WeakPolarHBondContact O-CB 3.46Å; D361-Q365 VanDerWaalsContact O-CG 3.28Å; D361-Q365 WeakPolarHBondContact O-CG 3.13Å; D361-Q365 PolarHBondContact O-N 2.79Å; F362-Q365 PolarHBondContact O-N 3.39Å; Q365-R367 PolarHBondContact O-N 2.69Å; Q365-H490 PolarHBondContact OE1-CE1 3.07Å; Q365-H490 PolarHBondContact OE1-NE2 3.04Å; Q365-E494 PolarHBondContact NE2-OE2 3.43Å; Q365-E494 PolarHBondContact OE1-OE2 3.35Å
366	R	91.1	Very high	93.4	Very high	61 Å²	61	68.3 Å²	68.3	23%	0.23	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	0.3	177	-64.9	-61.2	-63.9	-150	-6	114.3	F362 M363 E364 F368 D486 H490	F362-R366 HydrophobicContact CE1-CG 4.24Å; F362-R366 HydrophobicContact CE2-CG 4.34Å; F362-R366 HydrophobicContact CZ-CG 4.15Å; F362-R366 WeakPolarHBondContact O-CB 3.34Å; F362-R366 WeakPolarHBondContact O-CG 3.48Å; F362-R366 PolarHBondContact O-N 2.72Å; M363-R366 CarbonylContact O-C 3.49Å; M363-R366 PolarHBondContact O-N 2.93Å; E364-R366 PolarHBondContact O-N 3.5Å; R366-F368 VanDerWaalsContact C-N 3.33Å; R366-F368 HydrophobicContact CB-CD1 3.85Å; R366-F368 HydrophobicContact CB-CE1 3.75Å; R366-F368 HydrophobicContact CB-CG 4.45Å; R366-F368 HydrophobicContact CB-CZ 4.28Å; R366-F368 WeakPolarHBondContact O-CD1 3.3Å; R366-F368 PolarHBondContact O-N 2.84Å; R366-D486 PolarHBondContact NH1-O 2.84Å; R366-H490 VanDerWaalsContact NH1-CB 3.28Å
367	R	91.7	Very high	93.5	Very high	188 Å²	188	74.4 Å²	74.4	71%	0.709	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	40.1	-178.8	-53.7	178.3	-178.2	167.5	0.6	113.2	M363 E364 Q365 T393	M363-R367 PolarHBondContact O-N 2.96Å; E364-R367 WeakPolarHBondContact O-CA 3.4Å; E364-R367 PolarHBondContact O-N 3.31Å; Q365-R367 PolarHBondContact O-N 2.69Å; R367-T393 HydrophobicContact CB-CG2 4.24Å
368	F	93.7	Very high	93.5	Very high	30 Å²	30	78.4 Å²	78.4	13%	0.132	37%	0.365	C	S	.	.			trans	-82.8	136.9	170.4	-66.7	8.4	0	0	0	109	M363 R366 I371 Y390 T391 I392 Y487	M363-F368 HydrophobicContact CB-CB 4.26Å; M363-F368 HydrophobicContact CB-CD2 4.33Å; M363-F368 HydrophobicContact CG-CD2 3.96Å; M363-F368 PolarHBondContact O-N 3.45Å; R366-F368 VanDerWaalsContact C-N 3.33Å; R366-F368 HydrophobicContact CB-CD1 3.85Å; R366-F368 HydrophobicContact CB-CE1 3.75Å; R366-F368 HydrophobicContact CB-CG 4.45Å; R366-F368 HydrophobicContact CB-CZ 4.28Å; R366-F368 WeakPolarHBondContact O-CD1 3.3Å; R366-F368 PolarHBondContact O-N 2.84Å; F368-I371 HydrophobicContact CB-CD1 4.11Å; F368-I371 HydrophobicContact CB-CG1 4.32Å; F368-Y390 AromaticContact CD2-CD2 3.67Å; F368-Y390 HydrophobicContact CD2-CD2 3.67Å; F368-Y390 AromaticContact CD2-CE2 3.88Å; F368-Y390 HydrophobicContact CD2-CE2 3.88Å; F368-Y390 HydrophobicContact CD2-CG 4.35Å; F368-Y390 AromaticContact CE2-CD2 3.94Å; F368-Y390 HydrophobicContact CE2-CD2 3.94Å; F368-Y390 AromaticContact CE2-CE2 3.63Å; F368-Y390 HydrophobicContact CE2-CE2 3.63Å; F368-Y390 HydrophobicContact CG-CD2 4.28Å; F368-Y390 HydrophobicContact CZ-CE2 4.32Å; F368-T391 CarbonylContact C-O 3.47Å; F368-T391 VanDerWaalsContact CA-O 3.28Å; F368-T391 WeakPolarHBondContact CA-O 3.14Å; F368-I392 HydrophobicContact CD1-CB 4.31Å; F368-I392 HydrophobicContact CD1-CG2 3.72Å; F368-I392 HydrophobicContact CD2-CG2 4.36Å; F368-I392 HydrophobicContact CE1-CB 4.21Å; F368-I392 HydrophobicContact CE1-CG2 3.55Å; F368-I392 HydrophobicContact CE2-CG2 4.21Å; F368-I392 HydrophobicContact CG-CG2 4.14Å; F368-I392 HydrophobicContact CZ-CG2 3.82Å; F368-Y487 HydrophobicContact CE2-CE2 4.4Å; F368-Y487 HydrophobicContact CZ-CD2 4.49Å; F368-Y487 HydrophobicContact CZ-CE2 4.14Å
369	S	92.9	Very high	93.4	Very high	52 Å²	52	80.7 Å²	80.7	36%	0.364	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	171.2	176.7	65.6	0	0	0	0	111.7	I371 T391	S369-I371 PolarHBondContact O-N 3.43Å; S369-I371 VanDerWaalsContact O-N 3.14Å; S369-T391 PolarHBondContact N-O 2.83Å; S369-T391 PolarHBondContact O-N 3.05Å; S369-T391 WeakPolarHBondContact OG-CB 3.49Å
370	D	92.6	Very high	93.2	Very high	114 Å²	114	90.2 Å²	90.2	61%	0.61	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58	32.7	170.5	-39.1	-63	0	0	0	114	I372 T391	D370-I372 PolarHBondContact O-N 2.87Å; D370-T391 VanDerWaalsContact OD2-CB 3.31Å; D370-T391 WeakPolarHBondContact OD2-CB 3.49Å; D370-T391 PolarHBondContact OD2-OG1 3.34Å
371	I	93.4	Very high	92.9	Very high	58 Å²	58	88 Å²	88	30%	0.297	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	120.7	-170.2	-53.4	159	0	0	0	110.7	M363 F368 S369 F373 L389	M363-I371 HydrophobicContact CB-CD1 3.75Å; M363-I371 HydrophobicContact CG-CD1 4.37Å; M363-I371 HydrophobicContact SD-CD1 3.95Å; M363-I371 HydrophobicContact SD-CG2 3.98Å; F368-I371 HydrophobicContact CB-CD1 4.11Å; F368-I371 HydrophobicContact CB-CG1 4.32Å; S369-I371 PolarHBondContact O-N 3.43Å; S369-I371 VanDerWaalsContact O-N 3.14Å; I371-F373 HydrophobicContact CG2-CD2 3.98Å; I371-F373 HydrophobicContact CG2-CE2 3.51Å; I371-F373 HydrophobicContact CG2-CZ 3.99Å; I371-L389 CarbonylContact C-O 3.54Å; I371-L389 WeakPolarHBondContact CA-O 3.41Å
372	I	94.4	Very high	92.7	Very high	89 Å²	89	85.9 Å²	85.9	46%	0.456	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	111.2	177.8	-56.5	173.4	0	0	0	109	D370 I388 L389	D370-I372 PolarHBondContact O-N 2.87Å; I372-I388 WeakPolarHBondContact O-CA 3.24Å; I372-L389 HydrophobicContact CB-CB 4.33Å; I372-L389 PolarHBondContact N-O 2.98Å; I372-L389 PolarHBondContact O-N 3.16Å
373	F	93	Very high	92.6	Very high	53 Å²	53	86.8 Å²	86.8	23%	0.232	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.2	170.4	-64.2	-90.2	0	0	0	110.2	Q359 M363 I371 I388	Q359-F373 HydrophobicContact CG-CZ 4.25Å; M363-F373 HydrophobicContact CE-CE1 4.32Å; M363-F373 HydrophobicContact CE-CZ 4Å; M363-F373 HydrophobicContact SD-CE2 4.44Å; M363-F373 HydrophobicContact SD-CZ 3.77Å; I371-F373 HydrophobicContact CG2-CD2 3.98Å; I371-F373 HydrophobicContact CG2-CE2 3.51Å; I371-F373 HydrophobicContact CG2-CZ 3.99Å; F373-I388 HydrophobicContact CD1-CD1 3.88Å; F373-I388 HydrophobicContact CD1-CG1 4.04Å; F373-I388 HydrophobicContact CD1-CG2 3.8Å; F373-I388 HydrophobicContact CE1-CD1 3.93Å; F373-I388 HydrophobicContact CE1-CG2 4.01Å; F373-I388 HydrophobicContact CG-CG2 4.27Å
374	H	95.4	Very high	92.8	Very high	76 Å²	76	90.5 Å²	90.5	35%	0.352	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-82.8	148.9	163.9	-63.9	-69.1	0	0	0	110.8	V387	H374-V387 VanDerWaalsContact CB-O 3.29Å; H374-V387 WeakPolarHBondContact CB-O 3.45Å; H374-V387 PolarHBondContact CD2-O 3.43Å; H374-V387 VanDerWaalsContact CD2-O 3.31Å; H374-V387 PolarHBondContact N-O 3.22Å
375	P	94.8	Very high	93	Very high	92 Å²	92	84.5 Å²	84.5	60%	0.597	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-66	154.3	176.1	28.5	-35.8	0	0	0	111.7
376	W	95.3	Very high	93.2	Very high	55 Å²	55	80.7 Å²	80.7	21%	0.208	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-59.4	136.8	169.5	-68.7	110.9	0	0	0	111.1	Y349 F353 Q384 R386 Q409 M411 I423	Y349-W376 PolarHBondContact OH-NE1 3.35Å; F353-W376 HydrophobicContact CB-CZ2 4.47Å; W376-Q384 HydrophobicContact CE3-CB 4.04Å; W376-R386 HydrophobicContact CD2-CB 4.21Å; W376-R386 HydrophobicContact CD2-CG 3.95Å; W376-R386 HydrophobicContact CE3-CB 3.99Å; W376-R386 HydrophobicContact CE3-CG 3.78Å; W376-R386 HydrophobicContact CH2-CG 4.09Å; W376-R386 HydrophobicContact CZ2-CG 4.26Å; W376-R386 HydrophobicContact CZ3-CB 4.45Å; W376-R386 HydrophobicContact CZ3-CG 3.85Å; W376-Q409 HydrophobicContact CH2-CB 3.87Å; W376-Q409 HydrophobicContact CZ3-CB 4.23Å; W376-Q409 WeakPolarHBondContact CZ3-O 3.44Å; W376-M411 HydrophobicContact CH2-CB 4.17Å; W376-M411 HydrophobicContact CZ2-CE 4.37Å; W376-M411 HydrophobicContact CZ3-CB 4.06Å; W376-I423 HydrophobicContact CH2-CG2 4.14Å
377	K	95.1	Very high	93.5	Very high	136 Å²	136	79.1 Å²	79.1	59%	0.591	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.1	177.5	-63.2	178.1	-178.3	-179.9	0	108.8	Q384 S385	K377-Q384 CarbonylContact O-C 3.54Å; K377-Q384 VanDerWaalsContact O-CA 3.26Å; K377-Q384 WeakPolarHBondContact O-CA 3.5Å; K377-S385 PolarHBondContact N-O 3.13Å; K377-S385 PolarHBondContact O-N 3.25Å
378	K	94.3	Very high	93.7	Very high	168 Å²	168	70.2 Å²	70.2	73%	0.73	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.4	175.1	-166.6	170	-174.5	170.7	0	110.3
379	E	92.2	Very high	93.8	Very high	65 Å²	65	71.6 Å²	71.6	30%	0.304	36%	0.362	S	S	.	.			trans	-92.5	159.3	178	-64.5	-171.1	164	0	0	111.9	N381 G382 N383 S385	E379-N381 WeakPolarHBondContact CB-OD1 3.43Å; E379-N381 PolarHBondContact O-N 3.08Å; E379-N381 PolarHBondContact OE2-ND2 3.01Å; E379-G382 PolarHBondContact O-N 3.1Å; E379-N383 PolarHBondContact N-O 3.4Å; E379-S385 WeakPolarHBondContact OE1-CB 3.45Å; E379-S385 PolarHBondContact OE1-OG 3.15Å
380	E	88.6	Confident	94	Very high	213 Å²	213	70 Å²	70	100%	0.995	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.4	178.1	-61	178.8	177	0	0	113.1	G382	E380-G382 PolarHBondContact O-N 2.97Å
381	N	87.1	Confident	94.1	Very high	81 Å²	81	65.4 Å²	65.4	43%	0.433	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-8.2	177.4	61.3	37.8	0	0	0	113.9	E379 N383	E379-N381 WeakPolarHBondContact CB-OD1 3.43Å; E379-N381 PolarHBondContact O-N 3.08Å; E379-N381 PolarHBondContact OE2-ND2 3.01Å; N381-N383 WeakPolarHBondContact OD1-CB 3.28Å; N381-N383 VanDerWaalsContact OD1-CG 3.26Å; N381-N383 PolarHBondContact OD1-N 3.36Å; N381-N383 PolarHBondContact OD1-ND2 3.25Å
382	G	88.6	Confident	94	Very high	27 Å²	27	63.9 Å²	63.9	28%	0.278	32%	0.317	S	S	.	.	S	Bend	trans	97.1	-11.9	-179.4	0	0	0	0	0	115.8	E379 E380 K413	E379-G382 PolarHBondContact O-N 3.1Å; E380-G382 PolarHBondContact O-N 2.97Å; G382-K413 WeakPolarHBondContact O-CB 3.37Å
383	N	93.8	Very high	93.7	Very high	20 Å²	20	62.9 Å²	62.9	11%	0.107	32%	0.315	C	S	.	.			trans	-69.9	172.3	174.5	-62.3	-24.9	0	0	0	111.3	E379 N381 T410 M411 K413	E379-N383 PolarHBondContact N-O 3.4Å; N381-N383 WeakPolarHBondContact OD1-CB 3.28Å; N381-N383 VanDerWaalsContact OD1-CG 3.26Å; N381-N383 PolarHBondContact OD1-N 3.36Å; N381-N383 PolarHBondContact OD1-ND2 3.25Å; N383-T410 HydrophobicContact CB-CG2 4.09Å; N383-M411 WeakPolarHBondContact CA-O 3.43Å; N383-M411 WeakPolarHBondContact CB-O 3.34Å; N383-K413 PolarHBondContact OD1-N 2.86Å
384	Q	95.6	Very high	93.2	Very high	80 Å²	80	62.7 Å²	62.7	37%	0.374	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.9	165.8	-51.6	-173.6	29	0	0	109.8	W376 K377 T410 M411	W376-Q384 HydrophobicContact CE3-CB 4.04Å; K377-Q384 CarbonylContact O-C 3.54Å; K377-Q384 VanDerWaalsContact O-CA 3.26Å; K377-Q384 WeakPolarHBondContact O-CA 3.5Å; Q384-T410 CarbonylContact O-C 3.34Å; Q384-T410 WeakPolarHBondContact O-CA 3.24Å; Q384-M411 HydrophobicContact CB-CB 4.37Å; Q384-M411 PolarHBondContact N-O 2.98Å; Q384-M411 PolarHBondContact O-N 2.96Å
385	S	96.8	Very high	92.2	Very high	19 Å²	19	66 Å²	66	13%	0.133	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	155.4	174.3	67.3	0	0	0	0	113.2	K377 E379 Q409	K377-S385 PolarHBondContact N-O 3.13Å; K377-S385 PolarHBondContact O-N 3.25Å; E379-S385 WeakPolarHBondContact OE1-CB 3.45Å; E379-S385 PolarHBondContact OE1-OG 3.15Å; S385-Q409 CarbonylContact C-O 3.56Å; S385-Q409 WeakPolarHBondContact CA-O 3.4Å; S385-Q409 WeakPolarHBondContact CB-O 3.24Å
386	R	96.8	Very high	91	Very high	18 Å²	18	63.5 Å²	63.5	7%	0.068	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	165.7	172	67.7	176.6	-178.4	-174	0.7	111	F353 W376 T408 Q409	F353-R386 PolarHBondContact O-NH1 3.39Å; F353-R386 PolarHBondContact O-NH2 2.81Å; W376-R386 HydrophobicContact CD2-CB 4.21Å; W376-R386 HydrophobicContact CD2-CG 3.95Å; W376-R386 HydrophobicContact CE3-CB 3.99Å; W376-R386 HydrophobicContact CE3-CG 3.78Å; W376-R386 HydrophobicContact CH2-CG 4.09Å; W376-R386 HydrophobicContact CZ2-CG 4.26Å; W376-R386 HydrophobicContact CZ3-CB 4.45Å; W376-R386 HydrophobicContact CZ3-CG 3.85Å; R386-T408 WeakPolarHBondContact O-CA 3.34Å; R386-Q409 HydrophobicContact CG-CB 4.05Å; R386-Q409 PolarHBondContact N-O 2.94Å; R386-Q409 PolarHBondContact O-N 2.82Å
387	V	97.5	Very high	89.5	Confident	28 Å²	28	67 Å²	67	17%	0.17	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	139.6	172.4	178.2	0	0	0	0	108.5	H374 L389 R406 E407 T408	H374-V387 VanDerWaalsContact CB-O 3.29Å; H374-V387 WeakPolarHBondContact CB-O 3.45Å; H374-V387 PolarHBondContact CD2-O 3.43Å; H374-V387 VanDerWaalsContact CD2-O 3.31Å; H374-V387 PolarHBondContact N-O 3.22Å; V387-L389 HydrophobicContact CG1-CD2 3.8Å; V387-L389 HydrophobicContact CG1-CG 4.29Å; V387-R406 HydrophobicContact CG1-CG 4.1Å; V387-E407 CarbonylContact C-O 3.59Å; V387-E407 WeakPolarHBondContact CA-O 3.36Å; V387-T408 HydrophobicContact CG2-CG2 4.28Å
388	I	96.1	Very high	87.7	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.4	170.3	-43.3	175.2	0	0	0	106.7	I372 F373 Y390 E407 Q409	I372-I388 WeakPolarHBondContact O-CA 3.24Å; F373-I388 HydrophobicContact CD1-CD1 3.88Å; F373-I388 HydrophobicContact CD1-CG1 4.04Å; F373-I388 HydrophobicContact CD1-CG2 3.8Å; F373-I388 HydrophobicContact CE1-CD1 3.93Å; F373-I388 HydrophobicContact CE1-CG2 4.01Å; F373-I388 HydrophobicContact CG-CG2 4.27Å; I388-Y390 HydrophobicContact CB-CD1 4.48Å; I388-Y390 HydrophobicContact CB-CE1 4.47Å; I388-Y390 HydrophobicContact CG2-CD1 3.93Å; I388-Y390 HydrophobicContact CG2-CE1 4.29Å; I388-E407 HydrophobicContact CB-CB 4.37Å; I388-E407 PolarHBondContact N-O 3.35Å; I388-E407 PolarHBondContact O-N 2.92Å; I388-Q409 HydrophobicContact CD1-CG 4.32Å
389	L	96.4	Very high	86.4	Confident	58 Å²	58	58.8 Å²	58.8	30%	0.304	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.1	174.6	-53.3	176.8	0	0	0	108.2	I371 I372 V387 V405 R406	I371-L389 CarbonylContact C-O 3.54Å; I371-L389 WeakPolarHBondContact CA-O 3.41Å; I372-L389 HydrophobicContact CB-CB 4.33Å; I372-L389 PolarHBondContact N-O 2.98Å; I372-L389 PolarHBondContact O-N 3.16Å; V387-L389 HydrophobicContact CG1-CD2 3.8Å; V387-L389 HydrophobicContact CG1-CG 4.29Å; L389-V405 WeakPolarHBondContact CA-O 3.28Å; L389-R406 HydrophobicContact CD2-CB 4Å; L389-R406 HydrophobicContact CD2-CG 3.76Å
390	Y	95.6	Very high	85.7	Confident	18 Å²	18	58.6 Å²	58.6	7%	0.071	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	159.2	175.7	50	-88.3	0	0	0	111.2	F368 I388 I392 V405 E407	F368-Y390 AromaticContact CD2-CD2 3.67Å; F368-Y390 HydrophobicContact CD2-CD2 3.67Å; F368-Y390 AromaticContact CD2-CE2 3.88Å; F368-Y390 HydrophobicContact CD2-CE2 3.88Å; F368-Y390 HydrophobicContact CD2-CG 4.35Å; F368-Y390 AromaticContact CE2-CD2 3.94Å; F368-Y390 HydrophobicContact CE2-CD2 3.94Å; F368-Y390 AromaticContact CE2-CE2 3.63Å; F368-Y390 HydrophobicContact CE2-CE2 3.63Å; F368-Y390 HydrophobicContact CG-CD2 4.28Å; F368-Y390 HydrophobicContact CZ-CE2 4.32Å; I388-Y390 HydrophobicContact CB-CD1 4.48Å; I388-Y390 HydrophobicContact CB-CE1 4.47Å; I388-Y390 HydrophobicContact CG2-CD1 3.93Å; I388-Y390 HydrophobicContact CG2-CE1 4.29Å; Y390-I392 HydrophobicContact CD2-CG2 3.66Å; Y390-I392 HydrophobicContact CE2-CG2 3.73Å; Y390-V405 HydrophobicContact CD2-CB 3.85Å; Y390-V405 HydrophobicContact CD2-CG1 4.31Å; Y390-V405 HydrophobicContact CD2-CG2 4.21Å; Y390-V405 HydrophobicContact CE1-CG1 4.25Å; Y390-V405 HydrophobicContact CE2-CB 3.68Å; Y390-V405 HydrophobicContact CE2-CG1 3.66Å; Y390-V405 HydrophobicContact CE2-CG2 4.01Å; Y390-V405 HydrophobicContact CG-CB 4.38Å; Y390-V405 PolarHBondContact N-O 3.47Å; Y390-V405 VanDerWaalsContact N-O 3.14Å; Y390-V405 WeakPolarHBondContact O-CA 3.38Å; Y390-V405 WeakPolarHBondContact O-CB 3.42Å; Y390-V405 PolarHBondContact O-N 3.31Å; Y390-E407 HydrophobicContact CE1-CB 3.9Å; Y390-E407 VanDerWaalsContact CE1-OE2 3.31Å; Y390-E407 WeakPolarHBondContact CE1-OE2 3.39Å; Y390-E407 PolarHBondContact OH-OE2 2.94Å
391	T	94.6	Very high	85.4	Confident	19 Å²	19	57.1 Å²	57.1	12%	0.117	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.5	172.3	-53.8	0	0	0	0	109.3	F368 S369 D370 T402 A403	F368-T391 CarbonylContact C-O 3.47Å; F368-T391 VanDerWaalsContact CA-O 3.28Å; F368-T391 WeakPolarHBondContact CA-O 3.14Å; S369-T391 PolarHBondContact N-O 2.83Å; S369-T391 PolarHBondContact O-N 3.05Å; S369-T391 WeakPolarHBondContact OG-CB 3.49Å; D370-T391 VanDerWaalsContact OD2-CB 3.31Å; D370-T391 WeakPolarHBondContact OD2-CB 3.49Å; D370-T391 PolarHBondContact OD2-OG1 3.34Å; T391-T402 HydrophobicContact CG2-CG2 4.27Å; T391-A403 WeakPolarHBondContact CA-O 3.31Å
392	I	92.6	Very high	85.5	Confident	26 Å²	26	56.8 Å²	56.8	13%	0.133	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.4	174.3	65	176	0	0	0	111.2	F368 Y390 L394 T402 A403 V405 T429	F368-I392 HydrophobicContact CD1-CB 4.31Å; F368-I392 HydrophobicContact CD1-CG2 3.72Å; F368-I392 HydrophobicContact CD2-CG2 4.36Å; F368-I392 HydrophobicContact CE1-CB 4.21Å; F368-I392 HydrophobicContact CE1-CG2 3.55Å; F368-I392 HydrophobicContact CE2-CG2 4.21Å; F368-I392 HydrophobicContact CG-CG2 4.14Å; F368-I392 HydrophobicContact CZ-CG2 3.82Å; Y390-I392 HydrophobicContact CD2-CG2 3.66Å; Y390-I392 HydrophobicContact CE2-CG2 3.73Å; I392-L394 HydrophobicContact CD1-CD2 3.8Å; I392-L394 HydrophobicContact CG1-CD2 4.11Å; I392-L394 HydrophobicContact CG1-CG 4.48Å; I392-T402 CarbonylContact O-C 3.53Å; I392-T402 WeakPolarHBondContact O-CA 3.43Å; I392-A403 HydrophobicContact CG1-CB 4.15Å; I392-A403 PolarHBondContact N-O 2.98Å; I392-A403 PolarHBondContact O-N 3.43Å; I392-V405 HydrophobicContact CB-CG2 4.42Å; I392-V405 HydrophobicContact CD1-CG2 3.84Å; I392-V405 HydrophobicContact CG1-CG2 3.83Å; I392-V405 HydrophobicContact CG2-CG2 3.81Å; I392-T429 HydrophobicContact CD1-CG2 4.1Å
393	T	88.1	Confident	85.7	Confident	68 Å²	68	55.5 Å²	55.5	42%	0.417	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	137.4	167.5	60.8	0	0	0	0	111	R367 T402	R367-T393 HydrophobicContact CB-CG2 4.24Å; T393-T402 HydrophobicContact CG2-CG2 4.29Å
394	L	83.1	Confident	85.7	Confident	49 Å²	49	57.6 Å²	57.6	26%	0.257	32%	0.322	S	S	.	.			trans	-113.3	138.2	-178.2	-64.4	178.1	0	0	0	112.1	I392 A399 P400 K401 A403 V432	I392-L394 HydrophobicContact CD1-CD2 3.8Å; I392-L394 HydrophobicContact CG1-CD2 4.11Å; I392-L394 HydrophobicContact CG1-CG 4.48Å; L394-A399 HydrophobicContact CD1-CB 4.03Å; L394-P400 WeakPolarHBondContact CB-O 3.21Å; L394-P400 WeakPolarHBondContact CD1-O 3.44Å; L394-K401 PolarHBondContact N-O 3.28Å; L394-A403 HydrophobicContact CD1-CB 3.66Å; L394-A403 HydrophobicContact CG-CB 4.31Å; L394-V432 HydrophobicContact CD1-CG1 3.49Å; L394-V432 VanDerWaalsContact CD1-CG1 3.49Å
395	T	73.7	Confident	85.8	Confident	145 Å²	145	54 Å²	54	89%	0.89	31%	0.306	S	S	*	.			trans	-94.7	-12.8	179.9	47.6	0	0	0	0	113.6
396	N	70.2	Confident	85.8	Confident	39 Å²	39	57.7 Å²	57.7	21%	0.209	32%	0.317	C	S	.	.			trans	-78.7	121.3	-176.2	-176.4	-28.5	0	0	0	111.1	L398 A399 N479	N396-L398 PolarHBondContact O-N 2.87Å; N396-L398 VanDerWaalsContact O-N 3.15Å; N396-L398 WeakPolarHBondContact OD1-CB 3.34Å; N396-L398 PolarHBondContact OD1-N 3.43Å; N396-A399 HydrophobicContact CB-CB 4.4Å; N396-A399 PolarHBondContact O-N 2.83Å; N396-A399 VanDerWaalsContact O-N 3.13Å; N396-N479 PolarHBondContact ND2-OD1 2.68Å
397	P	62.4	Low	85.8	Confident	129 Å²	129	57.1 Å²	57.1	84%	0.838	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-8.8	-177.7	29.8	-37	0	0	0	114.8
398	L	58.6	Low	85.9	Confident	109 Å²	109	57 Å²	57	57%	0.571	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-0	175.3	-58.4	174.1	0	0	0	113.1	N396 P433 F475	N396-L398 PolarHBondContact O-N 2.87Å; N396-L398 VanDerWaalsContact O-N 3.15Å; N396-L398 WeakPolarHBondContact OD1-CB 3.34Å; N396-L398 PolarHBondContact OD1-N 3.43Å; L398-P433 WeakPolarHBondContact O-CG 3.3Å; L398-F475 HydrophobicContact CD1-CE2 4.02Å; L398-F475 HydrophobicContact CD1-CZ 4.31Å
399	A	66.5	Low	86	Confident	22 Å²	22	57.1 Å²	57.1	18%	0.182	32%	0.315	C	S	.	.	S	Bend	trans	-115.9	163.2	176.2	0	0	0	0	0	110.9	L394 N396 P433	L394-A399 HydrophobicContact CD1-CB 4.03Å; N396-A399 HydrophobicContact CB-CB 4.4Å; N396-A399 PolarHBondContact O-N 2.83Å; N396-A399 VanDerWaalsContact O-N 3.13Å; A399-P433 HydrophobicContact CB-CG 4.5Å
400	P	76.8	Confident	86	Confident	61 Å²	61	55.8 Å²	55.8	40%	0.396	31%	0.31	S	S	.	.			trans	-57.9	152.3	165.9	-21.8	34.6	0	0	0	111.1	L394 T402 D431	L394-P400 WeakPolarHBondContact CB-O 3.21Å; L394-P400 WeakPolarHBondContact CD1-O 3.44Å; P400-T402 WeakPolarHBondContact CB-O 3.37Å; P400-T402 PolarHBondContact O-N 3.27Å; P400-T402 VanDerWaalsContact O-N 3.16Å; P400-D431 WeakPolarHBondContact CG-O 3.33Å
401	K	83.4	Confident	86	Confident	182 Å²	182	55.6 Å²	55.6	79%	0.791	31%	0.309	S	S	*	.	S	Bend	trans	-65.1	-18.8	-178	-65.6	-174.7	178.4	-177.4	0	114	L394	L394-K401 PolarHBondContact N-O 3.28Å
402	T	88.8	Confident	86	Confident	74 Å²	74	57.1 Å²	57.1	45%	0.454	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	151.1	176.8	46.3	0	0	0	0	109.4	T391 I392 T393 P400	T391-T402 HydrophobicContact CG2-CG2 4.27Å; I392-T402 CarbonylContact O-C 3.53Å; I392-T402 WeakPolarHBondContact O-CA 3.43Å; T393-T402 HydrophobicContact CG2-CG2 4.29Å; P400-T402 WeakPolarHBondContact CB-O 3.37Å; P400-T402 PolarHBondContact O-N 3.27Å; P400-T402 VanDerWaalsContact O-N 3.16Å
403	A	91.7	Very high	85.8	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.008	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	140.7	173.4	0	0	0	0	0	110.2	T391 I392 L394 T429 H430 D431 V432	T391-A403 WeakPolarHBondContact CA-O 3.31Å; I392-A403 HydrophobicContact CG1-CB 4.15Å; I392-A403 PolarHBondContact N-O 2.98Å; I392-A403 PolarHBondContact O-N 3.43Å; L394-A403 HydrophobicContact CD1-CB 3.66Å; L394-A403 HydrophobicContact CG-CB 4.31Å; A403-T429 HydrophobicContact CB-CG2 3.76Å; A403-H430 WeakPolarHBondContact CB-O 3.05Å; A403-D431 HydrophobicContact CB-CB 4.44Å; A403-V432 HydrophobicContact CB-CG1 3.88Å
404	T	94.9	Very high	85.6	Confident	63 Å²	63	60.9 Å²	60.9	39%	0.387	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	143.6	172.5	57.7	0	0	0	0	110.4	H430 D431	T404-H430 PolarHBondContact O-N 3.31Å; T404-H430 WeakPolarHBondContact OG1-CB 3.45Å; T404-D431 PolarHBondContact N-OD2 2.96Å; T404-D431 PolarHBondContact OG1-OD2 2.93Å
405	V	96.9	Very high	85.9	Confident	6 Å²	6	59.5 Å²	59.5	4%	0.036	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.3	-176.2	-175.1	0	0	0	0	110.1	L389 Y390 I392 V427 T429	L389-V405 WeakPolarHBondContact CA-O 3.28Å; Y390-V405 HydrophobicContact CD2-CB 3.85Å; Y390-V405 HydrophobicContact CD2-CG1 4.31Å; Y390-V405 HydrophobicContact CD2-CG2 4.21Å; Y390-V405 HydrophobicContact CE1-CG1 4.25Å; Y390-V405 HydrophobicContact CE2-CB 3.68Å; Y390-V405 HydrophobicContact CE2-CG1 3.66Å; Y390-V405 HydrophobicContact CE2-CG2 4.01Å; Y390-V405 HydrophobicContact CG-CB 4.38Å; Y390-V405 PolarHBondContact N-O 3.47Å; Y390-V405 VanDerWaalsContact N-O 3.14Å; Y390-V405 WeakPolarHBondContact O-CA 3.38Å; Y390-V405 WeakPolarHBondContact O-CB 3.42Å; Y390-V405 PolarHBondContact O-N 3.31Å; I392-V405 HydrophobicContact CB-CG2 4.42Å; I392-V405 HydrophobicContact CD1-CG2 3.84Å; I392-V405 HydrophobicContact CG1-CG2 3.83Å; I392-V405 HydrophobicContact CG2-CG2 3.81Å; V405-V427 HydrophobicContact CG1-CG1 3.45Å; V405-V427 VanDerWaalsContact CG1-CG1 3.45Å; V405-T429 HydrophobicContact CG2-CG2 4.2Å
406	R	97.4	Very high	86.4	Confident	95 Å²	95	57.2 Å²	57.2	36%	0.358	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	110.8	170.5	-178.2	176.9	-172.2	-71.1	-5	109.1	V387 L389 T408 L428	V387-R406 HydrophobicContact CG1-CG 4.1Å; L389-R406 HydrophobicContact CD2-CB 4Å; L389-R406 HydrophobicContact CD2-CG 3.76Å; R406-T408 PolarHBondContact NH1-OG1 2.9Å; R406-L428 PolarHBondContact N-O 3.31Å; R406-L428 PolarHBondContact O-N 2.92Å
407	E	97.6	Very high	87.2	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.028	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.3	175	-179.4	171.9	166.1	0	0	109.7	V387 I388 Y390 Q409 A425 E426 V427	V387-E407 CarbonylContact C-O 3.59Å; V387-E407 WeakPolarHBondContact CA-O 3.36Å; I388-E407 HydrophobicContact CB-CB 4.37Å; I388-E407 PolarHBondContact N-O 3.35Å; I388-E407 PolarHBondContact O-N 2.92Å; Y390-E407 HydrophobicContact CE1-CB 3.9Å; Y390-E407 VanDerWaalsContact CE1-OE2 3.31Å; Y390-E407 WeakPolarHBondContact CE1-OE2 3.39Å; Y390-E407 PolarHBondContact OH-OE2 2.94Å; E407-Q409 HydrophobicContact CG-CG 4Å; E407-Q409 PolarHBondContact OE1-NE2 3.5Å; E407-A425 HydrophobicContact CG-CB 4.23Å; E407-A425 WeakPolarHBondContact OE1-CB 3.38Å; E407-E426 CarbonylContact C-O 3.46Å; E407-E426 WeakPolarHBondContact CA-O 3.34Å; E407-V427 HydrophobicContact CG-CG2 4.11Å
408	T	97.9	Very high	88.4	Confident	26 Å²	26	59.5 Å²	59.5	16%	0.16	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	111.3	174.4	-49.9	0	0	0	0	108.1	R386 V387 R406 A425 E426	R386-T408 WeakPolarHBondContact O-CA 3.34Å; V387-T408 HydrophobicContact CG2-CG2 4.28Å; R406-T408 PolarHBondContact NH1-OG1 2.9Å; T408-A425 CarbonylContact O-C 3.49Å; T408-A425 WeakPolarHBondContact O-CA 3.4Å; T408-E426 PolarHBondContact N-O 3.3Å; T408-E426 PolarHBondContact O-N 3Å
409	Q	97.9	Very high	89.9	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.019	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133.6	179.9	-62.1	-171.9	-20.1	0	0	110	W376 S385 R386 I388 E407 I423 D424 A425	W376-Q409 HydrophobicContact CH2-CB 3.87Å; W376-Q409 HydrophobicContact CZ3-CB 4.23Å; W376-Q409 WeakPolarHBondContact CZ3-O 3.44Å; S385-Q409 CarbonylContact C-O 3.56Å; S385-Q409 WeakPolarHBondContact CA-O 3.4Å; S385-Q409 WeakPolarHBondContact CB-O 3.24Å; R386-Q409 HydrophobicContact CG-CB 4.05Å; R386-Q409 PolarHBondContact N-O 2.94Å; R386-Q409 PolarHBondContact O-N 2.82Å; I388-Q409 HydrophobicContact CD1-CG 4.32Å; E407-Q409 HydrophobicContact CG-CG 4Å; E407-Q409 PolarHBondContact OE1-NE2 3.5Å; Q409-I423 HydrophobicContact CB-CG2 4.24Å; Q409-D424 CarbonylContact C-O 3.58Å; Q409-D424 WeakPolarHBondContact CA-O 3.12Å; Q409-A425 HydrophobicContact CG-CB 3.98Å
410	T	97.1	Very high	91.1	Very high	30 Å²	30	57.1 Å²	57.1	18%	0.184	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	112.2	178.4	-61.2	0	0	0	0	109.7	N383 Q384 I423 D424	N383-T410 HydrophobicContact CB-CG2 4.09Å; Q384-T410 CarbonylContact O-C 3.34Å; Q384-T410 WeakPolarHBondContact O-CA 3.24Å; T410-I423 WeakPolarHBondContact O-CA 3.33Å; T410-D424 PolarHBondContact N-O 3.44Å; T410-D424 PolarHBondContact O-N 3.33Å
411	M	95.8	Very high	92	Very high	13 Å²	13	55 Å²	55	6%	0.064	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	124.4	170.8	-178.8	-165.7	-65.4	0	0	109.6	Y349 W376 N383 Q384 S415 Y421 I423	Y349-M411 HydrophobicContact CD2-CE 4.38Å; Y349-M411 HydrophobicContact CE2-CE 3.4Å; Y349-M411 VanDerWaalsContact CE2-CE 3.4Å; Y349-M411 WeakPolarHBondContact OH-CE 3.45Å; W376-M411 HydrophobicContact CH2-CB 4.17Å; W376-M411 HydrophobicContact CZ2-CE 4.37Å; W376-M411 HydrophobicContact CZ3-CB 4.06Å; N383-M411 WeakPolarHBondContact CA-O 3.43Å; N383-M411 WeakPolarHBondContact CB-O 3.34Å; Q384-M411 HydrophobicContact CB-CB 4.37Å; Q384-M411 PolarHBondContact N-O 2.98Å; Q384-M411 PolarHBondContact O-N 2.96Å; M411-S415 WeakPolarHBondContact CG-OG 3.32Å; M411-Y421 HydrophobicContact CE-CD1 4.14Å; M411-Y421 HydrophobicContact SD-CD1 4.25Å; M411-I423 HydrophobicContact CB-CG1 4Å; M411-I423 HydrophobicContact CE-CD1 4.2Å; M411-I423 HydrophobicContact CG-CG1 4.06Å
412	Y	93.9	Very high	92.6	Very high	51 Å²	51	46.5 Å²	46.5	20%	0.2	24%	0.236	C	C	.	.			trans	-72.3	142.5	178.8	-73.4	-76.7	0	0	0	112.3	Y328 A414 S415 V422 D424	Y328-Y412 HydrophobicContact CD2-CD2 4.46Å; Y328-Y412 HydrophobicContact CD2-CG 4.43Å; Y328-Y412 HydrophobicContact CE2-CD1 4.15Å; Y328-Y412 HydrophobicContact CE2-CD2 4.26Å; Y328-Y412 AromaticContact CE2-CG 3.8Å; Y328-Y412 HydrophobicContact CE2-CG 3.8Å; Y328-Y412 AromaticContact CZ-CD1 3.94Å; Y412-A414 PolarHBondContact O-N 2.95Å; Y412-S415 VanDerWaalsContact O-CB 3.27Å; Y412-S415 WeakPolarHBondContact O-CB 3.49Å; Y412-S415 PolarHBondContact O-N 3.28Å; Y412-S415 PolarHBondContact O-OG 2.85Å; Y412-V422 HydrophobicContact CD2-CB 4.2Å; Y412-V422 HydrophobicContact CD2-CG1 3.88Å; Y412-V422 HydrophobicContact CE2-CG1 4.39Å; Y412-V422 PolarHBondContact N-O 3.09Å; Y412-D424 HydrophobicContact CE2-CB 4.27Å; Y412-D424 PolarHBondContact OH-OD2 2.9Å
413	K	89	Confident	93	Very high	143 Å²	143	43 Å²	43	62%	0.622	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-10.6	177.9	72	-177.6	179.8	-176.2	0	116.3	G382 N383 S415	G382-K413 WeakPolarHBondContact O-CB 3.37Å; N383-K413 PolarHBondContact OD1-N 2.86Å; K413-S415 VanDerWaalsContact C-N 3.34Å
414	A	85	Confident	93.2	Very high	30 Å²	30	43.8 Å²	43.8	25%	0.248	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	1.6	174	0	0	0	0	0	112.7	F327 Y328 Y412	F327-A414 HydrophobicContact CD2-CB 4.43Å; Y328-A414 HydrophobicContact CE2-CB 4.19Å; Y412-A414 PolarHBondContact O-N 2.95Å
415	S	87.4	Confident	93.4	Very high	21 Å²	21	40.8 Å²	40.8	15%	0.147	20%	0.201	C	C	.	.			trans	-68	127.6	167.8	-54	0	0	0	0	109.1	M411 Y412 K413 C420 V422	M411-S415 WeakPolarHBondContact CG-OG 3.32Å; Y412-S415 VanDerWaalsContact O-CB 3.27Å; Y412-S415 WeakPolarHBondContact O-CB 3.49Å; Y412-S415 PolarHBondContact O-N 3.28Å; Y412-S415 PolarHBondContact O-OG 2.85Å; K413-S415 VanDerWaalsContact C-N 3.34Å; S415-C420 CarbonylContact C-O 3.6Å; S415-C420 WeakPolarHBondContact CA-O 3.42Å; S415-V422 PolarHBondContact OG-N 3.26Å; S415-V422 VanDerWaalsContact OG-N 3.1Å
416	Q	85	Confident	93.4	Very high	96 Å²	96	43 Å²	43	45%	0.449	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-120.4	127.8	179.7	-61	-163.3	116.5	0	0	109.1	E419 C420	Q416-E419 HydrophobicContact CB-CB 4.13Å; Q416-E419 PolarHBondContact NE2-OE2 3.44Å; Q416-E419 PolarHBondContact O-N 3.44Å; Q416-E419 VanDerWaalsContact O-N 3.1Å; Q416-C420 PolarHBondContact N-O 3.3Å; Q416-C420 PolarHBondContact O-N 3.38Å
417	E	86.9	Confident	93.4	Very high	164 Å²	164	39.1 Å²	39.1	77%	0.766	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	141.2	178.4	-61.2	178.7	179.2	0	0	110.4	E419	E417-E419 PolarHBondContact O-N 3.09Å; E417-E419 VanDerWaalsContact O-N 3.08Å
418	S	88.2	Confident	93.3	Very high	53 Å²	53	40.1 Å²	40.1	37%	0.371	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	-0.2	-171.5	-70	0	0	0	0	117.4	V345 D346 R448	V345-S418 WeakPolarHBondContact CG1-O 3.4Å; D346-S418 WeakPolarHBondContact OD1-CA 3.49Å; D346-S418 PolarHBondContact OD1-N 3Å; D346-S418 VanDerWaalsContact OD2-CA 3.3Å; D346-S418 WeakPolarHBondContact OD2-CA 3.43Å; D346-S418 WeakPolarHBondContact OD2-CB 3.29Å; D346-S418 PolarHBondContact OD2-OG 3.37Å; S418-R448 WeakPolarHBondContact O-CD 3.48Å; S418-R448 PolarHBondContact O-NH1 3.29Å
419	E	89.1	Confident	93.1	Very high	80 Å²	80	40.6 Å²	40.6	37%	0.374	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-62.1	178.3	-68.3	-175.1	175.1	0	0	113.8	V324 Q416 E417 R448	V324-E419 HydrophobicContact CG1-CB 4.45Å; Q416-E419 HydrophobicContact CB-CB 4.13Å; Q416-E419 PolarHBondContact NE2-OE2 3.44Å; Q416-E419 PolarHBondContact O-N 3.44Å; Q416-E419 VanDerWaalsContact O-N 3.1Å; E417-E419 PolarHBondContact O-N 3.09Å; E417-E419 VanDerWaalsContact O-N 3.08Å; E419-R448 VanDerWaalsContact O-CB 3.24Å; E419-R448 WeakPolarHBondContact O-CB 3.36Å; E419-R448 PolarHBondContact O-N 2.88Å
420	C	93.1	Very high	92.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	145.9	-177.7	66.3	0	0	0	0	113.9	V324 S415 Q416 L446 T447	V324-C420 HydrophobicContact CG1-CB 4.25Å; S415-C420 CarbonylContact C-O 3.6Å; S415-C420 WeakPolarHBondContact CA-O 3.42Å; Q416-C420 PolarHBondContact N-O 3.3Å; Q416-C420 PolarHBondContact O-N 3.38Å; C420-L446 CarbonylContact C-O 3.52Å; C420-L446 WeakPolarHBondContact CA-O 3.06Å; C420-L446 WeakPolarHBondContact CB-O 3.44Å; C420-T447 HydrophobicContact CB-CG2 4.06Å
421	Y	95.1	Very high	92.1	Very high	17 Å²	17	46.3 Å²	46.3	7%	0.067	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.7	170	-60.7	-89.6	0	0	0	110.3	V345 D346 Y349 M411 L446	V345-Y421 HydrophobicContact CG2-CD2 4.22Å; D346-Y421 PolarHBondContact OD1-OH 3.25Å; Y349-Y421 HydrophobicContact CD1-CE1 4.4Å; Y349-Y421 AromaticContact CD2-CD1 3.95Å; Y349-Y421 HydrophobicContact CD2-CD1 3.95Å; Y349-Y421 HydrophobicContact CD2-CD2 4.31Å; Y349-Y421 HydrophobicContact CD2-CE1 4.23Å; Y349-Y421 AromaticContact CD2-CG 3.99Å; Y349-Y421 HydrophobicContact CD2-CG 3.99Å; Y349-Y421 HydrophobicContact CE2-CD1 4.33Å; Y349-Y421 HydrophobicContact CG-CD1 4.28Å; Y349-Y421 HydrophobicContact CG-CD2 4.11Å; Y349-Y421 HydrophobicContact CG-CE1 4.18Å; Y349-Y421 HydrophobicContact CG-CE2 4.01Å; Y349-Y421 HydrophobicContact CG-CG 4.24Å; M411-Y421 HydrophobicContact CE-CD1 4.14Å; M411-Y421 HydrophobicContact SD-CD1 4.25Å; Y421-L446 PolarHBondContact N-O 2.81Å; Y421-L446 PolarHBondContact O-N 3.44Å
422	V	95.6	Very high	91.6	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	117.1	173.1	-171.2	0	0	0	0	108.7	Y328 Y412 S415 R443 Y444	Y328-V422 HydrophobicContact CD2-CB 4.34Å; Y328-V422 HydrophobicContact CD2-CG1 4.15Å; Y328-V422 HydrophobicContact CD2-CG2 4.34Å; Y412-V422 HydrophobicContact CD2-CB 4.2Å; Y412-V422 HydrophobicContact CD2-CG1 3.88Å; Y412-V422 HydrophobicContact CE2-CG1 4.39Å; Y412-V422 PolarHBondContact N-O 3.09Å; S415-V422 PolarHBondContact OG-N 3.26Å; S415-V422 VanDerWaalsContact OG-N 3.1Å; V422-R443 HydrophobicContact CG1-CG 4.36Å; V422-Y444 WeakPolarHBondContact CA-O 3.42Å
423	I	96.8	Very high	90.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	118.1	-172.3	-56.2	174.5	0	0	0	109.4	Y349 F353 W376 Q409 T410 M411 Y444	Y349-I423 HydrophobicContact CD2-CD1 4Å; Y349-I423 HydrophobicContact CE2-CD1 3.84Å; F353-I423 HydrophobicContact CB-CD1 4.35Å; F353-I423 HydrophobicContact CD1-CD1 3.61Å; F353-I423 HydrophobicContact CD1-CG2 4.24Å; F353-I423 HydrophobicContact CD2-CD1 3.7Å; F353-I423 HydrophobicContact CE1-CB 4.16Å; F353-I423 HydrophobicContact CE1-CD1 3.79Å; F353-I423 HydrophobicContact CE1-CG2 3.83Å; F353-I423 HydrophobicContact CE2-CD1 3.86Å; F353-I423 HydrophobicContact CG-CD1 3.58Å; F353-I423 HydrophobicContact CZ-CB 4.31Å; F353-I423 HydrophobicContact CZ-CD1 3.92Å; F353-I423 HydrophobicContact CZ-CG2 4.46Å; W376-I423 HydrophobicContact CH2-CG2 4.14Å; Q409-I423 HydrophobicContact CB-CG2 4.24Å; T410-I423 WeakPolarHBondContact O-CA 3.33Å; M411-I423 HydrophobicContact CB-CG1 4Å; M411-I423 HydrophobicContact CE-CD1 4.2Å; M411-I423 HydrophobicContact CG-CG1 4.06Å; I423-Y444 PolarHBondContact N-O 3.19Å; I423-Y444 PolarHBondContact O-N 2.91Å
424	D	97	Very high	90.7	Very high	19 Å²	19	43.5 Å²	43.5	10%	0.102	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.7	171.1	-80.3	14	0	0	0	109.8	Q409 T410 Y412 I441 N442 R443	Q409-D424 CarbonylContact C-O 3.58Å; Q409-D424 WeakPolarHBondContact CA-O 3.12Å; T410-D424 PolarHBondContact N-O 3.44Å; T410-D424 PolarHBondContact O-N 3.33Å; Y412-D424 HydrophobicContact CE2-CB 4.27Å; Y412-D424 PolarHBondContact OH-OD2 2.9Å; D424-I441 HydrophobicContact CB-CG2 4.37Å; D424-N442 CarbonylContact C-O 3.39Å; D424-N442 WeakPolarHBondContact CA-O 3.32Å; D424-R443 WeakPolarHBondContact OD1-CB 3.23Å; D424-R443 WeakPolarHBondContact OD1-CG 3.32Å; D424-R443 IonicContact OD1-CZ 2.69Å; D424-R443 IonicContact OD1-NE 3.27Å; D424-R443 PolarHBondContact OD1-NE 2.85Å; D424-R443 IonicContact OD1-NH2 3.76Å; D424-R443 PolarHBondContact OD1-NH2 2.79Å; D424-R443 IonicContact OD2-CZ 2.59Å; D424-R443 IonicContact OD2-NE 2.72Å; D424-R443 IonicContact OD2-NH2 2.69Å; D424-R443 PolarHBondContact OD2-NH2 3.07Å
425	A	97.6	Very high	90.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	107.3	174.5	0	0	0	0	0	110.5	E407 T408 Q409 V427 I441 N442 Y444	E407-A425 HydrophobicContact CG-CB 4.23Å; E407-A425 WeakPolarHBondContact OE1-CB 3.38Å; T408-A425 CarbonylContact O-C 3.49Å; T408-A425 WeakPolarHBondContact O-CA 3.4Å; Q409-A425 HydrophobicContact CG-CB 3.98Å; A425-V427 PolarHBondContact O-N 3.43Å; A425-I441 WeakPolarHBondContact O-CA 3.43Å; A425-N442 HydrophobicContact CB-CB 4.38Å; A425-N442 PolarHBondContact N-O 3.37Å; A425-N442 PolarHBondContact O-N 3.27Å; A425-Y444 HydrophobicContact CB-CE2 4.07Å
426	E	97.8	Very high	90.9	Very high	53 Å²	53	48.5 Å²	48.5	25%	0.248	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	112.6	169	-165	-166	-150.8	0	0	109.1	E407 T408 L428 Y439 T440 R465	E407-E426 CarbonylContact C-O 3.46Å; E407-E426 WeakPolarHBondContact CA-O 3.34Å; T408-E426 PolarHBondContact N-O 3.3Å; T408-E426 PolarHBondContact O-N 3Å; E426-L428 HydrophobicContact CG-CD1 3.91Å; E426-Y439 HydrophobicContact CG-CD2 3.45Å; E426-Y439 VanDerWaalsContact CG-CD2 3.45Å; E426-Y439 HydrophobicContact CG-CE2 3.71Å; E426-Y439 VanDerWaalsContact OE1-CD2 3.28Å; E426-Y439 WeakPolarHBondContact OE1-CD2 3.3Å; E426-Y439 WeakPolarHBondContact OE1-CE2 3.35Å; E426-T440 WeakPolarHBondContact CA-O 3.19Å; E426-R465 IonicContact OE1-CZ 3.86Å; E426-R465 IonicContact OE1-NH2 2.64Å; E426-R465 PolarHBondContact OE1-NH2 3.07Å; E426-R465 IonicContact OE2-NH2 2.72Å
427	V	97.4	Very high	91.1	Very high	12 Å²	12	46.9 Å²	46.9	7%	0.073	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.8	-179.5	-165.8	0	0	0	0	110.4	V405 E407 A425 T440	V405-V427 HydrophobicContact CG1-CG1 3.45Å; V405-V427 VanDerWaalsContact CG1-CG1 3.45Å; E407-V427 HydrophobicContact CG-CG2 4.11Å; A425-V427 PolarHBondContact O-N 3.43Å; V427-T440 PolarHBondContact N-O 3.46Å; V427-T440 PolarHBondContact O-N 3.49Å; V427-T440 VanDerWaalsContact O-N 3.08Å
428	L	96.1	Very high	91.4	Very high	27 Å²	27	40.8 Å²	40.8	14%	0.141	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	98.8	174.9	-61	82.1	0	0	0	109.9	R406 E426 H430	R406-L428 PolarHBondContact N-O 3.31Å; R406-L428 PolarHBondContact O-N 2.92Å; E426-L428 HydrophobicContact CG-CD1 3.91Å; L428-H430 PolarHBondContact O-CE1 2.93Å; L428-H430 PolarHBondContact O-ND1 3.42Å
429	T	93.3	Very high	91.7	Very high	36 Å²	36	40.1 Å²	40.1	22%	0.221	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	123	167.2	-51.1	0	0	0	0	109.2	I392 A403 V405 V432 H435	I392-T429 HydrophobicContact CD1-CG2 4.1Å; A403-T429 HydrophobicContact CB-CG2 3.76Å; V405-T429 HydrophobicContact CG2-CG2 4.2Å; T429-V432 HydrophobicContact CG2-CB 4.48Å; T429-V432 HydrophobicContact CG2-CG1 3.71Å; T429-V432 HydrophobicContact CG2-CG2 3.92Å; T429-H435 WeakPolarHBondContact O-CB 3.37Å
430	H	89.6	Confident	92	Very high	68 Å²	68	36.9 Å²	36.9	32%	0.315	18%	0.181	S	C	.	.			trans	-93.1	179.2	175.4	-62.6	23.6	0	0	0	109.4	A403 T404 L428 V432	A403-H430 WeakPolarHBondContact CB-O 3.05Å; T404-H430 PolarHBondContact O-N 3.31Å; T404-H430 WeakPolarHBondContact OG1-CB 3.45Å; L428-H430 PolarHBondContact O-CE1 2.93Å; L428-H430 PolarHBondContact O-ND1 3.42Å; H430-V432 PolarHBondContact O-N 2.93Å
431	D	83.6	Confident	92.2	Very high	87 Å²	87	37.8 Å²	37.8	47%	0.465	19%	0.185	S	C	.	.	S	Bend	trans	63.6	-16.8	173.4	-43.6	-53.9	0	0	0	116.9	P400 A403 T404	P400-D431 WeakPolarHBondContact CG-O 3.33Å; A403-D431 HydrophobicContact CB-CB 4.44Å; T404-D431 PolarHBondContact N-OD2 2.96Å; T404-D431 PolarHBondContact OG1-OD2 2.93Å
432	V	85.3	Confident	92.3	Very high	19 Å²	19	37.3 Å²	37.3	12%	0.115	18%	0.184	C	C	.	.	S	Bend	trans	-79	153.2	178.8	-66.3	0	0	0	0	113.1	L394 A403 T429 H430 Y434 H435	L394-V432 HydrophobicContact CD1-CG1 3.49Å; L394-V432 VanDerWaalsContact CD1-CG1 3.49Å; A403-V432 HydrophobicContact CB-CG1 3.88Å; T429-V432 HydrophobicContact CG2-CB 4.48Å; T429-V432 HydrophobicContact CG2-CG1 3.71Å; T429-V432 HydrophobicContact CG2-CG2 3.92Å; H430-V432 PolarHBondContact O-N 2.93Å; V432-Y434 PolarHBondContact O-N 3.01Å; V432-H435 HydrophobicContact CG2-CB 3.74Å; V432-H435 WeakPolarHBondContact O-CB 3.26Å; V432-H435 PolarHBondContact O-CD2 3.25Å; V432-H435 PolarHBondContact O-N 2.9Å; V432-H435 VanDerWaalsContact O-N 3.13Å
433	P	79.6	Confident	92.3	Very high	51 Å²	51	38.5 Å²	38.5	33%	0.331	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	129.3	171	-26	34.7	0	0	0	112	L398 A399 H435	L398-P433 WeakPolarHBondContact O-CG 3.3Å; A399-P433 HydrophobicContact CB-CG 4.5Å; P433-H435 VanDerWaalsContact C-N 3.31Å; P433-H435 PolarHBondContact O-N 3.41Å
434	Y	85.2	Confident	92.4	Very high	77 Å²	77	39 Å²	39	30%	0.302	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	22.3	-178.9	-43.8	-79.3	0	0	0	115.8	V432 D436 Y437 F438 V472 F475 I476	V432-Y434 PolarHBondContact O-N 3.01Å; Y434-D436 PolarHBondContact O-N 3.42Å; Y434-Y437 HydrophobicContact CD1-CD2 4.13Å; Y434-Y437 HydrophobicContact CD1-CE2 4.08Å; Y434-Y437 WeakPolarHBondContact O-CB 3.36Å; Y434-Y437 PolarHBondContact O-N 3.12Å; Y434-F438 VanDerWaalsContact O-CD1 3.27Å; Y434-F438 WeakPolarHBondContact O-CD1 3.4Å; Y434-F438 WeakPolarHBondContact O-CE1 2.87Å; Y434-V472 HydrophobicContact CD1-CG1 3.76Å; Y434-V472 HydrophobicContact CD2-CG1 4.09Å; Y434-V472 HydrophobicContact CE1-CG1 3.68Å; Y434-V472 HydrophobicContact CE1-CG2 4.27Å; Y434-V472 HydrophobicContact CE2-CG1 4.02Å; Y434-V472 HydrophobicContact CG-CG1 3.97Å; Y434-F475 HydrophobicContact CD2-CD1 4.4Å; Y434-F475 HydrophobicContact CE2-CD1 4.21Å; Y434-F475 HydrophobicContact CE2-CE1 4.42Å; Y434-I476 HydrophobicContact CD2-CG1 4.48Å; Y434-I476 HydrophobicContact CG-CD1 4.41Å
435	H	86.1	Confident	92.3	Very high	93 Å²	93	38.1 Å²	38.1	43%	0.431	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-18.5	176.5	74.2	96.7	0	0	0	115	T429 V432 P433	T429-H435 WeakPolarHBondContact O-CB 3.37Å; V432-H435 HydrophobicContact CG2-CB 3.74Å; V432-H435 WeakPolarHBondContact O-CB 3.26Å; V432-H435 PolarHBondContact O-CD2 3.25Å; V432-H435 PolarHBondContact O-N 2.9Å; V432-H435 VanDerWaalsContact O-N 3.13Å; P433-H435 VanDerWaalsContact C-N 3.31Å; P433-H435 PolarHBondContact O-N 3.41Å
436	D	89.6	Confident	92.2	Very high	63 Å²	63	38.1 Å²	38.1	34%	0.337	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-2.8	177.4	69.9	-52.2	0	0	0	114.2	Y434 K466	Y434-D436 PolarHBondContact O-N 3.42Å; D436-K466 WeakPolarHBondContact O-CD 3.44Å; D436-K466 VanDerWaalsContact O-CE 3.26Å; D436-K466 WeakPolarHBondContact O-CE 3.39Å; D436-K466 IonicContact OD2-NZ 2.7Å; D436-K466 PolarHBondContact OD2-NZ 3.19Å
437	Y	89.5	Confident	92.1	Very high	63 Å²	63	35.6 Å²	35.6	25%	0.247	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-33.2	178.6	-77.6	-110.3	0	0	0	113.3	Y434 Y464 R465 K466 P468	Y434-Y437 HydrophobicContact CD1-CD2 4.13Å; Y434-Y437 HydrophobicContact CD1-CE2 4.08Å; Y434-Y437 WeakPolarHBondContact O-CB 3.36Å; Y434-Y437 PolarHBondContact O-N 3.12Å; Y437-Y464 CarbonylContact O-C 3.54Å; Y437-Y464 WeakPolarHBondContact O-CA 3.21Å; Y437-R465 PolarHBondContact O-N 3.06Å; Y437-K466 HydrophobicContact CD1-CB 3.74Å; Y437-K466 HydrophobicContact CD2-CD 4.5Å; Y437-K466 HydrophobicContact CE1-CB 4.09Å; Y437-K466 HydrophobicContact CE2-CD 4.49Å; Y437-K466 HydrophobicContact CG-CB 4.14Å; Y437-K466 PolarHBondContact O-N 2.9Å; Y437-P468 HydrophobicContact CD1-CB 4.3Å
438	F	93.7	Very high	92	Very high	35 Å²	35	38.7 Å²	38.7	15%	0.154	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	164.5	-167.1	74.2	-82.5	0	0	0	113.5	Y434 L462 R463 Y464 I476 F480	Y434-F438 VanDerWaalsContact O-CD1 3.27Å; Y434-F438 WeakPolarHBondContact O-CD1 3.4Å; Y434-F438 WeakPolarHBondContact O-CE1 2.87Å; F438-L462 HydrophobicContact CB-CD1 3.91Å; F438-L462 HydrophobicContact CD2-CD1 3.77Å; F438-L462 HydrophobicContact CG-CD1 4.19Å; F438-R463 CarbonylContact C-O 3.54Å; F438-R463 VanDerWaalsContact CA-O 3.22Å; F438-R463 WeakPolarHBondContact CA-O 3.27Å; F438-Y464 HydrophobicContact CB-CD1 3.68Å; F438-Y464 HydrophobicContact CB-CE1 3.8Å; F438-I476 HydrophobicContact CB-CG2 4.37Å; F438-I476 HydrophobicContact CD1-CD1 3.82Å; F438-I476 HydrophobicContact CD1-CG1 4.09Å; F438-I476 HydrophobicContact CD1-CG2 3.71Å; F438-I476 HydrophobicContact CD2-CG2 3.92Å; F438-I476 HydrophobicContact CE1-CD1 4.25Å; F438-I476 HydrophobicContact CE1-CG1 4.07Å; F438-I476 HydrophobicContact CE1-CG2 3.89Å; F438-I476 HydrophobicContact CE2-CG2 4.1Å; F438-I476 HydrophobicContact CG-CG2 3.73Å; F438-I476 HydrophobicContact CZ-CG2 4.08Å; F438-F480 HydrophobicContact CD2-CD2 4.23Å; F438-F480 HydrophobicContact CD2-CE2 4.48Å; F438-F480 HydrophobicContact CE2-CD2 4.05Å
439	Y	95.1	Very high	91.9	Very high	40 Å²	40	39.5 Å²	39.5	16%	0.157	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	161.2	171.8	65.2	-77	0	0	0	110.3	E426 I441 R463 R465	E426-Y439 HydrophobicContact CG-CD2 3.45Å; E426-Y439 VanDerWaalsContact CG-CD2 3.45Å; E426-Y439 HydrophobicContact CG-CE2 3.71Å; E426-Y439 VanDerWaalsContact OE1-CD2 3.28Å; E426-Y439 WeakPolarHBondContact OE1-CD2 3.3Å; E426-Y439 WeakPolarHBondContact OE1-CE2 3.35Å; Y439-I441 HydrophobicContact CD2-CG1 4.13Å; Y439-I441 HydrophobicContact CE2-CD1 3.92Å; Y439-I441 HydrophobicContact CE2-CG1 3.7Å; Y439-R463 HydrophobicContact CD1-CB 3.77Å; Y439-R463 WeakPolarHBondContact CD1-O 3.43Å; Y439-R463 HydrophobicContact CD2-CB 4.14Å; Y439-R463 HydrophobicContact CE1-CB 3.31Å; Y439-R463 HydrophobicContact CE1-CG 4.36Å; Y439-R463 HydrophobicContact CE2-CB 3.74Å; Y439-R463 HydrophobicContact CE2-CG 4.13Å; Y439-R463 HydrophobicContact CG-CB 4.19Å; Y439-R463 PolarHBondContact N-O 3.36Å; Y439-R463 PolarHBondContact O-N 2.94Å; Y439-R465 HydrophobicContact CD1-CG 3.58Å; Y439-R465 HydrophobicContact CE1-CG 3.52Å
440	T	95.8	Very high	91.8	Very high	12 Å²	12	39.8 Å²	39.8	7%	0.074	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	141.6	177.1	-39.7	0	0	0	0	110	E426 V427 N442 T460 F480 L484	E426-T440 WeakPolarHBondContact CA-O 3.19Å; V427-T440 PolarHBondContact N-O 3.46Å; V427-T440 PolarHBondContact O-N 3.49Å; V427-T440 VanDerWaalsContact O-N 3.08Å; T440-N442 WeakPolarHBondContact CG2-OD1 3.15Å; T440-T460 HydrophobicContact CG2-CG2 3.54Å; T440-F480 HydrophobicContact CG2-CE2 4.04Å; T440-F480 HydrophobicContact CG2-CZ 3.88Å; T440-F480 WeakPolarHBondContact OG1-CE2 3.08Å; T440-L484 HydrophobicContact CG2-CD1 4.39Å; T440-L484 HydrophobicContact CG2-CD2 4.23Å
441	I	96.8	Very high	91.8	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.097	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.9	153.5	-53.2	-178.3	0	0	0	107.8	L331 D424 A425 Y439 T460 E461 R463	L331-I441 HydrophobicContact CD1-CB 4.16Å; L331-I441 HydrophobicContact CD1-CG2 3.81Å; L331-I441 WeakPolarHBondContact CD1-O 3.44Å; D424-I441 HydrophobicContact CB-CG2 4.37Å; A425-I441 WeakPolarHBondContact O-CA 3.43Å; Y439-I441 HydrophobicContact CD2-CG1 4.13Å; Y439-I441 HydrophobicContact CE2-CD1 3.92Å; Y439-I441 HydrophobicContact CE2-CG1 3.7Å; I441-T460 CarbonylContact O-C 3.58Å; I441-T460 WeakPolarHBondContact O-CA 3.29Å; I441-E461 PolarHBondContact N-O 3.27Å; I441-E461 PolarHBondContact O-N 3.17Å; I441-R463 HydrophobicContact CD1-CG 3.8Å; I441-R463 HydrophobicContact CG1-CG 4.08Å
442	N	97.2	Very high	92.1	Very high	7 Å²	7	45.3 Å²	45.3	4%	0.037	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.1	169.7	-59.2	-51.7	0	0	0	108.8	D424 A425 T440 Y444 S459 T460 F488	D424-N442 CarbonylContact C-O 3.39Å; D424-N442 WeakPolarHBondContact CA-O 3.32Å; A425-N442 HydrophobicContact CB-CB 4.38Å; A425-N442 PolarHBondContact N-O 3.37Å; A425-N442 PolarHBondContact O-N 3.27Å; T440-N442 WeakPolarHBondContact CG2-OD1 3.15Å; N442-Y444 HydrophobicContact CB-CD2 4.37Å; N442-Y444 HydrophobicContact CB-CE2 3.74Å; N442-S459 CarbonylContact C-O 3.56Å; N442-S459 WeakPolarHBondContact CA-O 3.26Å; N442-T460 WeakPolarHBondContact OD1-CB 3.45Å; N442-T460 WeakPolarHBondContact OD1-CG2 3.35Å; N442-T460 PolarHBondContact OD1-OG1 3.05Å; N442-F488 HydrophobicContact CB-CZ 4.43Å
443	R	96.4	Very high	92.6	Very high	28 Å²	28	48.9 Å²	48.9	11%	0.106	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	120.3	170.1	172.8	162.3	-66.3	169.5	4.5	109.3	E329 L331 V422 D424 V458 S459	E329-R443 PolarHBondContact O-NH1 2.95Å; L331-R443 HydrophobicContact CD1-CB 3.66Å; L331-R443 HydrophobicContact CD2-CB 4.47Å; L331-R443 HydrophobicContact CG-CB 3.68Å; V422-R443 HydrophobicContact CG1-CG 4.36Å; D424-R443 WeakPolarHBondContact OD1-CB 3.23Å; D424-R443 WeakPolarHBondContact OD1-CG 3.32Å; D424-R443 IonicContact OD1-CZ 2.69Å; D424-R443 IonicContact OD1-NE 3.27Å; D424-R443 PolarHBondContact OD1-NE 2.85Å; D424-R443 IonicContact OD1-NH2 3.76Å; D424-R443 PolarHBondContact OD1-NH2 2.79Å; D424-R443 IonicContact OD2-CZ 2.59Å; D424-R443 IonicContact OD2-NE 2.72Å; D424-R443 IonicContact OD2-NH2 2.69Å; D424-R443 PolarHBondContact OD2-NH2 3.07Å; R443-V458 WeakPolarHBondContact O-CA 3.49Å; R443-S459 PolarHBondContact N-O 3.47Å; R443-S459 PolarHBondContact O-N 3.02Å
444	Y	97.1	Very high	93.3	Very high	10 Å²	10	46.5 Å²	46.5	4%	0.039	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.9	171.7	-60.8	-96.1	0	0	0	108.8	F353 V422 I423 A425 N442 V458 F488	F353-Y444 HydrophobicContact CE1-CD2 4.26Å; F353-Y444 HydrophobicContact CE1-CG 4.42Å; F353-Y444 HydrophobicContact CZ-CD1 4.02Å; F353-Y444 AromaticContact CZ-CD2 3.93Å; F353-Y444 HydrophobicContact CZ-CD2 3.93Å; F353-Y444 AromaticContact CZ-CG 3.64Å; F353-Y444 HydrophobicContact CZ-CG 3.64Å; V422-Y444 WeakPolarHBondContact CA-O 3.42Å; I423-Y444 PolarHBondContact N-O 3.19Å; I423-Y444 PolarHBondContact O-N 2.91Å; A425-Y444 HydrophobicContact CB-CE2 4.07Å; N442-Y444 HydrophobicContact CB-CD2 4.37Å; N442-Y444 HydrophobicContact CB-CE2 3.74Å; Y444-V458 HydrophobicContact CD1-CB 4.44Å; Y444-V458 HydrophobicContact CD1-CG1 4.03Å; Y444-V458 HydrophobicContact CD1-CG2 3.53Å; Y444-V458 HydrophobicContact CE1-CG1 3.98Å; Y444-V458 HydrophobicContact CE1-CG2 3.93Å; Y444-V458 HydrophobicContact CG-CG2 4.42Å; Y444-F488 HydrophobicContact CE1-CE1 4.06Å
445	T	95.8	Very high	93.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	102.1	-178.9	-57.7	0	0	0	0	108.1	A326 D330 T447 R457	A326-T445 HydrophobicContact CB-CG2 3.39Å; D330-T445 PolarHBondContact OD1-OG1 2.96Å; T445-T447 HydrophobicContact CG2-CG2 4.17Å; T445-R457 PolarHBondContact N-O 2.83Å; T445-R457 PolarHBondContact O-N 3.06Å
446	L	96.3	Very high	94.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.8	179	-75.3	64	0	0	0	108	V345 L348 F353 C420 Y421 R455 L456	V345-L446 HydrophobicContact CG2-CB 3.88Å; L348-L446 HydrophobicContact CB-CD2 4.26Å; L348-L446 HydrophobicContact CD2-CB 4.45Å; L348-L446 HydrophobicContact CD2-CD2 4.07Å; L348-L446 HydrophobicContact CD2-CG 3.83Å; L348-L446 HydrophobicContact CG-CD2 3.79Å; L348-L446 HydrophobicContact CG-CG 4.09Å; F353-L446 HydrophobicContact CD2-CD2 4.49Å; F353-L446 HydrophobicContact CE2-CD1 4Å; F353-L446 HydrophobicContact CE2-CD2 4.23Å; C420-L446 CarbonylContact C-O 3.52Å; C420-L446 WeakPolarHBondContact CA-O 3.06Å; C420-L446 WeakPolarHBondContact CB-O 3.44Å; Y421-L446 PolarHBondContact N-O 2.81Å; Y421-L446 PolarHBondContact O-N 3.44Å; L446-R455 WeakPolarHBondContact CA-O 3.3Å; L446-L456 HydrophobicContact CD1-CD1 3.58Å; L446-L456 HydrophobicContact CG-CD1 4.06Å
447	T	95.3	Very high	94.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	140.6	-175.1	43.7	0	0	0	0	111.6	V324 A326 C420 T445 S454 R455	V324-T447 WeakPolarHBondContact O-CB 3.42Å; V324-T447 WeakPolarHBondContact O-CG2 3.44Å; A326-T447 HydrophobicContact CB-CG2 3.98Å; C420-T447 HydrophobicContact CB-CG2 4.06Å; T445-T447 HydrophobicContact CG2-CG2 4.17Å; T447-S454 CarbonylContact O-C 3.48Å; T447-S454 WeakPolarHBondContact O-CA 3.36Å; T447-S454 VanDerWaalsContact O-CB 3.29Å; T447-S454 WeakPolarHBondContact O-CB 3.48Å; T447-R455 PolarHBondContact N-O 2.69Å; T447-R455 PolarHBondContact O-N 3.18Å
448	R	94.8	Very high	95	Very high	78 Å²	78	35.9 Å²	35.9	29%	0.294	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	128.8	175.9	-177.6	-163.3	-172.1	96.7	-8	110.5	V324 V345 S418 E419	V324-R448 HydrophobicContact CB-CB 4.48Å; V324-R448 HydrophobicContact CG2-CB 3.92Å; V324-R448 PolarHBondContact N-O 3.33Å; V324-R448 VanDerWaalsContact N-O 3.12Å; V345-R448 HydrophobicContact CG1-CB 4.44Å; S418-R448 WeakPolarHBondContact O-CD 3.48Å; S418-R448 PolarHBondContact O-NH1 3.29Å; E419-R448 VanDerWaalsContact O-CB 3.24Å; E419-R448 WeakPolarHBondContact O-CB 3.36Å; E419-R448 PolarHBondContact O-N 2.88Å
449	V	93.8	Very high	95.1	Very high	43 Å²	43	34.3 Å²	34.3	26%	0.261	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-32.8	171.5	179.8	0	0	0	0	110.4	E323 V340 K453 R455	E323-V449 HydrophobicContact CG-CG2 4.09Å; V340-V449 HydrophobicContact CG1-CB 4.31Å; V340-V449 HydrophobicContact CG1-CG1 4.29Å; V340-V449 HydrophobicContact CG1-CG2 4.12Å; V340-V449 HydrophobicContact CG2-CG2 4.44Å; V449-K453 HydrophobicContact CB-CB 4.17Å; V449-K453 PolarHBondContact N-O 3.48Å; V449-R455 HydrophobicContact CG2-CB 3.93Å
450	A	91.8	Very high	95.2	Very high	42 Å²	42	32.4 Å²	32.4	35%	0.347	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	177.5	169	0	0	0	0	0	109.5	N452 K453	A450-N452 PolarHBondContact O-N 3.27Å; A450-N452 VanDerWaalsContact O-N 3.1Å; A450-K453 HydrophobicContact CB-CB 3.95Å; A450-K453 HydrophobicContact CB-CD 4.49Å; A450-K453 HydrophobicContact CB-CG 4.2Å; A450-K453 PolarHBondContact N-O 3.08Å; A450-K453 PolarHBondContact O-N 2.96Å; A450-K453 VanDerWaalsContact O-N 3.08Å
451	R	88.7	Confident	95.1	Very high	201 Å²	201	33.2 Å²	33.2	76%	0.758	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-40.1	178.6	-172	179.3	179.6	166.2	1.4	113.6	S344	S344-R451 WeakPolarHBondContact CB-O 3.37Å
452	N	91.1	Very high	95	Very high	71 Å²	71	33.2 Å²	33.2	38%	0.38	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	26.6	178.1	-60.3	5	0	0	0	112	N342 F343 A450	N342-N452 CarbonylContact C-O 3.59Å; N342-N452 VanDerWaalsContact CA-O 3.29Å; N342-N452 WeakPolarHBondContact CA-O 3.44Å; F343-N452 CarbonylContact C-O 3.58Å; F343-N452 PolarHBondContact N-O 3.11Å; F343-N452 CarbonylContact O-C 3.55Å; A450-N452 PolarHBondContact O-N 3.27Å; A450-N452 VanDerWaalsContact O-N 3.1Å
453	K	94.2	Very high	94.8	Very high	94 Å²	94	37.1 Å²	37.1	41%	0.409	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.9	173.7	-60.4	-171.6	-179.3	-168.9	0	111	V340 F341 N342 F343 V449 A450	V340-K453 HydrophobicContact CG1-CB 4.36Å; F341-K453 WeakPolarHBondContact O-CA 3.42Å; N342-K453 WeakPolarHBondContact OD1-CE 3.43Å; F343-K453 CarbonylContact O-C 3.06Å; F343-K453 WeakPolarHBondContact O-CA 3.43Å; F343-K453 PolarHBondContact O-N 2.92Å; V449-K453 HydrophobicContact CB-CB 4.17Å; V449-K453 PolarHBondContact N-O 3.48Å; A450-K453 HydrophobicContact CB-CB 3.95Å; A450-K453 HydrophobicContact CB-CD 4.49Å; A450-K453 HydrophobicContact CB-CG 4.2Å; A450-K453 PolarHBondContact N-O 3.08Å; A450-K453 PolarHBondContact O-N 2.96Å; A450-K453 VanDerWaalsContact O-N 3.08Å
454	S	95.9	Very high	94.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	143	178.2	46.2	0	0	0	0	111.2	V340 F341 F343 T447	V340-S454 WeakPolarHBondContact CA-O 3.38Å; F341-S454 PolarHBondContact N-O 2.89Å; F341-S454 PolarHBondContact O-N 3.23Å; F343-S454 PolarHBondContact O-N 3.01Å; F343-S454 PolarHBondContact O-OG 3.28Å; T447-S454 CarbonylContact O-C 3.48Å; T447-S454 WeakPolarHBondContact O-CA 3.36Å; T447-S454 VanDerWaalsContact O-CB 3.29Å; T447-S454 WeakPolarHBondContact O-CB 3.48Å
455	R	95.8	Very high	94.2	Very high	52 Å²	52	44.2 Å²	44.2	20%	0.196	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131.4	172.2	-174.5	-171.7	-65.9	-75.1	-4.2	109.2	E323 N338 E339 V340 L446 T447 V449 R457	E323-R455 VanDerWaalsContact OE1-CD 3.32Å; E323-R455 WeakPolarHBondContact OE1-CD 3.36Å; E323-R455 IonicContact OE1-CZ 4Å; E323-R455 IonicContact OE1-NE 3.45Å; E323-R455 PolarHBondContact OE1-NE 3.48Å; E323-R455 IonicContact OE1-NH2 2.68Å; E323-R455 IonicContact OE2-CZ 3.86Å; E323-R455 VanDerWaalsContact OE2-CZ 3.28Å; E323-R455 IonicContact OE2-NE 2.66Å; E323-R455 PolarHBondContact OE2-NE 3.43Å; E323-R455 IonicContact OE2-NH2 2.67Å; E323-R455 PolarHBondContact OE2-NH2 3.39Å; N338-R455 PolarHBondContact O-NH1 3.34Å; N338-R455 WeakPolarHBondContact OD1-CD 3.34Å; N338-R455 PolarHBondContact OD1-NH1 3.43Å; E339-R455 CarbonylContact O-C 3.55Å; E339-R455 WeakPolarHBondContact O-CA 3.5Å; V340-R455 HydrophobicContact CG2-CB 4.07Å; V340-R455 HydrophobicContact CG2-CG 4.17Å; L446-R455 WeakPolarHBondContact CA-O 3.3Å; T447-R455 PolarHBondContact N-O 2.69Å; T447-R455 PolarHBondContact O-N 3.18Å; V449-R455 HydrophobicContact CG2-CB 3.93Å; R455-R457 HydrophobicContact CG-CG 3.94Å
456	L	96.9	Very high	93.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.3	164.5	-179.1	57.6	0	0	0	108.8	V337 N338 E339 F341 L348 L352 L446 V458 L495	V337-L456 HydrophobicContact CG1-CB 4.47Å; V337-L456 HydrophobicContact CG1-CD2 4.21Å; V337-L456 HydrophobicContact CG1-CG 4.19Å; N338-L456 CarbonylContact C-O 3.43Å; N338-L456 VanDerWaalsContact CA-O 3.29Å; N338-L456 WeakPolarHBondContact CA-O 3.32Å; N338-L456 PolarHBondContact N-O 3.26Å; E339-L456 PolarHBondContact N-O 3.1Å; E339-L456 VanDerWaalsContact N-O 3.11Å; E339-L456 PolarHBondContact O-N 3.39Å; F341-L456 HydrophobicContact CD2-CB 4.17Å; F341-L456 HydrophobicContact CE2-CB 3.98Å; F341-L456 HydrophobicContact CE2-CD2 4.18Å; L348-L456 HydrophobicContact CD2-CB 4.05Å; L352-L456 HydrophobicContact CD1-CD1 4.09Å; L352-L456 HydrophobicContact CD1-CD2 4.07Å; L446-L456 HydrophobicContact CD1-CD1 3.58Å; L446-L456 HydrophobicContact CG-CD1 4.06Å; L456-V458 HydrophobicContact CD1-CG2 3.9Å; L456-V458 HydrophobicContact CD2-CG2 4.39Å; L456-V458 HydrophobicContact CG-CG2 3.96Å; L456-L495 HydrophobicContact CD2-CD1 3.58Å
457	R	96	Very high	93.1	Very high	22 Å²	22	56.4 Å²	56.4	8%	0.083	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.6	161.8	-49.8	-158.1	-61.1	-91.9	2.7	109.9	E323 D330 V337 N338 T445 R455	E323-R457 IonicContact OE1-NH1 3.52Å; D330-R457 IonicContact OD1-NE 2.68Å; D330-R457 IonicContact OD2-CZ 3.77Å; D330-R457 VanDerWaalsContact OD2-CZ 3.26Å; D330-R457 IonicContact OD2-NE 3.74Å; D330-R457 PolarHBondContact OD2-NE 2.85Å; D330-R457 IonicContact OD2-NH2 3.26Å; D330-R457 PolarHBondContact OD2-NH2 2.97Å; V337-R457 CarbonylContact O-C 3.36Å; V337-R457 VanDerWaalsContact O-CA 3.32Å; V337-R457 WeakPolarHBondContact O-CA 3.32Å; N338-R457 WeakPolarHBondContact OD1-CD 3.38Å; N338-R457 VanDerWaalsContact OD1-CG 3.32Å; N338-R457 WeakPolarHBondContact OD1-CG 3.22Å; T445-R457 PolarHBondContact N-O 2.83Å; T445-R457 PolarHBondContact O-N 3.06Å; R455-R457 HydrophobicContact CG-CG 3.94Å
458	V	97.1	Very high	92	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	121.8	172.3	-172.1	0	0	0	0	109.5	Q335 Y336 V337 R443 Y444 L456 F488	Q335-V458 WeakPolarHBondContact CA-O 3.4Å; Y336-V458 PolarHBondContact N-O 3.3Å; V337-V458 HydrophobicContact CB-CB 4.13Å; V337-V458 HydrophobicContact CB-CG2 4.04Å; V337-V458 HydrophobicContact CG2-CB 4.27Å; V337-V458 HydrophobicContact CG2-CG2 4.2Å; V337-V458 PolarHBondContact N-O 2.7Å; V337-V458 PolarHBondContact O-N 3.3Å; R443-V458 WeakPolarHBondContact O-CA 3.49Å; Y444-V458 HydrophobicContact CD1-CB 4.44Å; Y444-V458 HydrophobicContact CD1-CG1 4.03Å; Y444-V458 HydrophobicContact CD1-CG2 3.53Å; Y444-V458 HydrophobicContact CE1-CG1 3.98Å; Y444-V458 HydrophobicContact CE1-CG2 3.93Å; Y444-V458 HydrophobicContact CG-CG2 4.42Å; L456-V458 HydrophobicContact CD1-CG2 3.9Å; L456-V458 HydrophobicContact CD2-CG2 4.39Å; L456-V458 HydrophobicContact CG-CG2 3.96Å; V458-F488 HydrophobicContact CG1-CD1 4.15Å; V458-F488 HydrophobicContact CG1-CE1 3.6Å; V458-F488 HydrophobicContact CG1-CE2 4.41Å; V458-F488 HydrophobicContact CG1-CZ 3.74Å
459	S	95.7	Very high	90.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.007	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	141.8	175	51.4	0	0	0	0	110.6	L331 N442 R443	L331-S459 PolarHBondContact N-OG 3.4Å; N442-S459 CarbonylContact C-O 3.56Å; N442-S459 WeakPolarHBondContact CA-O 3.26Å; R443-S459 PolarHBondContact N-O 3.47Å; R443-S459 PolarHBondContact O-N 3.02Å
460	T	96.6	Very high	89.1	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.8	-174.6	-59.3	0	0	0	0	111.7	G333 R334 T440 I441 N442 F480 W481 L484 F488	G333-T460 WeakPolarHBondContact CA-O 3.46Å; R334-T460 PolarHBondContact N-O 2.74Å; R334-T460 PolarHBondContact O-N 3.39Å; T440-T460 HydrophobicContact CG2-CG2 3.54Å; I441-T460 CarbonylContact O-C 3.58Å; I441-T460 WeakPolarHBondContact O-CA 3.29Å; N442-T460 WeakPolarHBondContact OD1-CB 3.45Å; N442-T460 WeakPolarHBondContact OD1-CG2 3.35Å; N442-T460 PolarHBondContact OD1-OG1 3.05Å; T460-F480 HydrophobicContact CG2-CE1 4.37Å; T460-F480 HydrophobicContact CG2-CZ 4.19Å; T460-W481 HydrophobicContact CG2-CZ3 4.47Å; T460-L484 HydrophobicContact CG2-CD1 3.64Å; T460-L484 HydrophobicContact CG2-CD2 4.42Å; T460-F488 WeakPolarHBondContact OG1-CE2 3.45Å
461	E	94.6	Very high	87.6	Confident	30 Å²	30	64.2 Å²	64.2	14%	0.14	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.4	175.9	-156.5	-172.3	151.9	0	0	111.6	L331 I441 R463	L331-E461 HydrophobicContact CB-CB 4.26Å; L331-E461 HydrophobicContact CD1-CB 4.1Å; I441-E461 PolarHBondContact N-O 3.27Å; I441-E461 PolarHBondContact O-N 3.17Å; E461-R463 IonicContact OE1-CZ 2.76Å; E461-R463 IonicContact OE1-NE 2.73Å; E461-R463 PolarHBondContact OE1-NE 3.01Å; E461-R463 IonicContact OE1-NH2 3.25Å; E461-R463 PolarHBondContact OE1-NH2 2.94Å; E461-R463 IonicContact OE2-CZ 2.95Å; E461-R463 VanDerWaalsContact OE2-CZ 3.32Å; E461-R463 IonicContact OE2-NE 2.76Å; E461-R463 PolarHBondContact OE2-NE 3.42Å; E461-R463 IonicContact OE2-NH2 3.84Å; E461-R463 PolarHBondContact OE2-NH2 3.38Å
462	L	93.9	Very high	86.8	Confident	18 Å²	18	55.2 Å²	55.2	9%	0.094	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	105.2	171	177.4	50.1	0	0	0	109.5	F438 Y464 I476 E477 F480 W481	F438-L462 HydrophobicContact CB-CD1 3.91Å; F438-L462 HydrophobicContact CD2-CD1 3.77Å; F438-L462 HydrophobicContact CG-CD1 4.19Å; L462-Y464 HydrophobicContact CD1-CE1 4.32Å; L462-Y464 HydrophobicContact CD2-CE1 4.41Å; L462-Y464 HydrophobicContact CD2-CE2 4.24Å; L462-Y464 VanDerWaalsContact CD2-OH 3.32Å; L462-Y464 WeakPolarHBondContact CD2-OH 3.39Å; L462-Y464 HydrophobicContact CG-CE1 4.29Å; L462-Y464 HydrophobicContact CG-CE2 4.12Å; L462-I476 HydrophobicContact CD1-CG2 4.31Å; L462-I476 HydrophobicContact CD2-CG2 4.31Å; L462-E477 HydrophobicContact CD2-CG 3.6Å; L462-F480 HydrophobicContact CB-CD1 4.14Å; L462-F480 HydrophobicContact CB-CE1 3.53Å; L462-F480 HydrophobicContact CB-CZ 3.73Å; L462-F480 HydrophobicContact CD1-CD1 4.2Å; L462-F480 HydrophobicContact CD1-CD2 3.83Å; L462-F480 HydrophobicContact CD1-CE1 4.04Å; L462-F480 HydrophobicContact CD1-CE2 3.62Å; L462-F480 HydrophobicContact CD1-CG 4.1Å; L462-F480 HydrophobicContact CD1-CZ 3.73Å; L462-F480 HydrophobicContact CD2-CD1 3.95Å; L462-F480 HydrophobicContact CD2-CE1 4.21Å; L462-F480 HydrophobicContact CD2-CG 4.26Å; L462-F480 HydrophobicContact CG-CD1 4.32Å; L462-F480 HydrophobicContact CG-CE1 4.12Å; L462-F480 HydrophobicContact CG-CZ 4.22Å; L462-W481 HydrophobicContact CB-CH2 4.23Å; L462-W481 HydrophobicContact CB-CZ2 4.03Å
463	R	92.9	Very high	86.3	Confident	90 Å²	90	55.6 Å²	55.6	34%	0.34	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.2	180	-74.8	-77.1	177.9	81.1	10.6	111.3	F438 Y439 I441 E461	F438-R463 CarbonylContact C-O 3.54Å; F438-R463 VanDerWaalsContact CA-O 3.22Å; F438-R463 WeakPolarHBondContact CA-O 3.27Å; Y439-R463 HydrophobicContact CD1-CB 3.77Å; Y439-R463 WeakPolarHBondContact CD1-O 3.43Å; Y439-R463 HydrophobicContact CD2-CB 4.14Å; Y439-R463 HydrophobicContact CE1-CB 3.31Å; Y439-R463 HydrophobicContact CE1-CG 4.36Å; Y439-R463 HydrophobicContact CE2-CB 3.74Å; Y439-R463 HydrophobicContact CE2-CG 4.13Å; Y439-R463 HydrophobicContact CG-CB 4.19Å; Y439-R463 PolarHBondContact N-O 3.36Å; Y439-R463 PolarHBondContact O-N 2.94Å; I441-R463 HydrophobicContact CD1-CG 3.8Å; I441-R463 HydrophobicContact CG1-CG 4.08Å; E461-R463 IonicContact OE1-CZ 2.76Å; E461-R463 IonicContact OE1-NE 2.73Å; E461-R463 PolarHBondContact OE1-NE 3.01Å; E461-R463 IonicContact OE1-NH2 3.25Å; E461-R463 PolarHBondContact OE1-NH2 2.94Å; E461-R463 IonicContact OE2-CZ 2.95Å; E461-R463 VanDerWaalsContact OE2-CZ 3.32Å; E461-R463 IonicContact OE2-NE 2.76Å; E461-R463 PolarHBondContact OE2-NE 3.42Å; E461-R463 IonicContact OE2-NH2 3.84Å; E461-R463 PolarHBondContact OE2-NH2 3.38Å
464	Y	91.7	Very high	85.5	Confident	59 Å²	59	55.1 Å²	55.1	23%	0.231	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.9	175.3	-67.8	-64.1	0	0	0	111.7	Y437 F438 L462 P468 K473 I476	Y437-Y464 CarbonylContact O-C 3.54Å; Y437-Y464 WeakPolarHBondContact O-CA 3.21Å; F438-Y464 HydrophobicContact CB-CD1 3.68Å; F438-Y464 HydrophobicContact CB-CE1 3.8Å; L462-Y464 HydrophobicContact CD1-CE1 4.32Å; L462-Y464 HydrophobicContact CD2-CE1 4.41Å; L462-Y464 HydrophobicContact CD2-CE2 4.24Å; L462-Y464 VanDerWaalsContact CD2-OH 3.32Å; L462-Y464 WeakPolarHBondContact CD2-OH 3.39Å; L462-Y464 HydrophobicContact CG-CE1 4.29Å; L462-Y464 HydrophobicContact CG-CE2 4.12Å; Y464-P468 HydrophobicContact CD1-CG 3.34Å; Y464-P468 HydrophobicContact CD2-CG 4.31Å; Y464-P468 HydrophobicContact CE1-CG 3.25Å; Y464-P468 HydrophobicContact CE2-CG 4.22Å; Y464-P468 HydrophobicContact CG-CG 3.89Å; Y464-K473 HydrophobicContact CE2-CG 4.19Å; Y464-K473 WeakPolarHBondContact OH-CG 3.35Å; Y464-I476 HydrophobicContact CE1-CD1 4.22Å; Y464-I476 HydrophobicContact CE1-CG2 4.16Å
465	R	89.6	Confident	84.7	Confident	127 Å²	127	58.4 Å²	58.4	48%	0.479	27%	0.273	S	S	.	.	S	Bend	trans	-81.1	-22.5	168.7	-66.2	174.9	178.3	-162.7	-4.3	111.8	E426 Y437 Y439	E426-R465 IonicContact OE1-CZ 3.86Å; E426-R465 IonicContact OE1-NH2 2.64Å; E426-R465 PolarHBondContact OE1-NH2 3.07Å; E426-R465 IonicContact OE2-NH2 2.72Å; Y437-R465 PolarHBondContact O-N 3.06Å; Y439-R465 HydrophobicContact CD1-CG 3.58Å; Y439-R465 HydrophobicContact CE1-CG 3.52Å
466	K	87.1	Confident	84.2	Confident	99 Å²	99	56.1 Å²	56.1	43%	0.43	27%	0.265	S	S	.	.	S	Bend	trans	-140.1	132.3	176.1	-56.3	178.2	-171.4	179	0	108.7	D436 Y437 P468	D436-K466 WeakPolarHBondContact O-CD 3.44Å; D436-K466 VanDerWaalsContact O-CE 3.26Å; D436-K466 WeakPolarHBondContact O-CE 3.39Å; D436-K466 IonicContact OD2-NZ 2.7Å; D436-K466 PolarHBondContact OD2-NZ 3.19Å; Y437-K466 HydrophobicContact CD1-CB 3.74Å; Y437-K466 HydrophobicContact CD2-CD 4.5Å; Y437-K466 HydrophobicContact CE1-CB 4.09Å; Y437-K466 HydrophobicContact CE2-CD 4.49Å; Y437-K466 HydrophobicContact CG-CB 4.14Å; Y437-K466 PolarHBondContact O-N 2.9Å; K466-P468 WeakPolarHBondContact O-CD 3.39Å; K466-P468 VanDerWaalsContact O-N 3.16Å
467	Q	81.2	Confident	83.8	Confident	157 Å²	157	58.5 Å²	58.5	73%	0.734	28%	0.276	S	S	*	.			trans	-61.8	115.5	-179.2	-167.6	69.3	8.5	0	0	110.5
468	P	72.1	Confident	83.2	Confident	9 Å²	9	65.3 Å²	65.3	6%	0.058	31%	0.306	C	S	.	.			trans	-80.3	151.3	177.2	0.4	17	0	0	0	110.6	Y437 Y464 K466 V472 K473 I476	Y437-P468 HydrophobicContact CD1-CB 4.3Å; Y464-P468 HydrophobicContact CD1-CG 3.34Å; Y464-P468 HydrophobicContact CD2-CG 4.31Å; Y464-P468 HydrophobicContact CE1-CG 3.25Å; Y464-P468 HydrophobicContact CE2-CG 4.22Å; Y464-P468 HydrophobicContact CG-CG 3.89Å; K466-P468 WeakPolarHBondContact O-CD 3.39Å; K466-P468 VanDerWaalsContact O-N 3.16Å; P468-V472 HydrophobicContact CB-CB 4.35Å; P468-V472 HydrophobicContact CB-CG1 4.16Å; P468-K473 HydrophobicContact CB-CB 4Å; P468-K473 HydrophobicContact CG-CB 4.3Å; P468-K473 HydrophobicContact CG-CG 4.28Å; P468-I476 HydrophobicContact CB-CD1 4.38Å; P468-I476 HydrophobicContact CG-CD1 4.42Å
469	W	60.4	Low	82.6	Confident	162 Å²	162	68.3 Å²	68.3	61%	0.614	32%	0.323	S	S	*	.			trans	-76.5	147.3	174.2	-63.1	56.6	0	0	0	108.8	L471 V472 K473	W469-L471 PolarHBondContact O-N 3.2Å; W469-V472 CarbonylContact O-C 3.52Å; W469-V472 WeakPolarHBondContact O-CA 3.38Å; W469-V472 WeakPolarHBondContact O-CB 3.42Å; W469-V472 PolarHBondContact O-N 3.38Å; W469-K473 PolarHBondContact O-N 2.67Å
470	G	68.3	Low	82.3	Confident	55 Å²	55	69.1 Å²	69.1	57%	0.567	33%	0.326	S	S	*	.	H	α-helix	trans	-39.8	-54.8	-168.3	0	0	0	0	0	115.9	V472 K473 T474	G470-V472 PolarHBondContact O-N 2.84Å; G470-K473 VanDerWaalsContact O-CB 3.32Å; G470-K473 WeakPolarHBondContact O-CB 3.39Å; G470-K473 PolarHBondContact O-N 3.4Å; G470-T474 PolarHBondContact O-N 3.36Å; G470-T474 PolarHBondContact O-OG1 3.35Å; G470-T474 VanDerWaalsContact O-OG1 3.07Å
471	L	60.5	Low	82	Confident	101 Å²	101	71.9 Å²	71.9	53%	0.529	34%	0.336	S	S	.	.	H	α-helix	trans	-66.7	-34.1	179.9	-56.6	179.3	0	0	0	113.9	W469 F475	W469-L471 PolarHBondContact O-N 3.2Å; L471-F475 WeakPolarHBondContact O-CB 3.43Å; L471-F475 PolarHBondContact O-N 2.83Å
472	V	71.8	Confident	81.6	Confident	13 Å²	13	73.4 Å²	73.4	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-70.5	-38.7	173.4	179.5	0	0	0	0	110.2	M154 Y434 P468 W469 G470 F475 I476	M154-V472 HydrophobicContact CE-CG2 4.47Å; Y434-V472 HydrophobicContact CD1-CG1 3.76Å; Y434-V472 HydrophobicContact CD2-CG1 4.09Å; Y434-V472 HydrophobicContact CE1-CG1 3.68Å; Y434-V472 HydrophobicContact CE1-CG2 4.27Å; Y434-V472 HydrophobicContact CE2-CG1 4.02Å; Y434-V472 HydrophobicContact CG-CG1 3.97Å; P468-V472 HydrophobicContact CB-CB 4.35Å; P468-V472 HydrophobicContact CB-CG1 4.16Å; W469-V472 CarbonylContact O-C 3.52Å; W469-V472 WeakPolarHBondContact O-CA 3.38Å; W469-V472 WeakPolarHBondContact O-CB 3.42Å; W469-V472 PolarHBondContact O-N 3.38Å; G470-V472 PolarHBondContact O-N 2.84Å; V472-F475 PolarHBondContact O-N 2.93Å; V472-I476 HydrophobicContact CG1-CD1 3.9Å; V472-I476 HydrophobicContact CG1-CG1 4.47Å; V472-I476 VanDerWaalsContact O-CG1 3.29Å; V472-I476 WeakPolarHBondContact O-CG1 3.44Å; V472-I476 PolarHBondContact O-N 3.36Å
473	K	79.2	Confident	81.3	Confident	78 Å²	78	74.4 Å²	74.4	34%	0.339	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-53.6	174.3	-165.2	-165.5	156.5	-170.1	0	110	Y464 P468 W469 G470 F475 I476 E477	Y464-K473 HydrophobicContact CE2-CG 4.19Å; Y464-K473 WeakPolarHBondContact OH-CG 3.35Å; P468-K473 HydrophobicContact CB-CB 4Å; P468-K473 HydrophobicContact CG-CB 4.3Å; P468-K473 HydrophobicContact CG-CG 4.28Å; W469-K473 PolarHBondContact O-N 2.67Å; G470-K473 VanDerWaalsContact O-CB 3.32Å; G470-K473 WeakPolarHBondContact O-CB 3.39Å; G470-K473 PolarHBondContact O-N 3.4Å; K473-F475 VanDerWaalsContact C-N 3.34Å; K473-F475 PolarHBondContact O-N 3.26Å; K473-I476 PolarHBondContact O-N 3.3Å; K473-E477 WeakPolarHBondContact CE-OE1 3.15Å; K473-E477 VanDerWaalsContact CE-OE2 3.3Å; K473-E477 WeakPolarHBondContact CE-OE2 3.5Å; K473-E477 IonicContact NZ-OE1 3.83Å; K473-E477 PolarHBondContact NZ-OE1 3.46Å; K473-E477 WeakPolarHBondContact O-CB 3.09Å; K473-E477 WeakPolarHBondContact O-CG 3.28Å; K473-E477 PolarHBondContact O-N 2.79Å
474	T	78.3	Confident	81.3	Confident	84 Å²	84	71 Å²	71	52%	0.515	35%	0.354	S	S	.	.	H	α-helix	trans	-60.7	-38.1	176.9	-52.9	0	0	0	0	112.8	G470 K478	G470-T474 PolarHBondContact O-N 3.36Å; G470-T474 PolarHBondContact O-OG1 3.35Å; G470-T474 VanDerWaalsContact O-OG1 3.07Å; T474-K478 VanDerWaalsContact O-CB 3.3Å; T474-K478 WeakPolarHBondContact O-CB 3.47Å; T474-K478 PolarHBondContact O-N 2.92Å
475	F	79.8	Confident	81.3	Confident	69 Å²	69	72.4 Å²	72.4	30%	0.303	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-46.4	174.7	177.3	-93.3	0	0	0	111.8	L398 Y434 L471 V472 K473 N479	L398-F475 HydrophobicContact CD1-CE2 4.02Å; L398-F475 HydrophobicContact CD1-CZ 4.31Å; Y434-F475 HydrophobicContact CD2-CD1 4.4Å; Y434-F475 HydrophobicContact CE2-CD1 4.21Å; Y434-F475 HydrophobicContact CE2-CE1 4.42Å; L471-F475 WeakPolarHBondContact O-CB 3.43Å; L471-F475 PolarHBondContact O-N 2.83Å; V472-F475 PolarHBondContact O-N 2.93Å; K473-F475 VanDerWaalsContact C-N 3.34Å; K473-F475 PolarHBondContact O-N 3.26Å; F475-N479 WeakPolarHBondContact CE2-ND2 3.32Å; F475-N479 PolarHBondContact O-N 3.22Å; F475-N479 PolarHBondContact O-ND2 2.79Å
476	I	84.9	Confident	81.4	Confident	5 Å²	5	69.5 Å²	69.5	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-55	175.8	-67.6	164.4	0	0	0	109.2	Y434 F438 L462 Y464 P468 V472 K473 K478 N479 F480	Y434-I476 HydrophobicContact CD2-CG1 4.48Å; Y434-I476 HydrophobicContact CG-CD1 4.41Å; F438-I476 HydrophobicContact CB-CG2 4.37Å; F438-I476 HydrophobicContact CD1-CD1 3.82Å; F438-I476 HydrophobicContact CD1-CG1 4.09Å; F438-I476 HydrophobicContact CD1-CG2 3.71Å; F438-I476 HydrophobicContact CD2-CG2 3.92Å; F438-I476 HydrophobicContact CE1-CD1 4.25Å; F438-I476 HydrophobicContact CE1-CG1 4.07Å; F438-I476 HydrophobicContact CE1-CG2 3.89Å; F438-I476 HydrophobicContact CE2-CG2 4.1Å; F438-I476 HydrophobicContact CG-CG2 3.73Å; F438-I476 HydrophobicContact CZ-CG2 4.08Å; L462-I476 HydrophobicContact CD1-CG2 4.31Å; L462-I476 HydrophobicContact CD2-CG2 4.31Å; Y464-I476 HydrophobicContact CE1-CD1 4.22Å; Y464-I476 HydrophobicContact CE1-CG2 4.16Å; P468-I476 HydrophobicContact CB-CD1 4.38Å; P468-I476 HydrophobicContact CG-CD1 4.42Å; V472-I476 HydrophobicContact CG1-CD1 3.9Å; V472-I476 HydrophobicContact CG1-CG1 4.47Å; V472-I476 VanDerWaalsContact O-CG1 3.29Å; V472-I476 WeakPolarHBondContact O-CG1 3.44Å; V472-I476 PolarHBondContact O-N 3.36Å; K473-I476 PolarHBondContact O-N 3.3Å; I476-K478 PolarHBondContact O-N 2.71Å; I476-N479 PolarHBondContact O-N 2.9Å; I476-F480 WeakPolarHBondContact O-CB 3.33Å; I476-F480 PolarHBondContact O-N 2.66Å
477	E	87.7	Confident	81.7	Confident	49 Å²	49	66.2 Å²	66.2	23%	0.229	34%	0.341	C	S	.	.	H	α-helix	trans	-54.2	-49.1	-178.9	-76.8	171.8	142.4	0	0	112.4	L462 K473 N479 F480 W481	L462-E477 HydrophobicContact CD2-CG 3.6Å; K473-E477 WeakPolarHBondContact CE-OE1 3.15Å; K473-E477 VanDerWaalsContact CE-OE2 3.3Å; K473-E477 WeakPolarHBondContact CE-OE2 3.5Å; K473-E477 IonicContact NZ-OE1 3.83Å; K473-E477 PolarHBondContact NZ-OE1 3.46Å; K473-E477 WeakPolarHBondContact O-CB 3.09Å; K473-E477 WeakPolarHBondContact O-CG 3.28Å; K473-E477 PolarHBondContact O-N 2.79Å; E477-N479 PolarHBondContact O-N 3.41Å; E477-F480 PolarHBondContact O-N 3.01Å; E477-W481 WeakPolarHBondContact O-CB 3.44Å; E477-W481 PolarHBondContact O-N 3.38Å
478	K	84.1	Confident	82.4	Confident	165 Å²	165	58.8 Å²	58.8	72%	0.717	31%	0.306	S	S	*	.	H	α-helix	trans	-60.8	-43.6	-178.6	-177.4	169.8	-178.3	170.2	0	112.6	T474 I476 S482	T474-K478 VanDerWaalsContact O-CB 3.3Å; T474-K478 WeakPolarHBondContact O-CB 3.47Å; T474-K478 PolarHBondContact O-N 2.92Å; I476-K478 PolarHBondContact O-N 2.71Å; K478-S482 VanDerWaalsContact O-CB 3.3Å; K478-S482 WeakPolarHBondContact O-CB 3.29Å; K478-S482 PolarHBondContact O-N 2.99Å
479	N	84.2	Confident	83.4	Confident	64 Å²	64	64.8 Å²	64.8	34%	0.342	33%	0.328	S	S	.	.	H	α-helix	trans	-74.2	-39	179.4	-73.3	-87	0	0	0	111.9	N396 F475 I476 E477 G483	N396-N479 PolarHBondContact ND2-OD1 2.68Å; F475-N479 WeakPolarHBondContact CE2-ND2 3.32Å; F475-N479 PolarHBondContact O-N 3.22Å; F475-N479 PolarHBondContact O-ND2 2.79Å; I476-N479 PolarHBondContact O-N 2.9Å; E477-N479 PolarHBondContact O-N 3.41Å; N479-G483 PolarHBondContact O-N 3.33Å
480	F	89.4	Confident	85.1	Confident	18 Å²	18	59.5 Å²	59.5	8%	0.079	31%	0.31	C	S	.	.	H	α-helix	trans	-64.2	-55.8	-179.2	176.9	-92.4	0	0	0	111.9	F438 T440 T460 L462 I476 E477 S482 G483 L484	F438-F480 HydrophobicContact CD2-CD2 4.23Å; F438-F480 HydrophobicContact CD2-CE2 4.48Å; F438-F480 HydrophobicContact CE2-CD2 4.05Å; T440-F480 HydrophobicContact CG2-CE2 4.04Å; T440-F480 HydrophobicContact CG2-CZ 3.88Å; T440-F480 WeakPolarHBondContact OG1-CE2 3.08Å; T460-F480 HydrophobicContact CG2-CE1 4.37Å; T460-F480 HydrophobicContact CG2-CZ 4.19Å; L462-F480 HydrophobicContact CB-CD1 4.14Å; L462-F480 HydrophobicContact CB-CE1 3.53Å; L462-F480 HydrophobicContact CB-CZ 3.73Å; L462-F480 HydrophobicContact CD1-CD1 4.2Å; L462-F480 HydrophobicContact CD1-CD2 3.83Å; L462-F480 HydrophobicContact CD1-CE1 4.04Å; L462-F480 HydrophobicContact CD1-CE2 3.62Å; L462-F480 HydrophobicContact CD1-CG 4.1Å; L462-F480 HydrophobicContact CD1-CZ 3.73Å; L462-F480 HydrophobicContact CD2-CD1 3.95Å; L462-F480 HydrophobicContact CD2-CE1 4.21Å; L462-F480 HydrophobicContact CD2-CG 4.26Å; L462-F480 HydrophobicContact CG-CD1 4.32Å; L462-F480 HydrophobicContact CG-CE1 4.12Å; L462-F480 HydrophobicContact CG-CZ 4.22Å; I476-F480 WeakPolarHBondContact O-CB 3.33Å; I476-F480 PolarHBondContact O-N 2.66Å; E477-F480 PolarHBondContact O-N 3.01Å; F480-S482 VanDerWaalsContact C-N 3.34Å; F480-S482 PolarHBondContact O-N 2.72Å; F480-G483 PolarHBondContact O-N 2.87Å; F480-L484 HydrophobicContact CD1-CD1 3.58Å; F480-L484 HydrophobicContact CD2-CD1 4.13Å; F480-L484 HydrophobicContact CE1-CD1 3.26Å; F480-L484 HydrophobicContact CE2-CD1 3.89Å; F480-L484 HydrophobicContact CG-CD1 4.01Å; F480-L484 HydrophobicContact CZ-CD1 3.46Å; F480-L484 VanDerWaalsContact CZ-CD1 3.46Å; F480-L484 WeakPolarHBondContact O-CG 3.43Å; F480-L484 PolarHBondContact O-N 2.99Å; F480-L484 VanDerWaalsContact O-N 3.07Å
481	W	89.5	Confident	86.4	Confident	58 Å²	58	57 Å²	57	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-38.4	-177.6	-62.3	124.9	0	0	0	111.8	R334 Y336 T460 L462 E477 L484 E485	R334-W481 HydrophobicContact CB-CE3 4.2Å; R334-W481 HydrophobicContact CB-CH2 4.22Å; R334-W481 HydrophobicContact CB-CZ3 3.71Å; Y336-W481 HydrophobicContact CE2-CE3 4.17Å; Y336-W481 HydrophobicContact CE2-CZ3 4.3Å; Y336-W481 PolarHBondContact OH-O 3.45Å; T460-W481 HydrophobicContact CG2-CZ3 4.47Å; L462-W481 HydrophobicContact CB-CH2 4.23Å; L462-W481 HydrophobicContact CB-CZ2 4.03Å; E477-W481 WeakPolarHBondContact O-CB 3.44Å; E477-W481 PolarHBondContact O-N 3.38Å; W481-L484 HydrophobicContact CE3-CD1 4.37Å; W481-E485 WeakPolarHBondContact O-CB 3.34Å; W481-E485 PolarHBondContact O-N 3.23Å
482	S	87.3	Confident	88.1	Confident	62 Å²	62	55.6 Å²	55.6	43%	0.434	27%	0.274	S	S	.	.	H	α-helix	trans	-62.7	-47.4	174.9	-178	0	0	0	0	112.2	K478 F480 L484 E485 D486	K478-S482 VanDerWaalsContact O-CB 3.3Å; K478-S482 WeakPolarHBondContact O-CB 3.29Å; K478-S482 PolarHBondContact O-N 2.99Å; F480-S482 VanDerWaalsContact C-N 3.34Å; F480-S482 PolarHBondContact O-N 2.72Å; S482-L484 VanDerWaalsContact C-N 3.32Å; S482-L484 PolarHBondContact O-N 2.88Å; S482-E485 PolarHBondContact O-N 2.64Å; S482-D486 PolarHBondContact O-N 2.97Å
483	G	88.4	Confident	89.2	Confident	39 Å²	39	56.9 Å²	56.9	40%	0.402	28%	0.284	S	S	.	.	H	α-helix	trans	-65.7	-33.1	-179.5	0	0	0	0	0	113.7	N479 F480 Y487	N479-G483 PolarHBondContact O-N 3.33Å; F480-G483 PolarHBondContact O-N 2.87Å; G483-Y487 WeakPolarHBondContact O-CB 3.38Å; G483-Y487 PolarHBondContact O-N 3.13Å; G483-Y487 VanDerWaalsContact O-N 3.1Å
484	L	92.3	Very high	90	Very high	19 Å²	19	54 Å²	54	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-75.8	-37.5	174.6	-71.1	164.2	0	0	0	112.6	Y336 T440 T460 F480 W481 S482 D486 Y487 F488	Y336-L484 HydrophobicContact CE2-CB 3.83Å; Y336-L484 HydrophobicContact CE2-CD1 4.44Å; T440-L484 HydrophobicContact CG2-CD1 4.39Å; T440-L484 HydrophobicContact CG2-CD2 4.23Å; T460-L484 HydrophobicContact CG2-CD1 3.64Å; T460-L484 HydrophobicContact CG2-CD2 4.42Å; F480-L484 HydrophobicContact CD1-CD1 3.58Å; F480-L484 HydrophobicContact CD2-CD1 4.13Å; F480-L484 HydrophobicContact CE1-CD1 3.26Å; F480-L484 HydrophobicContact CE2-CD1 3.89Å; F480-L484 HydrophobicContact CG-CD1 4.01Å; F480-L484 HydrophobicContact CZ-CD1 3.46Å; F480-L484 VanDerWaalsContact CZ-CD1 3.46Å; F480-L484 WeakPolarHBondContact O-CG 3.43Å; F480-L484 PolarHBondContact O-N 2.99Å; F480-L484 VanDerWaalsContact O-N 3.07Å; W481-L484 HydrophobicContact CE3-CD1 4.37Å; S482-L484 VanDerWaalsContact C-N 3.32Å; S482-L484 PolarHBondContact O-N 2.88Å; L484-D486 VanDerWaalsContact C-N 3.31Å; L484-D486 PolarHBondContact O-N 3.01Å; L484-Y487 WeakPolarHBondContact O-CB 3.36Å; L484-Y487 PolarHBondContact O-N 2.76Å; L484-F488 HydrophobicContact CB-CD2 4.44Å; L484-F488 HydrophobicContact CB-CE2 4.4Å; L484-F488 HydrophobicContact CD2-CE2 3.96Å; L484-F488 VanDerWaalsContact O-CD2 3.28Å; L484-F488 WeakPolarHBondContact O-CD2 3.28Å; L484-F488 PolarHBondContact O-N 2.93Å
485	E	91.6	Very high	90.9	Very high	87 Å²	87	50 Å²	50	41%	0.407	25%	0.247	S	C	.	.	H	α-helix	trans	-63.4	-40	175	-166.6	159.3	175.9	0	0	111.2	R334 Y336 W481 S482 Y487 R489	R334-E485 IonicContact CZ-OE2 2.67Å; R334-E485 IonicContact NH1-OE2 3.92Å; R334-E485 PolarHBondContact NH1-OE2 2.67Å; Y336-E485 VanDerWaalsContact CE1-CA 3.43Å; Y336-E485 HydrophobicContact CE1-CB 3.68Å; Y336-E485 HydrophobicContact CE1-CG 4.08Å; W481-E485 WeakPolarHBondContact O-CB 3.34Å; W481-E485 PolarHBondContact O-N 3.23Å; S482-E485 PolarHBondContact O-N 2.64Å; E485-Y487 VanDerWaalsContact C-N 3.34Å; E485-R489 WeakPolarHBondContact O-CB 3.44Å; E485-R489 PolarHBondContact O-N 3.41Å; E485-R489 PolarHBondContact O-NH1 2.91Å; E485-R489 VanDerWaalsContact O-NH1 3.12Å
486	D	90.9	Very high	91.6	Very high	67 Å²	67	48.5 Å²	48.5	36%	0.358	25%	0.247	S	C	.	.	H	α-helix	trans	-68.1	-29.9	170.2	-71.4	-16.1	0	0	0	113.2	R366 S482 L484 R489	R366-D486 PolarHBondContact NH1-O 2.84Å; S482-D486 PolarHBondContact O-N 2.97Å; L484-D486 VanDerWaalsContact C-N 3.31Å; L484-D486 PolarHBondContact O-N 3.01Å; D486-R489 IonicContact OD1-CZ 3.86Å; D486-R489 VanDerWaalsContact OD1-CZ 3.23Å; D486-R489 IonicContact OD1-NH1 3.79Å; D486-R489 PolarHBondContact OD1-NH1 3.32Å; D486-R489 IonicContact OD1-NH2 3.28Å; D486-R489 PolarHBondContact OD1-NH2 2.9Å
487	Y	93.8	Very high	92.1	Very high	29 Å²	29	53.5 Å²	53.5	11%	0.114	27%	0.269	C	S	.	.	H	α-helix	trans	-71.7	-55.9	177.2	-178.9	-95.3	0	0	0	112.2	F362 F368 G483 L484 E485 H490 L491	F362-Y487 AromaticContact CE1-CE2 3.71Å; F362-Y487 HydrophobicContact CE1-CE2 3.71Å; F362-Y487 AromaticContact CE1-CZ 3.83Å; F362-Y487 HydrophobicContact CZ-CD2 4.28Å; F362-Y487 AromaticContact CZ-CE2 3.79Å; F362-Y487 HydrophobicContact CZ-CE2 3.79Å; F362-Y487 AromaticContact CZ-CZ 3.95Å; F368-Y487 HydrophobicContact CE2-CE2 4.4Å; F368-Y487 HydrophobicContact CZ-CD2 4.49Å; F368-Y487 HydrophobicContact CZ-CE2 4.14Å; G483-Y487 WeakPolarHBondContact O-CB 3.38Å; G483-Y487 PolarHBondContact O-N 3.13Å; G483-Y487 VanDerWaalsContact O-N 3.1Å; L484-Y487 WeakPolarHBondContact O-CB 3.36Å; L484-Y487 PolarHBondContact O-N 2.76Å; E485-Y487 VanDerWaalsContact C-N 3.34Å; Y487-H490 PolarHBondContact O-N 3.41Å; Y487-L491 PolarHBondContact O-N 3.28Å; Y487-L491 VanDerWaalsContact O-N 3.09Å
488	F	95.6	Very high	92.5	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-72.1	-35.1	-173.8	-68.5	-61.4	0	0	0	113.3	Y336 V337 N442 Y444 V458 T460 L484 H490 L491 E492	Y336-F488 HydrophobicContact CD1-CB 4.34Å; Y336-F488 HydrophobicContact CD1-CD2 4.04Å; Y336-F488 AromaticContact CD2-CD2 3.57Å; Y336-F488 HydrophobicContact CD2-CD2 3.57Å; Y336-F488 AromaticContact CD2-CE2 3.83Å; Y336-F488 HydrophobicContact CD2-CE2 3.83Å; Y336-F488 HydrophobicContact CE2-CD2 4.23Å; Y336-F488 HydrophobicContact CE2-CE2 4.41Å; Y336-F488 HydrophobicContact CG-CB 4.22Å; Y336-F488 AromaticContact CG-CD2 3.44Å; Y336-F488 HydrophobicContact CG-CD2 3.44Å; Y336-F488 VanDerWaalsContact CG-CD2 3.44Å; Y336-F488 HydrophobicContact CG-CE2 4.16Å; Y336-F488 HydrophobicContact CG-CG 4.12Å; V337-F488 HydrophobicContact CG2-CB 4.12Å; N442-F488 HydrophobicContact CB-CZ 4.43Å; Y444-F488 HydrophobicContact CE1-CE1 4.06Å; V458-F488 HydrophobicContact CG1-CD1 4.15Å; V458-F488 HydrophobicContact CG1-CE1 3.6Å; V458-F488 HydrophobicContact CG1-CE2 4.41Å; V458-F488 HydrophobicContact CG1-CZ 3.74Å; T460-F488 WeakPolarHBondContact OG1-CE2 3.45Å; L484-F488 HydrophobicContact CB-CD2 4.44Å; L484-F488 HydrophobicContact CB-CE2 4.4Å; L484-F488 HydrophobicContact CD2-CE2 3.96Å; L484-F488 VanDerWaalsContact O-CD2 3.28Å; L484-F488 WeakPolarHBondContact O-CD2 3.28Å; L484-F488 PolarHBondContact O-N 2.93Å; F488-H490 PolarHBondContact O-N 2.84Å; F488-L491 HydrophobicContact CD1-CD2 4.09Å; F488-L491 HydrophobicContact CE1-CD2 4.47Å; F488-L491 WeakPolarHBondContact O-CB 3.45Å; F488-L491 PolarHBondContact O-N 3.12Å; F488-L491 VanDerWaalsContact O-N 3.08Å; F488-E492 WeakPolarHBondContact O-CB 3.42Å; F488-E492 PolarHBondContact O-N 3Å
489	R	94.6	Very high	92.9	Very high	136 Å²	136	46.6 Å²	46.6	51%	0.513	24%	0.242	S	C	.	.	H	α-helix	trans	-60.3	-32	172.5	-170.8	176.9	72.8	-107.5	4.3	112.6	E485 D486 S493	E485-R489 WeakPolarHBondContact O-CB 3.44Å; E485-R489 PolarHBondContact O-N 3.41Å; E485-R489 PolarHBondContact O-NH1 2.91Å; E485-R489 VanDerWaalsContact O-NH1 3.12Å; D486-R489 IonicContact OD1-CZ 3.86Å; D486-R489 VanDerWaalsContact OD1-CZ 3.23Å; D486-R489 IonicContact OD1-NH1 3.79Å; D486-R489 PolarHBondContact OD1-NH1 3.32Å; D486-R489 IonicContact OD1-NH2 3.28Å; D486-R489 PolarHBondContact OD1-NH2 2.9Å; R489-S493 WeakPolarHBondContact O-CB 3.39Å; R489-S493 PolarHBondContact O-N 2.97Å
490	H	95.1	Very high	93.3	Very high	51 Å²	51	47.2 Å²	47.2	24%	0.236	25%	0.251	C	S	.	.	H	α-helix	trans	-75.6	-39.4	173.2	-162.8	81.7	0	0	0	111.8	F362 Q365 R366 Y487 F488 S493 E494	F362-H490 AromaticContact CD2-CD2 3.86Å; F362-H490 HydrophobicContact CE2-CB 4.47Å; F362-H490 AromaticContact CE2-CD2 3.62Å; Q365-H490 PolarHBondContact OE1-CE1 3.07Å; Q365-H490 PolarHBondContact OE1-NE2 3.04Å; R366-H490 VanDerWaalsContact NH1-CB 3.28Å; Y487-H490 PolarHBondContact O-N 3.41Å; F488-H490 PolarHBondContact O-N 2.84Å; H490-S493 WeakPolarHBondContact O-CB 3.47Å; H490-S493 PolarHBondContact O-N 3.31Å; H490-E494 IonicContact NE2-OE1 2.97Å; H490-E494 WeakPolarHBondContact O-CG 3.11Å; H490-E494 PolarHBondContact O-N 3.31Å
491	L	96.1	Very high	93.4	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-46.1	177.4	-174.4	67.1	0	0	0	111.6	L352 F358 F362 Y487 F488 E494 L495	L352-L491 HydrophobicContact CD2-CD1 3.84Å; L352-L491 HydrophobicContact CD2-CD2 4.37Å; L352-L491 HydrophobicContact CD2-CG 4.45Å; F358-L491 HydrophobicContact CE1-CD1 4.01Å; F358-L491 HydrophobicContact CZ-CD1 4.05Å; F362-L491 HydrophobicContact CD2-CD1 4.09Å; F362-L491 HydrophobicContact CE1-CD1 4.19Å; F362-L491 HydrophobicContact CE2-CB 3.85Å; F362-L491 HydrophobicContact CE2-CD1 3.71Å; F362-L491 HydrophobicContact CE2-CG 4.42Å; F362-L491 HydrophobicContact CG-CD1 4.48Å; F362-L491 HydrophobicContact CZ-CB 3.99Å; F362-L491 HydrophobicContact CZ-CD1 3.77Å; F362-L491 HydrophobicContact CZ-CG 4.47Å; Y487-L491 PolarHBondContact O-N 3.28Å; Y487-L491 VanDerWaalsContact O-N 3.09Å; F488-L491 HydrophobicContact CD1-CD2 4.09Å; F488-L491 HydrophobicContact CE1-CD2 4.47Å; F488-L491 WeakPolarHBondContact O-CB 3.45Å; F488-L491 PolarHBondContact O-N 3.12Å; F488-L491 VanDerWaalsContact O-N 3.08Å; L491-E494 PolarHBondContact O-N 2.83Å; L491-L495 HydrophobicContact CG-CD1 4.17Å; L491-L495 WeakPolarHBondContact O-CB 3.46Å; L491-L495 VanDerWaalsContact O-CG 3.29Å; L491-L495 WeakPolarHBondContact O-CG 3.49Å; L491-L495 PolarHBondContact O-N 2.7Å
492	E	95.5	Very high	93.4	Very high	70 Å²	70	50.9 Å²	50.9	33%	0.327	28%	0.275	S	S	.	.	H	α-helix	trans	-59.1	-47	174.9	-171	-172.7	167.7	0	0	111.9	F488 E494 L495 A496	F488-E492 WeakPolarHBondContact O-CB 3.42Å; F488-E492 PolarHBondContact O-N 3Å; E492-E494 PolarHBondContact O-N 3.13Å; E492-L495 PolarHBondContact O-N 2.86Å; E492-A496 WeakPolarHBondContact O-CB 3.4Å; E492-A496 PolarHBondContact O-N 3.15Å
493	S	95.9	Very high	93.5	Very high	40 Å²	40	50.6 Å²	50.6	28%	0.28	27%	0.268	S	S	.	.	H	α-helix	trans	-54.6	-51	173.6	156.9	0	0	0	0	112.6	R489 H490 A496 K497	R489-S493 WeakPolarHBondContact O-CB 3.39Å; R489-S493 PolarHBondContact O-N 2.97Å; H490-S493 WeakPolarHBondContact O-CB 3.47Å; H490-S493 PolarHBondContact O-N 3.31Å; S493-A496 PolarHBondContact O-N 2.89Å; S493-K497 VanDerWaalsContact O-CG 3.29Å; S493-K497 WeakPolarHBondContact O-CG 3.47Å; S493-K497 PolarHBondContact O-N 2.95Å; S493-K497 VanDerWaalsContact O-N 3.1Å; S493-K497 VanDerWaalsContact OG-CE 3.26Å; S493-K497 WeakPolarHBondContact OG-CE 3.39Å; S493-K497 PolarHBondContact OG-NZ 3.49Å; S493-K497 VanDerWaalsContact OG-NZ 3.11Å
494	E	96.1	Very high	93.5	Very high	19 Å²	19	51 Å²	51	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-71	-33.7	-178	-60.6	-44	97	0	0	112	F358 F362 Q365 H490 L491 E492 K497 T498	F358-E494 HydrophobicContact CE2-CB 3.71Å; F358-E494 HydrophobicContact CZ-CB 4.06Å; F362-E494 HydrophobicContact CD2-CB 4.45Å; F362-E494 HydrophobicContact CD2-CG 4.2Å; Q365-E494 PolarHBondContact NE2-OE2 3.43Å; Q365-E494 PolarHBondContact OE1-OE2 3.35Å; H490-E494 IonicContact NE2-OE1 2.97Å; H490-E494 WeakPolarHBondContact O-CG 3.11Å; H490-E494 PolarHBondContact O-N 3.31Å; L491-E494 PolarHBondContact O-N 2.83Å; E492-E494 PolarHBondContact O-N 3.13Å; E494-K497 PolarHBondContact O-N 2.92Å; E494-K497 WeakPolarHBondContact OE1-CD 3.45Å; E494-K497 WeakPolarHBondContact OE1-CE 3.32Å; E494-K497 IonicContact OE1-NZ 2.94Å; E494-K497 PolarHBondContact OE1-NZ 2.93Å; E494-K497 IonicContact OE2-NZ 3.97Å; E494-T498 WeakPolarHBondContact O-CB 3.33Å; E494-T498 PolarHBondContact O-N 2.89Å; E494-T498 PolarHBondContact O-OG1 3.15Å
495	L	96.2	Very high	93.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-46.7	172.9	-75.5	172	0	0	0	111.5	F341 F343 L348 L352 F358 L456 L491 E492 K497 T498 E499	F341-L495 HydrophobicContact CD1-CB 4.27Å; F341-L495 HydrophobicContact CE1-CB 3.68Å; F341-L495 HydrophobicContact CE2-CD1 4.09Å; F341-L495 HydrophobicContact CZ-CB 3.82Å; F341-L495 HydrophobicContact CZ-CD1 4.03Å; F343-L495 HydrophobicContact CE2-CD2 4.43Å; L348-L495 HydrophobicContact CD1-CD2 4.26Å; L352-L495 HydrophobicContact CD2-CD1 4.45Å; L352-L495 HydrophobicContact CD2-CD2 4.3Å; F358-L495 HydrophobicContact CE1-CD2 4.08Å; F358-L495 HydrophobicContact CE2-CD2 4.07Å; F358-L495 HydrophobicContact CE2-CG 4.36Å; F358-L495 HydrophobicContact CZ-CD2 3.66Å; F358-L495 HydrophobicContact CZ-CG 3.81Å; L456-L495 HydrophobicContact CD2-CD1 3.58Å; L491-L495 HydrophobicContact CG-CD1 4.17Å; L491-L495 WeakPolarHBondContact O-CB 3.46Å; L491-L495 VanDerWaalsContact O-CG 3.29Å; L491-L495 WeakPolarHBondContact O-CG 3.49Å; L491-L495 PolarHBondContact O-N 2.7Å; E492-L495 PolarHBondContact O-N 2.86Å; L495-K497 VanDerWaalsContact C-N 3.34Å; L495-K497 PolarHBondContact O-N 2.97Å; L495-T498 WeakPolarHBondContact O-CB 3.47Å; L495-T498 PolarHBondContact O-N 3.4Å; L495-T498 VanDerWaalsContact O-N 3.14Å; L495-E499 WeakPolarHBondContact O-CB 3.45Å; L495-E499 PolarHBondContact O-N 2.82Å
496	A	95.2	Very high	92.5	Very high	37 Å²	37	54.6 Å²	54.6	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-64.6	-34.6	178.4	0	0	0	0	0	113	F341 E492 S493 S500	F341-A496 HydrophobicContact CE1-CB 4.49Å; E492-A496 WeakPolarHBondContact O-CB 3.4Å; E492-A496 PolarHBondContact O-N 3.15Å; S493-A496 PolarHBondContact O-N 2.89Å; A496-S500 WeakPolarHBondContact O-CB 3.4Å; A496-S500 PolarHBondContact O-N 2.89Å; A496-S500 PolarHBondContact O-OG 3.29Å
497	K	95.1	Very high	91.6	Very high	110 Å²	110	58.3 Å²	58.3	48%	0.478	30%	0.3	S	S	.	.	H	α-helix	trans	-66.6	-41.7	171	-69.3	168.6	-165.6	172.4	0	111.9	S493 E494 L495 S500 T501	S493-K497 VanDerWaalsContact O-CG 3.29Å; S493-K497 WeakPolarHBondContact O-CG 3.47Å; S493-K497 PolarHBondContact O-N 2.95Å; S493-K497 VanDerWaalsContact O-N 3.1Å; S493-K497 VanDerWaalsContact OG-CE 3.26Å; S493-K497 WeakPolarHBondContact OG-CE 3.39Å; S493-K497 PolarHBondContact OG-NZ 3.49Å; S493-K497 VanDerWaalsContact OG-NZ 3.11Å; E494-K497 PolarHBondContact O-N 2.92Å; E494-K497 WeakPolarHBondContact OE1-CD 3.45Å; E494-K497 WeakPolarHBondContact OE1-CE 3.32Å; E494-K497 IonicContact OE1-NZ 2.94Å; E494-K497 PolarHBondContact OE1-NZ 2.93Å; E494-K497 IonicContact OE2-NZ 3.97Å; L495-K497 VanDerWaalsContact C-N 3.34Å; L495-K497 PolarHBondContact O-N 2.97Å; K497-S500 PolarHBondContact O-N 3.02Å; K497-T501 WeakPolarHBondContact O-CB 3.32Å; K497-T501 PolarHBondContact O-N 2.97Å; K497-T501 PolarHBondContact O-OG1 2.77Å
498	T	94.8	Very high	90.3	Very high	40 Å²	40	66.9 Å²	66.9	25%	0.245	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-41.7	177.8	-58	0	0	0	0	111	F343 L351 F358 E494 L495 T501 Y502	F343-T498 HydrophobicContact CE1-CG2 4.48Å; F343-T498 HydrophobicContact CZ-CG2 4.01Å; L351-T498 HydrophobicContact CD1-CG2 4.36Å; L351-T498 HydrophobicContact CD2-CG2 4.2Å; F358-T498 HydrophobicContact CD2-CG2 4.33Å; F358-T498 VanDerWaalsContact CD2-OG1 3.32Å; F358-T498 WeakPolarHBondContact CD2-OG1 3.34Å; F358-T498 WeakPolarHBondContact CE2-OG1 3.48Å; E494-T498 WeakPolarHBondContact O-CB 3.33Å; E494-T498 PolarHBondContact O-N 2.89Å; E494-T498 PolarHBondContact O-OG1 3.15Å; L495-T498 WeakPolarHBondContact O-CB 3.47Å; L495-T498 PolarHBondContact O-N 3.4Å; L495-T498 VanDerWaalsContact O-N 3.14Å; T498-T501 PolarHBondContact O-N 2.68Å; T498-Y502 WeakPolarHBondContact O-CB 3.33Å; T498-Y502 PolarHBondContact O-N 3.22Å
499	E	94.4	Very high	88.5	Confident	28 Å²	28	74.1 Å²	74.1	13%	0.131	37%	0.366	C	S	.	.	H	α-helix	trans	-61.5	-50.6	174.2	175.7	-173.2	-148.4	0	0	111.3	N342 F343 L495 T501 Y502 L503	N342-E499 HydrophobicContact CB-CG 4.25Å; N342-E499 WeakPolarHBondContact CB-OE1 3.35Å; N342-E499 PolarHBondContact N-OE1 3.38Å; N342-E499 PolarHBondContact ND2-OE1 3.45Å; F343-E499 HydrophobicContact CE1-CB 4.26Å; F343-E499 HydrophobicContact CE2-CB 4.13Å; F343-E499 VanDerWaalsContact CZ-CA 3.5Å; F343-E499 HydrophobicContact CZ-CB 3.71Å; L495-E499 WeakPolarHBondContact O-CB 3.45Å; L495-E499 PolarHBondContact O-N 2.82Å; E499-T501 PolarHBondContact O-N 3.27Å; E499-Y502 PolarHBondContact O-N 2.79Å; E499-Y502 VanDerWaalsContact O-N 3.14Å; E499-L503 HydrophobicContact CG-CD1 4.05Å; E499-L503 HydrophobicContact CG-CG 4.46Å; E499-L503 WeakPolarHBondContact O-CB 3.46Å; E499-L503 WeakPolarHBondContact O-CG 3.44Å; E499-L503 PolarHBondContact O-N 2.82Å
500	S	92.6	Very high	86.1	Confident	77 Å²	77	71.2 Å²	71.2	54%	0.538	37%	0.367	S	S	.	.	H	α-helix	trans	-56.2	-38.1	177.4	-62.2	0	0	0	0	111.8	A496 K497 A504	A496-S500 WeakPolarHBondContact O-CB 3.4Å; A496-S500 PolarHBondContact O-N 2.89Å; A496-S500 PolarHBondContact O-OG 3.29Å; K497-S500 PolarHBondContact O-N 3.02Å; S500-A504 WeakPolarHBondContact O-CB 3.46Å; S500-A504 PolarHBondContact O-N 3.49Å; S500-A504 VanDerWaalsContact O-N 3.15Å
501	T	91.5	Very high	83.9	Confident	86 Å²	86	74.5 Å²	74.5	53%	0.528	39%	0.392	S	S	.	.	H	α-helix	trans	-71.2	-45.6	176.9	-54.6	0	0	0	0	111.6	K497 T498 E499 A504 E505	K497-T501 WeakPolarHBondContact O-CB 3.32Å; K497-T501 PolarHBondContact O-N 2.97Å; K497-T501 PolarHBondContact O-OG1 2.77Å; T498-T501 PolarHBondContact O-N 2.68Å; E499-T501 PolarHBondContact O-N 3.27Å; T501-A504 WeakPolarHBondContact O-CB 3.49Å; T501-A504 PolarHBondContact O-N 2.91Å; T501-E505 PolarHBondContact O-N 3.04Å
502	Y	88.7	Confident	81.4	Confident	67 Å²	67	83.5 Å²	83.5	26%	0.263	43%	0.431	S	S	.	.	H	α-helix	trans	-60.4	-45.6	177.8	176.2	-114.7	0	0	0	112.3	N342 F343 T498 E499 A504 E505 M506	N342-Y502 WeakPolarHBondContact O-CE1 3.31Å; F343-Y502 AromaticContact CD1-CD1 3.77Å; F343-Y502 HydrophobicContact CD1-CD1 3.77Å; F343-Y502 HydrophobicContact CD1-CE1 4.11Å; F343-Y502 HydrophobicContact CD1-CG 4.33Å; F343-Y502 AromaticContact CE1-CD1 3.88Å; F343-Y502 HydrophobicContact CE1-CD1 3.88Å; F343-Y502 HydrophobicContact CE1-CG 4.08Å; T498-Y502 WeakPolarHBondContact O-CB 3.33Å; T498-Y502 PolarHBondContact O-N 3.22Å; E499-Y502 PolarHBondContact O-N 2.79Å; E499-Y502 VanDerWaalsContact O-N 3.14Å; Y502-A504 PolarHBondContact O-N 3.48Å; Y502-E505 PolarHBondContact O-N 2.93Å; Y502-M506 HydrophobicContact CD1-SD 4.37Å; Y502-M506 HydrophobicContact CE1-SD 3.7Å; Y502-M506 HydrophobicContact CE2-CG 4.41Å; Y502-M506 HydrophobicContact CE2-SD 4.4Å; Y502-M506 WeakPolarHBondContact O-CG 3.41Å; Y502-M506 PolarHBondContact O-N 3.47Å
503	L	88.9	Confident	78.7	Confident	56 Å²	56	89.3 Å²	89.3	29%	0.293	46%	0.459	S	S	.	.	H	α-helix	trans	-62.8	-39.9	174.3	-69.7	175.3	0	0	0	111.9	N342 E499 E505 M506 H507	N342-L503 HydrophobicContact CB-CD1 4.17Å; N342-L503 HydrophobicContact CB-CD2 4.01Å; N342-L503 HydrophobicContact CB-CG 4.39Å; E499-L503 HydrophobicContact CG-CD1 4.05Å; E499-L503 HydrophobicContact CG-CG 4.46Å; E499-L503 WeakPolarHBondContact O-CB 3.46Å; E499-L503 WeakPolarHBondContact O-CG 3.44Å; E499-L503 PolarHBondContact O-N 2.82Å; L503-E505 VanDerWaalsContact C-N 3.3Å; L503-E505 PolarHBondContact O-N 2.72Å; L503-M506 PolarHBondContact O-N 3.08Å; L503-H507 WeakPolarHBondContact O-CB 3.36Å; L503-H507 PolarHBondContact O-CD2 3.28Å; L503-H507 PolarHBondContact O-N 3.06Å
504	A	88.3	Confident	76.3	Confident	49 Å²	49	97.1 Å²	97.1	41%	0.405	49%	0.488	S	S	.	.	H	α-helix	trans	-64.8	-32.1	175.6	0	0	0	0	0	112.8	S500 T501 Y502 R508	S500-A504 WeakPolarHBondContact O-CB 3.46Å; S500-A504 PolarHBondContact O-N 3.49Å; S500-A504 VanDerWaalsContact O-N 3.15Å; T501-A504 WeakPolarHBondContact O-CB 3.49Å; T501-A504 PolarHBondContact O-N 2.91Å; Y502-A504 PolarHBondContact O-N 3.48Å; A504-R508 VanDerWaalsContact O-CG 3.31Å; A504-R508 WeakPolarHBondContact O-CG 3.46Å; A504-R508 PolarHBondContact O-N 3.24Å
505	E	85.6	Confident	73.5	Confident	105 Å²	105	100.6 Å²	100.6	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-74.6	-41.2	172.3	-70.4	-164.2	131.6	0	0	112.7	T501 Y502 L503 H507 R508 Q509	T501-E505 PolarHBondContact O-N 3.04Å; Y502-E505 PolarHBondContact O-N 2.93Å; L503-E505 VanDerWaalsContact C-N 3.3Å; L503-E505 PolarHBondContact O-N 2.72Å; E505-H507 VanDerWaalsContact C-N 3.33Å; E505-H507 PolarHBondContact O-N 3.28Å; E505-R508 WeakPolarHBondContact O-CA 3.44Å; E505-R508 WeakPolarHBondContact O-CB 3.45Å; E505-R508 PolarHBondContact O-N 3.23Å; E505-Q509 WeakPolarHBondContact O-CG 3.29Å; E505-Q509 PolarHBondContact O-N 3.41Å
506	M	76.9	Confident	70.7	Confident	76 Å²	76	106.4 Å²	106.4	37%	0.374	56%	0.56	S	S	.	*	H	α-helix	trans	-58.4	-44.7	172.2	-69.9	-167.5	73.6	0	0	111.7	Y502 L503 R508 Q509 S510	Y502-M506 HydrophobicContact CD1-SD 4.37Å; Y502-M506 HydrophobicContact CE1-SD 3.7Å; Y502-M506 HydrophobicContact CE2-CG 4.41Å; Y502-M506 HydrophobicContact CE2-SD 4.4Å; Y502-M506 WeakPolarHBondContact O-CG 3.41Å; Y502-M506 PolarHBondContact O-N 3.47Å; L503-M506 PolarHBondContact O-N 3.08Å; M506-R508 PolarHBondContact O-N 3.1Å; M506-Q509 PolarHBondContact O-N 3.33Å; M506-Q509 VanDerWaalsContact O-N 3.12Å; M506-S510 PolarHBondContact O-N 2.74Å
507	H	73.8	Confident	67.9	Low	145 Å²	145	114.2 Å²	114.2	67%	0.671	59%	0.587	S	S	*	*	H	α-helix	trans	-67.1	-19.3	174.7	-78.9	-63.3	0	0	0	114.1	L503 E505	L503-H507 WeakPolarHBondContact O-CB 3.36Å; L503-H507 PolarHBondContact O-CD2 3.28Å; L503-H507 PolarHBondContact O-N 3.06Å; E505-H507 VanDerWaalsContact C-N 3.33Å; E505-H507 PolarHBondContact O-N 3.28Å
508	R	65.8	Low	65	Low	209 Å²	209	115.2 Å²	115.2	79%	0.789	60%	0.603	S	S	*	*	H	α-helix	trans	-82.8	-26.5	170.4	-80.9	172.5	167.2	-175.9	-2.5	113.3	A504 E505 M506	A504-R508 VanDerWaalsContact O-CG 3.31Å; A504-R508 WeakPolarHBondContact O-CG 3.46Å; A504-R508 PolarHBondContact O-N 3.24Å; E505-R508 WeakPolarHBondContact O-CA 3.44Å; E505-R508 WeakPolarHBondContact O-CB 3.45Å; E505-R508 PolarHBondContact O-N 3.23Å; M506-R508 PolarHBondContact O-N 3.1Å
509	Q	56.7	Low	61.9	Low	153 Å²	153	119.7 Å²	119.7	72%	0.715	63%	0.63	S	S	*	*	H	α-helix	trans	-83.3	-19.3	178.8	-69	176.2	18.9	0	0	113.1	E505 M506 P511	E505-Q509 WeakPolarHBondContact O-CG 3.29Å; E505-Q509 PolarHBondContact O-N 3.41Å; M506-Q509 PolarHBondContact O-N 3.33Å; M506-Q509 VanDerWaalsContact O-N 3.12Å; Q509-P511 WeakPolarHBondContact O-CD 3.49Å
510	S	45	Very low	58.9	Low	75 Å²	75	124.3 Å²	124.3	52%	0.524	66%	0.66	S	S	.	*	S	Bend	trans	-59.7	123.4	167.9	-172	0	0	0	0	110.8	M506 K512	M506-S510 PolarHBondContact O-N 2.74Å; S510-K512 PolarHBondContact O-N 2.87Å
511	P	49.4	Very low	56.2	Low	120 Å²	120	127 Å²	127	78%	0.779	67%	0.673	S	S	*	*			trans	-60	120.9	-177.4	-25.8	35.1	0	0	0	112.4	Q509 E513	Q509-P511 WeakPolarHBondContact O-CD 3.49Å; P511-E513 PolarHBondContact O-N 2.72Å
512	K	44.2	Very low	53.4	Low	191 Å²	191	134.8 Å²	134.8	83%	0.83	69%	0.693	S	S	*	*			trans	-78.7	113.2	168.3	-74.4	-173.7	176.7	-178.9	0	109.7	S510	S510-K512 PolarHBondContact O-N 2.87Å
513	E	38.7	Very low	50.6	Low	193 Å²	193	142.7 Å²	142.7	90%	0.902	72%	0.722	S	S	*	*			trans	-56.9	147.8	165.7	-69.2	-166.2	110	0	0	111.5	P511	P511-E513 PolarHBondContact O-N 2.72Å
514	K	44.3	Very low	48	Very low	204 Å²	204	151.4 Å²	151.4	89%	0.887	75%	0.751	S	S	*	*			trans	-93.7	122.6	-179.4	-61.8	169.4	-176.3	167.5	0	109.6
515	A	37.2	Very low	45.2	Very low	91 Å²	91	158.3 Å²	158.3	75%	0.752	77%	0.772	S	S	*	*				169.1	131	109.6	0	0	0	0	0	112.9
516	S	36.8	Very low	42.7	Very low	122 Å²	122	164.7 Å²	164.7	85%	0.853	79%	0.792	S	S	*	*			trans	-86.2	114.3	159.2	43.3	0	0	0	0	110.3
517	K	36.9	Very low	40.9	Very low	201 Å²	201	166.5 Å²	166.5	87%	0.874	81%	0.809	S	S	*	*			trans	-141.3	114.4	162.4	-76.6	-168	179.5	175.1	0	111.8
518	T	34.2	Very low	38.9	Very low	132 Å²	132	168.1 Å²	168.1	81%	0.81	82%	0.816	S	S	*	*			trans	-101.8	127.3	171.7	49.3	0	0	0	0	110.6
519	T	30.7	Very low	37	Very low	133 Å²	133	161.5 Å²	161.5	82%	0.816	81%	0.806	S	S	*	*			trans	-171.4	145.7	142	10.1	0	0	0	0	115.1
520	T	30.9	Very low	35.9	Very low	126 Å²	126	162.9 Å²	162.9	77%	0.773	81%	0.812	S	S	*	*			trans	58.7	86.7	148.9	55.1	0	0	0	0	123
521	V	35.9	Very low	35.3	Very low	132 Å²	132	167 Å²	167	80%	0.8	83%	0.828	S	S	*	*				17.1	124.9	120.1	-176.2	0	0	0	0	119.3
522	R	31.8	Very low	34.2	Very low	251 Å²	251	172.8 Å²	172.8	95%	0.947	83%	0.834	S	S	*	*			trans	-151.6	68.3	146.7	-129.5	175.2	-167.7	-178.2	4.4	118.2
523	R	31.5	Very low	33.8	Very low	233 Å²	233	170 Å²	170	88%	0.879	83%	0.833	S	S	*	*			trans	31.2	112.5	138.2	-175.3	-171	-172	177.2	4	119.6
524	R	32.8	Very low	33.8	Very low	238 Å²	238	166 Å²	166	90%	0.898	82%	0.824	S	S	*	*			trans	-151.4	116	138.9	-122.6	177.2	-171.8	-165.8	2.1	115.7
525	K	30.5	Very low	33	Very low	194 Å²	194	164 Å²	164	84%	0.843	82%	0.817	S	S	*	*			trans	42.1	105.1	151.6	-66.5	-171.3	172.7	-170.5	0	121.9
526	R	32.7	Very low	32.6	Very low	240 Å²	240	165.3 Å²	165.3	91%	0.906	81%	0.811	S	S	*	*			trans	-59.4	160.4	130.9	-80.8	-177.9	-178.8	174.3	0.4	110.2
527	P	39.6	Very low	32.2	Very low	113 Å²	113	167.3 Å²	167.3	73%	0.734	81%	0.807	S	S	*	*				-146.3	-176.2	55.7	33	-8.4	0	0	0	115.8
528	H	32	Very low	31.8	Very low	179 Å²	179	166.4 Å²	166.4	83%	0.829	81%	0.806	S	S	*	*			cis	-156.3	149	-12.6	-124.7	-68.9	0	0	0	109.7
529	A	26.3	Very low	31.4	Very low	70 Å²	70	165.5 Å²	165.5	58%	0.579	80%	0.8	S	S	*	*			trans	55.7	157.3	150.2	0	0	0	0	0	119.2
530	H	32.5	Very low	31.2	Very low	182 Å²	182	167.9 Å²	167.9	84%	0.843	80%	0.804	S	S	*	*			cis	-135.7	166.7	20.2	-83.5	-97.6	0	0	0	113.5
531	L	31.7	Very low	31.1	Very low	163 Å²	163	166 Å²	166	85%	0.853	80%	0.796	S	S	*	*			trans	-78.6	142.7	169.3	-73	68.4	0	0	0	111.1
532	R	28	Very low	31.1	Very low	240 Å²	240	165.4 Å²	165.4	91%	0.906	80%	0.795	S	S	*	*				-169.6	146.4	120.3	-109.5	176.7	179.6	120.7	-3.1	114.3
533	V	34.7	Very low	30.9	Very low	134 Å²	134	158.9 Å²	158.9	81%	0.812	78%	0.782	S	S	*	*			trans	-130.5	137.8	158.8	177.3	0	0	0	0	101.5
534	P	39	Very low	30.9	Very low	109 Å²	109	152.8 Å²	152.8	71%	0.708	77%	0.771	S	S	*	*				-157.7	-173	62.1	44.3	-22.3	0	0	0	118.4
535	H	27.1	Very low	30.8	Very low	160 Å²	160	147.4 Å²	147.4	74%	0.741	77%	0.765	S	S	*	*			trans	78.7	105.5	139	-144.2	-97.7	0	0	0	122.3
536	L	29	Very low	31.6	Very low	120 Å²	120	143.2 Å²	143.2	63%	0.628	76%	0.758	S	S	*	*				57	137.6	126.7	-140.6	77.3	0	0	0	123.6
537	E	28.3	Very low	31.3	Very low	163 Å²	163	138.9 Å²	138.9	76%	0.762	76%	0.758	S	S	*	*			trans	97.4	127	135.6	-116.1	161.2	-157.6	0	0	123.8
538	E	28.8	Very low	30.9	Very low	182 Å²	182	140.8 Å²	140.8	85%	0.85	76%	0.762	S	S	*	*			trans	69.5	176	147.5	-124.5	-173.5	173.6	0	0	122.8
539	V	26.6	Very low	30.8	Very low	113 Å²	113	141 Å²	141	69%	0.685	76%	0.763	S	S	*	*			trans	98.9	86.5	164.8	-167.1	0	0	0	0	118.9
540	M	25.7	Very low	31	Very low	183 Å²	183	144.4 Å²	144.4	90%	0.901	77%	0.772	S	S	*	*			trans	82.8	147.9	133.8	-65.9	177.4	71.8	0	0	123.7
541	S	29.4	Very low	30.9	Very low	88 Å²	88	141.5 Å²	141.5	62%	0.615	77%	0.767	S	S	*	*			trans	-100.3	171.8	167.2	58.3	0	0	0	0	112
542	P	34.9	Very low	30.7	Very low	119 Å²	119	136.7 Å²	136.7	77%	0.773	76%	0.757	S	S	*	*				-128.4	155.9	106.8	4.6	17.6	0	0	0	112.5
543	V	28.1	Very low	30.8	Very low	113 Å²	113	133.7 Å²	133.7	69%	0.685	75%	0.753	S	S	*	*			cis	79.7	123.8	36.6	169.4	0	0	0	0	112.6
544	T	32.4	Very low	30.6	Very low	105 Å²	105	138.1 Å²	138.1	64%	0.644	76%	0.755	S	S	*	*			cis	-169.5	144.2	-6.6	29	0	0	0	0	112.4
545	T	30	Very low	30.2	Very low	126 Å²	126	139 Å²	139	77%	0.773	75%	0.752	S	S	*	*			trans	49.6	-167.3	136.2	73.2	0	0	0	0	121.3
546	P	46.2	Very low	30.2	Very low	106 Å²	106	140.9 Å²	140.9	69%	0.688	76%	0.758	S	S	*	*				-125.6	178.4	-50.8	27.6	-9.1	0	0	0	113.6
547	T	28	Very low	30.1	Very low	148 Å²	148	143.1 Å²	143.1	91%	0.908	77%	0.765	S	S	*	*				-166.5	164.2	119	23.4	0	0	0	0	111.8
548	D	30.3	Very low	30.2	Very low	153 Å²	153	141.9 Å²	141.9	82%	0.818	77%	0.768	S	S	*	*			trans	-120.1	177.8	-170.3	-159.1	-4.4	0	0	0	111
549	E	30.3	Very low	30.1	Very low	184 Å²	184	138 Å²	138	86%	0.86	77%	0.768	S	S	*	*			trans	154.5	161	154.1	-86.1	-73.3	144.7	0	0	113.1
550	D	30.2	Very low	30.1	Very low	141 Å²	141	136.2 Å²	136.2	75%	0.754	77%	0.772	S	S	*	*			trans	-133	173.2	-147.8	-164.8	6.2	0	0	0	115.4
551	V	29.5	Very low	30.2	Very low	121 Å²	121	132.8 Å²	132.8	73%	0.733	77%	0.766	S	S	*	*			trans	65.7	121.8	160.8	-171.9	0	0	0	0	120.5
552	G	27.8	Very low	30.1	Very low	63 Å²	63	134.7 Å²	134.7	65%	0.649	77%	0.774	S	S	*	*				127.8	102.2	118.8	0	0	0	0	0	123.3
553	H	30	Very low	29.7	Very low	176 Å²	176	137 Å²	137	82%	0.815	78%	0.775	S	S	*	*			trans	76.1	133.5	130.1	-80.8	-57.6	0	0	0	126.1
554	R	30.8	Very low	29.9	Very low	227 Å²	227	137.9 Å²	137.9	86%	0.857	78%	0.78	S	S	*	*			trans	96.6	110.6	153.6	-72.5	178.1	171.1	175.9	-1.6	117.6
555	I	29.7	Very low	29.6	Very low	129 Å²	129	144.3 Å²	144.3	66%	0.662	79%	0.793	S	S	*	*			cis	79.2	110.5	49.1	-59.1	162.5	0	0	0	114.1
556	K	27.5	Very low	29.3	Very low	198 Å²	198	146.4 Å²	146.4	86%	0.861	79%	0.793	S	S	*	*			trans	-172.6	138.7	143.6	-102.1	172	-178.2	179.7	0	108.5
557	H	27.4	Very low	28.5	Very low	167 Å²	167	148.5 Å²	148.5	77%	0.773	80%	0.797	S	S	*	*			cis	-157.9	163.8	-27	-138.4	-89.1	0	0	0	108.6
558	V	30.5	Very low	28.9	Very low	137 Å²	137	145.6 Å²	145.6	83%	0.83	78%	0.781	S	S	*	*			trans	-114	140.6	-172.2	173	0	0	0	0	112.8
559	A	27.1	Very low	28.8	Very low	102 Å²	102	147.7 Å²	147.7	84%	0.843	79%	0.786	S	S	*	*			trans	164.3	150.2	143	0	0	0	0	0	110.8
560	G	26	Very low	28.7	Very low	74 Å²	74	145.9 Å²	145.9	76%	0.763	78%	0.782	S	S	*	*			cis	176.3	174.9	-4.3	0	0	0	0	0	114.1
561	S	27.6	Very low	28.7	Very low	112 Å²	112	145.8 Å²	145.8	78%	0.783	79%	0.787	S	S	*	*			trans	-25.3	141.1	173.3	-174.4	0	0	0	0	119.4
562	T	28.5	Very low	29.3	Very low	128 Å²	128	145.4 Å²	145.4	79%	0.785	79%	0.787	S	S	*	*				-173.1	148.4	114.8	20.7	0	0	0	0	116.3
563	Q	26.4	Very low	29.4	Very low	168 Å²	168	149.6 Å²	149.6	79%	0.785	79%	0.794	S	S	*	*			trans	25.3	118.9	150.7	-72.9	178.9	-39.3	0	0	123
564	T	31.9	Very low	29.9	Very low	130 Å²	130	145 Å²	145	80%	0.798	79%	0.794	S	S	*	*				13.5	126.2	123.6	56.2	0	0	0	0	119.4
565	R	25.8	Very low	30.3	Very low	240 Å²	240	143 Å²	143	91%	0.906	79%	0.792	S	S	*	*			trans	-146	130.9	142.8	-157.2	168.1	-176.3	161.3	1.3	113.4
566	H	24.3	Very low	31.1	Very low	171 Å²	171	143.9 Å²	143.9	79%	0.792	79%	0.793	S	S	*	*			trans	-89.1	147.2	172.8	-143.5	-79.7	0	0	0	109.4
567	I	29.5	Very low	32.1	Very low	150 Å²	150	141.9 Å²	141.9	77%	0.769	79%	0.791	S	S	*	*			trans	177.3	148.2	140.8	-97	157.5	0	0	0	109.5
568	P	36.6	Very low	33.1	Very low	87 Å²	87	141.6 Å²	141.6	57%	0.565	79%	0.79	S	S	*	*			trans	-111.3	178.2	-155	41.7	-33.1	0	0	0	114.5
569	E	26.6	Very low	34.3	Very low	196 Å²	196	138.5 Å²	138.5	92%	0.916	78%	0.775	S	S	*	*			trans	-106.4	131.1	149.6	-67.9	-164.2	135.8	0	0	109.6
570	D	28.8	Very low	35.8	Very low	147 Å²	147	137 Å²	137	79%	0.786	75%	0.754	S	S	*	*			trans	-92.4	140.1	175.1	-75.8	-65.1	0	0	0	111.1
571	T	31.2	Very low	37.8	Very low	139 Å²	139	137 Å²	137	85%	0.853	74%	0.743	S	S	*	*			trans	-153.2	143	148.9	5.3	0	0	0	0	110.2
572	P	41.3	Very low	40	Very low	112 Å²	112	139 Å²	139	73%	0.727	74%	0.738	S	S	*	*			trans	-96.1	146.8	-160.5	35.8	-34.9	0	0	0	114.3
573	N	30.2	Very low	42.4	Very low	151 Å²	151	138 Å²	138	81%	0.807	73%	0.727	S	S	*	*			trans	-160.8	75.8	148.1	-110	-31.7	0	0	0	113	F575	N573-F575 PolarHBondContact O-N 3.16Å
574	G	41	Very low	45	Very low	79 Å²	79	135.1 Å²	135.1	81%	0.814	72%	0.716	S	S	*	*			trans	-79.1	71.9	-178.7	0	0	0	0	0	114.5
575	F	39.4	Very low	47.5	Very low	187 Å²	187	134.1 Å²	134.1	82%	0.82	71%	0.706	S	S	*	*			trans	-127.1	-5.2	179.8	-90.4	-73	0	0	0	117.2	N573	N573-F575 PolarHBondContact O-N 3.16Å
576	H	46.2	Very low	50.4	Low	146 Å²	146	126.9 Å²	126.9	68%	0.676	69%	0.688	S	S	*	*	S	Bend	trans	-92.9	-27.6	-170.1	-149.5	-108.5	0	0	0	116.5	Q578 S579	H576-Q578 PolarHBondContact O-N 2.91Å; H576-S579 PolarHBondContact O-N 2.92Å
577	L	47	Very low	53.4	Low	156 Å²	156	122.7 Å²	122.7	82%	0.817	67%	0.67	S	S	*	*	H	α-helix	trans	-69.7	-30.3	-170	-82.9	91.1	0	0	0	115.1	S579 S581	L577-S579 VanDerWaalsContact C-N 3.28Å; L577-S579 PolarHBondContact O-N 3.5Å; L577-S581 PolarHBondContact O-N 3.11Å
578	Q	49.9	Very low	56.1	Low	161 Å²	161	118.7 Å²	118.7	75%	0.752	66%	0.656	S	S	*	*	H	α-helix	trans	-69.6	-25.1	179.9	-73.5	-171.6	-8.2	0	0	113.2	H576 K582	H576-Q578 PolarHBondContact O-N 2.91Å; Q578-K582 PolarHBondContact O-N 3.23Å
579	S	54.6	Low	58.6	Low	73 Å²	73	117.7 Å²	117.7	51%	0.51	65%	0.65	S	S	.	*	H	α-helix	trans	-65.4	-49.8	176.5	-176.2	0	0	0	0	111.3	H576 L577 S581 K582 L583	H576-S579 PolarHBondContact O-N 2.92Å; L577-S579 VanDerWaalsContact C-N 3.28Å; L577-S579 PolarHBondContact O-N 3.5Å; S579-S581 VanDerWaalsContact C-N 3.31Å; S579-S581 PolarHBondContact O-N 2.84Å; S579-K582 PolarHBondContact O-N 3.46Å; S579-K582 VanDerWaalsContact O-N 3.17Å; S579-L583 PolarHBondContact O-N 3.5Å
580	V	58.4	Low	61.7	Low	69 Å²	69	112 Å²	112	42%	0.418	63%	0.629	S	S	.	*	H	α-helix	trans	-60.5	-40.5	-178.3	-174.8	0	0	0	0	111.6	K582 L583 L584	V580-K582 PolarHBondContact O-N 2.93Å; V580-L583 PolarHBondContact O-N 3.31Å; V580-L584 HydrophobicContact CG1-CD1 4.02Å; V580-L584 HydrophobicContact CG1-CG 4.38Å; V580-L584 WeakPolarHBondContact O-CG 3.4Å; V580-L584 PolarHBondContact O-N 3.27Å
581	S	69.2	Low	64.6	Low	75 Å²	75	109.9 Å²	109.9	52%	0.524	62%	0.617	S	S	.	*	H	α-helix	trans	-59.7	-44.9	176.7	-177.1	0	0	0	0	112.4	L577 S579 L585	L577-S581 PolarHBondContact O-N 3.11Å; S579-S581 VanDerWaalsContact C-N 3.31Å; S579-S581 PolarHBondContact O-N 2.84Å; S581-L585 WeakPolarHBondContact O-CB 3.22Å; S581-L585 PolarHBondContact O-N 2.74Å; S581-L585 VanDerWaalsContact O-N 3.09Å
582	K	72.7	Confident	67.6	Low	155 Å²	155	107.2 Å²	107.2	67%	0.674	60%	0.6	S	S	*	*	H	α-helix	trans	-65.8	-41.1	176.5	-69.8	-175.7	-179.8	-179.1	0	112.2	Q578 S579 V580 L585 V586	Q578-K582 PolarHBondContact O-N 3.23Å; S579-K582 PolarHBondContact O-N 3.46Å; S579-K582 VanDerWaalsContact O-N 3.17Å; V580-K582 PolarHBondContact O-N 2.93Å; K582-L585 PolarHBondContact O-N 2.76Å; K582-V586 WeakPolarHBondContact O-CG2 3.43Å; K582-V586 PolarHBondContact O-N 2.95Å
583	L	78.9	Confident	70	Confident	105 Å²	105	106.8 Å²	106.8	55%	0.55	59%	0.591	S	S	.	*	H	α-helix	trans	-62	-45.5	178	-178.1	62.3	0	0	0	111.8	S579 V580 L585 V586 I587	S579-L583 PolarHBondContact O-N 3.5Å; V580-L583 PolarHBondContact O-N 3.31Å; L583-L585 VanDerWaalsContact C-N 3.32Å; L583-L585 PolarHBondContact O-N 3.25Å; L583-V586 PolarHBondContact O-N 2.76Å; L583-I587 HydrophobicContact CD1-CD1 4.25Å; L583-I587 HydrophobicContact CG-CD1 3.98Å; L583-I587 VanDerWaalsContact O-CG1 3.32Å; L583-I587 WeakPolarHBondContact O-CG1 3.26Å; L583-I587 PolarHBondContact O-N 2.9Å
584	L	82.3	Confident	72.8	Confident	108 Å²	108	103.8 Å²	103.8	57%	0.565	58%	0.575	S	S	*	*	H	α-helix	trans	-63.5	-36.5	176.4	-70.6	171.9	0	0	0	112.4	V580 I587 S588	V580-L584 HydrophobicContact CG1-CD1 4.02Å; V580-L584 HydrophobicContact CG1-CG 4.38Å; V580-L584 WeakPolarHBondContact O-CG 3.4Å; V580-L584 PolarHBondContact O-N 3.27Å; L584-I587 PolarHBondContact O-N 3.17Å; L584-S588 WeakPolarHBondContact O-CB 3.49Å; L584-S588 PolarHBondContact O-N 2.81Å
585	L	84.3	Confident	75.3	Confident	110 Å²	110	104.3 Å²	104.3	58%	0.576	56%	0.562	S	S	*	*	H	α-helix	trans	-66.4	-42.6	176	-148.2	168.6	0	0	0	111.1	S581 K582 L583 S588 C589	S581-L585 WeakPolarHBondContact O-CB 3.22Å; S581-L585 PolarHBondContact O-N 2.74Å; S581-L585 VanDerWaalsContact O-N 3.09Å; K582-L585 PolarHBondContact O-N 2.76Å; L583-L585 VanDerWaalsContact C-N 3.32Å; L583-L585 PolarHBondContact O-N 3.25Å; L585-S588 WeakPolarHBondContact O-CB 3.29Å; L585-S588 PolarHBondContact O-N 3.17Å; L585-C589 PolarHBondContact O-N 2.73Å
586	V	85.8	Confident	77.8	Confident	88 Å²	88	100.2 Å²	100.2	53%	0.533	55%	0.547	S	S	.	.	H	α-helix	trans	-61.4	-46.1	173.3	171.2	0	0	0	0	111.5	K582 L583 S588 C589 V590	K582-V586 WeakPolarHBondContact O-CG2 3.43Å; K582-V586 PolarHBondContact O-N 2.95Å; L583-V586 PolarHBondContact O-N 2.76Å; V586-S588 VanDerWaalsContact C-N 3.31Å; V586-S588 PolarHBondContact O-N 3.02Å; V586-C589 PolarHBondContact O-N 2.92Å; V586-V590 WeakPolarHBondContact O-CG2 3.47Å; V586-V590 PolarHBondContact O-N 2.84Å
587	I	86.9	Confident	79.8	Confident	82 Å²	82	97.9 Å²	97.9	42%	0.421	54%	0.539	S	S	.	.	H	α-helix	trans	-61	-41.4	177.1	-68.3	164.9	0	0	0	110.9	L583 L584 V590 L591	L583-I587 HydrophobicContact CD1-CD1 4.25Å; L583-I587 HydrophobicContact CG-CD1 3.98Å; L583-I587 VanDerWaalsContact O-CG1 3.32Å; L583-I587 WeakPolarHBondContact O-CG1 3.26Å; L583-I587 PolarHBondContact O-N 2.9Å; L584-I587 PolarHBondContact O-N 3.17Å; I587-V590 PolarHBondContact O-N 2.85Å; I587-L591 HydrophobicContact CG2-CD1 4.09Å; I587-L591 WeakPolarHBondContact O-CG 3.4Å; I587-L591 PolarHBondContact O-N 2.86Å
588	S	87.9	Confident	81.6	Confident	66 Å²	66	95.1 Å²	95.1	46%	0.462	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-45.6	175.1	-172	0	0	0	0	112	L584 L585 V586 V590 L591 V592	L584-S588 WeakPolarHBondContact O-CB 3.49Å; L584-S588 PolarHBondContact O-N 2.81Å; L585-S588 WeakPolarHBondContact O-CB 3.29Å; L585-S588 PolarHBondContact O-N 3.17Å; V586-S588 VanDerWaalsContact C-N 3.31Å; V586-S588 PolarHBondContact O-N 3.02Å; S588-V590 PolarHBondContact O-N 2.79Å; S588-L591 PolarHBondContact O-N 2.97Å; S588-V592 WeakPolarHBondContact O-CG2 3.38Å; S588-V592 PolarHBondContact O-N 2.85Å
589	C	88.9	Confident	83.5	Confident	66 Å²	66	93.5 Å²	93.5	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-61.1	-40.9	174.2	-75.8	0	0	0	0	112.7	L585 V586 V592 L593	L585-C589 PolarHBondContact O-N 2.73Å; V586-C589 PolarHBondContact O-N 2.92Å; C589-V592 PolarHBondContact O-N 3.11Å; C589-L593 WeakPolarHBondContact O-CB 3.21Å; C589-L593 VanDerWaalsContact O-CG 3.29Å; C589-L593 WeakPolarHBondContact O-CG 3.46Å; C589-L593 PolarHBondContact O-N 3.05Å
590	V	90.7	Very high	85	Confident	78 Å²	78	94.9 Å²	94.9	47%	0.473	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-39.8	176.1	171.2	0	0	0	0	111.5	V586 I587 S588 L593 L594	V586-V590 WeakPolarHBondContact O-CG2 3.47Å; V586-V590 PolarHBondContact O-N 2.84Å; I587-V590 PolarHBondContact O-N 2.85Å; S588-V590 PolarHBondContact O-N 2.79Å; V590-L593 PolarHBondContact O-N 2.9Å; V590-L594 HydrophobicContact CG1-CD1 4.35Å; V590-L594 WeakPolarHBondContact O-CB 3.12Å; V590-L594 PolarHBondContact O-N 2.79Å
591	L	89.4	Confident	86.3	Confident	102 Å²	102	97.3 Å²	97.3	53%	0.534	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-43.6	174.2	-78.9	165	0	0	0	112.2	I587 S588 L594 V595	I587-L591 HydrophobicContact CG2-CD1 4.09Å; I587-L591 WeakPolarHBondContact O-CG 3.4Å; I587-L591 PolarHBondContact O-N 2.86Å; S588-L591 PolarHBondContact O-N 2.97Å; L591-L594 WeakPolarHBondContact O-CB 3.42Å; L591-L594 PolarHBondContact O-N 3.5Å; L591-V595 WeakPolarHBondContact O-CG2 3.4Å; L591-V595 PolarHBondContact O-N 2.68Å
592	V	93.9	Very high	87.1	Confident	82 Å²	82	100.4 Å²	100.4	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-63.3	-42.4	175.4	170.8	0	0	0	0	111.2	S588 C589 L594 V595 I596	S588-V592 WeakPolarHBondContact O-CG2 3.38Å; S588-V592 PolarHBondContact O-N 2.85Å; C589-V592 PolarHBondContact O-N 3.11Å; V592-L594 VanDerWaalsContact C-N 3.34Å; V592-L594 PolarHBondContact O-N 2.82Å; V592-V595 PolarHBondContact O-N 3.01Å; V592-I596 HydrophobicContact CG1-CD1 3.82Å; V592-I596 HydrophobicContact CG1-CG1 4.49Å; V592-I596 VanDerWaalsContact O-CG1 3.3Å; V592-I596 WeakPolarHBondContact O-CG1 3.29Å; V592-I596 PolarHBondContact O-N 3.48Å
593	L	92.2	Very high	87.9	Confident	103 Å²	103	99.4 Å²	99.4	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-62.4	-39.4	173.6	-73.4	169.1	0	0	0	112.1	C589 V590 I596 L597	C589-L593 WeakPolarHBondContact O-CB 3.21Å; C589-L593 VanDerWaalsContact O-CG 3.29Å; C589-L593 WeakPolarHBondContact O-CG 3.46Å; C589-L593 PolarHBondContact O-N 3.05Å; V590-L593 PolarHBondContact O-N 2.9Å; L593-I596 PolarHBondContact O-N 2.94Å; L593-L597 WeakPolarHBondContact O-CB 3.36Å; L593-L597 VanDerWaalsContact O-CG 3.28Å; L593-L597 WeakPolarHBondContact O-CG 3.43Å; L593-L597 PolarHBondContact O-N 3.37Å
594	L	88.8	Confident	88.2	Confident	89 Å²	89	101.4 Å²	101.4	47%	0.466	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-41.1	173	-95.1	163.1	0	0	0	112.4	V590 L591 V592 L597 N598	V590-L594 HydrophobicContact CG1-CD1 4.35Å; V590-L594 WeakPolarHBondContact O-CB 3.12Å; V590-L594 PolarHBondContact O-N 2.79Å; L591-L594 WeakPolarHBondContact O-CB 3.42Å; L591-L594 PolarHBondContact O-N 3.5Å; V592-L594 VanDerWaalsContact C-N 3.34Å; V592-L594 PolarHBondContact O-N 2.82Å; L594-L597 PolarHBondContact O-N 3.08Å; L594-N598 WeakPolarHBondContact O-CB 3.33Å; L594-N598 PolarHBondContact O-N 2.72Å; L594-N598 PolarHBondContact O-ND2 3.34Å
595	V	94	Very high	88.3	Confident	90 Å²	90	101.4 Å²	101.4	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-43.1	175.1	171.6	0	0	0	0	111.1	L591 V592 N598 M599	L591-V595 WeakPolarHBondContact O-CG2 3.4Å; L591-V595 PolarHBondContact O-N 2.68Å; V592-V595 PolarHBondContact O-N 3.01Å; V595-N598 PolarHBondContact O-N 3.34Å; V595-M599 WeakPolarHBondContact O-CB 3.45Å; V595-M599 WeakPolarHBondContact O-CG 3.15Å; V595-M599 PolarHBondContact O-N 3.48Å
596	I	92.3	Very high	88.3	Confident	100 Å²	100	102.7 Å²	102.7	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-62.8	-43.4	176	-68.6	165.7	0	0	0	111	V592 L593 M599 M600	V592-I596 HydrophobicContact CG1-CD1 3.82Å; V592-I596 HydrophobicContact CG1-CG1 4.49Å; V592-I596 VanDerWaalsContact O-CG1 3.3Å; V592-I596 WeakPolarHBondContact O-CG1 3.29Å; V592-I596 PolarHBondContact O-N 3.48Å; L593-I596 PolarHBondContact O-N 2.94Å; I596-M599 PolarHBondContact O-N 2.91Å; I596-M600 WeakPolarHBondContact O-CB 3.48Å; I596-M600 PolarHBondContact O-N 2.93Å
597	L	88.4	Confident	88.1	Confident	98 Å²	98	102 Å²	102	51%	0.513	52%	0.52	S	S	.	.	H	α-helix	trans	-64.8	-41.2	176.7	-76.3	168.9	0	0	0	112	L593 L594 M600 L601	L593-L597 WeakPolarHBondContact O-CB 3.36Å; L593-L597 VanDerWaalsContact O-CG 3.28Å; L593-L597 WeakPolarHBondContact O-CG 3.43Å; L593-L597 PolarHBondContact O-N 3.37Å; L594-L597 PolarHBondContact O-N 3.08Å; L597-M600 HydrophobicContact CD2-CE 4.11Å; L597-M600 PolarHBondContact O-N 2.95Å; L597-L601 WeakPolarHBondContact O-CB 3.15Å; L597-L601 PolarHBondContact O-N 2.97Å
598	N	83.3	Confident	87.6	Confident	97 Å²	97	103.4 Å²	103.4	52%	0.519	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-40.3	174.6	-82.5	-78.8	0	0	0	111.9	L594 V595 L601 F602	L594-N598 WeakPolarHBondContact O-CB 3.33Å; L594-N598 PolarHBondContact O-N 2.72Å; L594-N598 PolarHBondContact O-ND2 3.34Å; V595-N598 PolarHBondContact O-N 3.34Å; N598-L601 PolarHBondContact O-N 3.09Å; N598-F602 WeakPolarHBondContact O-CB 3.45Å; N598-F602 PolarHBondContact O-N 2.99Å
599	M	90.5	Very high	87	Confident	128 Å²	128	104.9 Å²	104.9	63%	0.631	53%	0.527	S	S	*	.	H	α-helix	trans	-64.1	-39.4	173	-77.8	-68.6	-178.9	0	0	112.2	V595 I596 F602 Y603	V595-M599 WeakPolarHBondContact O-CB 3.45Å; V595-M599 WeakPolarHBondContact O-CG 3.15Å; V595-M599 PolarHBondContact O-N 3.48Å; I596-M599 PolarHBondContact O-N 2.91Å; M599-F602 PolarHBondContact O-N 2.66Å; M599-Y603 WeakPolarHBondContact O-CB 3.21Å; M599-Y603 PolarHBondContact O-N 3.1Å
600	M	86.6	Confident	86.5	Confident	102 Å²	102	108.1 Å²	108.1	50%	0.502	53%	0.531	S	S	.	.	H	α-helix	trans	-66.6	-37.9	173.8	-170.5	-170.6	71.5	0	0	111.7	I596 L597 K604	I596-M600 WeakPolarHBondContact O-CB 3.48Å; I596-M600 PolarHBondContact O-N 2.93Å; L597-M600 HydrophobicContact CD2-CE 4.11Å; L597-M600 PolarHBondContact O-N 2.95Å; M600-K604 WeakPolarHBondContact O-CB 3.46Å; M600-K604 WeakPolarHBondContact O-CG 3.44Å; M600-K604 PolarHBondContact O-N 2.9Å
601	L	84.6	Confident	85.5	Confident	120 Å²	120	107.7 Å²	107.7	63%	0.628	53%	0.529	S	S	*	.	H	α-helix	trans	-66.6	-42.3	175.7	-153	86.7	0	0	0	111.1	L597 N598 K604 L605	L597-L601 WeakPolarHBondContact O-CB 3.15Å; L597-L601 PolarHBondContact O-N 2.97Å; N598-L601 PolarHBondContact O-N 3.09Å; L601-K604 WeakPolarHBondContact O-CB 3.34Å; L601-K604 PolarHBondContact O-N 3.38Å; L601-L605 WeakPolarHBondContact O-CB 3.22Å; L601-L605 PolarHBondContact O-N 2.89Å
602	F	87.8	Confident	84.1	Confident	140 Å²	140	106.3 Å²	106.3	61%	0.614	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-43.9	174.9	-173.1	-94.5	0	0	0	111.5	N598 M599 K604 L605 W606	N598-F602 WeakPolarHBondContact O-CB 3.45Å; N598-F602 PolarHBondContact O-N 2.99Å; M599-F602 PolarHBondContact O-N 2.66Å; F602-K604 PolarHBondContact O-N 3.48Å; F602-L605 PolarHBondContact O-N 3.34Å; F602-W606 WeakPolarHBondContact O-CB 3.37Å; F602-W606 PolarHBondContact O-N 3.11Å
603	Y	89.6	Confident	82.6	Confident	134 Å²	134	107.4 Å²	107.4	53%	0.525	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-39.8	173.5	-179.8	-99.3	0	0	0	112.3	M599 W606 M607	M599-Y603 WeakPolarHBondContact O-CB 3.21Å; M599-Y603 PolarHBondContact O-N 3.1Å; Y603-W606 HydrophobicContact CD2-CE3 4.12Å; Y603-W606 HydrophobicContact CD2-CZ3 4.47Å; Y603-W606 HydrophobicContact CE2-CE3 4.13Å; Y603-W606 HydrophobicContact CE2-CZ3 4.09Å; Y603-W606 PolarHBondContact O-N 2.76Å; Y603-M607 HydrophobicContact CD1-CG 4.23Å; Y603-M607 HydrophobicContact CE1-CG 3.76Å; Y603-M607 HydrophobicContact CE2-CG 4.15Å; Y603-M607 VanDerWaalsContact O-CB 3.29Å; Y603-M607 WeakPolarHBondContact O-CB 3.46Å; Y603-M607 WeakPolarHBondContact O-CG 3.39Å; Y603-M607 PolarHBondContact O-N 3.39Å
604	K	84.5	Confident	80.9	Confident	146 Å²	146	105.1 Å²	105.1	64%	0.635	51%	0.514	S	S	*	.	H	α-helix	trans	-61.3	-42.8	171.9	-84.3	-80	-173.8	173.5	0	111.8	M600 L601 F602 L608	M600-K604 WeakPolarHBondContact O-CB 3.46Å; M600-K604 WeakPolarHBondContact O-CG 3.44Å; M600-K604 PolarHBondContact O-N 2.9Å; L601-K604 WeakPolarHBondContact O-CB 3.34Å; L601-K604 PolarHBondContact O-N 3.38Å; F602-K604 PolarHBondContact O-N 3.48Å; K604-L608 WeakPolarHBondContact O-CB 3.32Å; K604-L608 PolarHBondContact O-N 3.41Å
605	L	83.9	Confident	79.2	Confident	108 Å²	108	105.5 Å²	105.5	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-45.8	178	-166.7	73.8	0	0	0	111.2	L601 F602 L608 E609	L601-L605 WeakPolarHBondContact O-CB 3.22Å; L601-L605 PolarHBondContact O-N 2.89Å; F602-L605 PolarHBondContact O-N 3.34Å; L605-L608 WeakPolarHBondContact O-CB 3.35Å; L605-L608 PolarHBondContact O-N 3.04Å; L605-L608 VanDerWaalsContact O-N 3.16Å; L605-E609 WeakPolarHBondContact O-CB 3.29Å; L605-E609 PolarHBondContact O-N 3.3Å
606	W	84.9	Confident	77.3	Confident	138 Å²	138	105.1 Å²	105.1	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-40.3	177.4	-178	69.1	0	0	0	112.5	F602 Y603 L608 E609 Y610	F602-W606 WeakPolarHBondContact O-CB 3.37Å; F602-W606 PolarHBondContact O-N 3.11Å; Y603-W606 HydrophobicContact CD2-CE3 4.12Å; Y603-W606 HydrophobicContact CD2-CZ3 4.47Å; Y603-W606 HydrophobicContact CE2-CE3 4.13Å; Y603-W606 HydrophobicContact CE2-CZ3 4.09Å; Y603-W606 PolarHBondContact O-N 2.76Å; W606-L608 VanDerWaalsContact C-N 3.35Å; W606-E609 PolarHBondContact O-N 3.18Å; W606-Y610 WeakPolarHBondContact O-CB 3.31Å; W606-Y610 PolarHBondContact O-N 2.83Å
607	M	80.8	Confident	75.4	Confident	74 Å²	74	103.2 Å²	103.2	37%	0.365	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-37.6	170.7	-82.2	-69.3	-60.7	0	0	112.4	Y603 T611	Y603-M607 HydrophobicContact CD1-CG 4.23Å; Y603-M607 HydrophobicContact CE1-CG 3.76Å; Y603-M607 HydrophobicContact CE2-CG 4.15Å; Y603-M607 VanDerWaalsContact O-CB 3.29Å; Y603-M607 WeakPolarHBondContact O-CB 3.46Å; Y603-M607 WeakPolarHBondContact O-CG 3.39Å; Y603-M607 PolarHBondContact O-N 3.39Å; M607-T611 WeakPolarHBondContact O-CB 3.48Å; M607-T611 PolarHBondContact O-N 2.91Å; M607-T611 PolarHBondContact O-OG1 2.97Å
608	L	75.7	Confident	73.5	Confident	110 Å²	110	107 Å²	107	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-66	-43.6	174.8	-166.1	78.2	0	0	0	110.7	K604 L605 W606 T611 T612	K604-L608 WeakPolarHBondContact O-CB 3.32Å; K604-L608 PolarHBondContact O-N 3.41Å; L605-L608 WeakPolarHBondContact O-CB 3.35Å; L605-L608 PolarHBondContact O-N 3.04Å; L605-L608 VanDerWaalsContact O-N 3.16Å; W606-L608 VanDerWaalsContact C-N 3.35Å; L608-T611 CarbonylContact O-C 3.56Å; L608-T611 WeakPolarHBondContact O-CB 3.43Å; L608-T611 PolarHBondContact O-N 3.12Å; L608-T612 PolarHBondContact O-N 2.95Å; L608-T612 PolarHBondContact O-OG1 2.91Å
609	E	76.7	Confident	71.9	Confident	97 Å²	97	108.2 Å²	108.2	45%	0.453	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-44.9	177.5	-163.7	-170.8	161	0	0	111.8	L605 W606 T611 T612 Q613	L605-E609 WeakPolarHBondContact O-CB 3.29Å; L605-E609 PolarHBondContact O-N 3.3Å; W606-E609 PolarHBondContact O-N 3.18Å; E609-T611 PolarHBondContact O-N 3.4Å; E609-T612 WeakPolarHBondContact CA-OG1 3.49Å; E609-T612 PolarHBondContact O-N 3.03Å; E609-T612 PolarHBondContact O-OG1 2.86Å; E609-T612 VanDerWaalsContact O-OG1 3.13Å; E609-Q613 HydrophobicContact CG-CG 4.47Å; E609-Q613 VanDerWaalsContact O-CB 3.32Å; E609-Q613 WeakPolarHBondContact O-CB 3.25Å; E609-Q613 VanDerWaalsContact O-CG 3.24Å; E609-Q613 WeakPolarHBondContact O-CG 3.28Å; E609-Q613 PolarHBondContact O-N 2.92Å; E609-Q613 PolarHBondContact OE1-NE2 2.9Å
610	Y	76.9	Confident	69.7	Low	134 Å²	134	104.6 Å²	104.6	53%	0.525	52%	0.519	S	S	.	.	H	α-helix	trans	-58.9	-38.1	171.8	-178.6	-99.9	0	0	0	111.8	W606 T614	W606-Y610 WeakPolarHBondContact O-CB 3.31Å; W606-Y610 PolarHBondContact O-N 2.83Å; Y610-T614 HydrophobicContact CE1-CG2 4.46Å; Y610-T614 PolarHBondContact O-N 2.85Å; Y610-T614 PolarHBondContact O-OG1 3.26Å
611	T	71.8	Confident	67.7	Low	70 Å²	70	105.6 Å²	105.6	43%	0.429	53%	0.526	S	S	.	.	H	α-helix	trans	-68.6	-41.7	176.2	-53.8	0	0	0	0	111.7	M607 L608 E609 T614 L615	M607-T611 WeakPolarHBondContact O-CB 3.48Å; M607-T611 PolarHBondContact O-N 2.91Å; M607-T611 PolarHBondContact O-OG1 2.97Å; L608-T611 CarbonylContact O-C 3.56Å; L608-T611 WeakPolarHBondContact O-CB 3.43Å; L608-T611 PolarHBondContact O-N 3.12Å; E609-T611 PolarHBondContact O-N 3.4Å; T611-T614 PolarHBondContact O-OG1 2.97Å; T611-L615 WeakPolarHBondContact O-CB 3.35Å; T611-L615 PolarHBondContact O-N 2.84Å
612	T	59.4	Low	65.9	Low	73 Å²	73	108.7 Å²	108.7	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-75.3	-29.4	176	50.6	0	0	0	0	113.3	L608 E609 L615 T616	L608-T612 PolarHBondContact O-N 2.95Å; L608-T612 PolarHBondContact O-OG1 2.91Å; E609-T612 WeakPolarHBondContact CA-OG1 3.49Å; E609-T612 PolarHBondContact O-N 3.03Å; E609-T612 PolarHBondContact O-OG1 2.86Å; E609-T612 VanDerWaalsContact O-OG1 3.13Å; T612-L615 PolarHBondContact O-N 2.97Å; T612-T616 WeakPolarHBondContact O-CB 3.31Å; T612-T616 PolarHBondContact O-N 3.07Å; T612-T616 PolarHBondContact O-OG1 2.73Å
613	Q	61.1	Low	63.7	Low	105 Å²	105	108.9 Å²	108.9	49%	0.491	54%	0.536	S	S	.	.	H	α-helix	trans	-65.1	-43.1	171.2	-75.3	179.1	16.9	0	0	111.2	E609 T616 A617	E609-Q613 HydrophobicContact CG-CG 4.47Å; E609-Q613 VanDerWaalsContact O-CB 3.32Å; E609-Q613 WeakPolarHBondContact O-CB 3.25Å; E609-Q613 VanDerWaalsContact O-CG 3.24Å; E609-Q613 WeakPolarHBondContact O-CG 3.28Å; E609-Q613 PolarHBondContact O-N 2.92Å; E609-Q613 PolarHBondContact OE1-NE2 2.9Å; Q613-T616 WeakPolarHBondContact CA-OG1 3.15Å; Q613-T616 PolarHBondContact O-OG1 2.84Å; Q613-A617 WeakPolarHBondContact O-CB 3.4Å; Q613-A617 PolarHBondContact O-N 3Å
614	T	57.5	Low	61.5	Low	55 Å²	55	110.3 Å²	110.3	34%	0.337	55%	0.547	S	S	.	.	H	α-helix	trans	-64.7	-44.3	171.7	52.3	0	0	0	0	111.4	Y610 T611 T616 A617 W618	Y610-T614 HydrophobicContact CE1-CG2 4.46Å; Y610-T614 PolarHBondContact O-N 2.85Å; Y610-T614 PolarHBondContact O-OG1 3.26Å; T611-T614 PolarHBondContact O-OG1 2.97Å; T614-T616 VanDerWaalsContact C-N 3.34Å; T614-T616 PolarHBondContact O-N 2.95Å; T614-A617 WeakPolarHBondContact O-CB 3.38Å; T614-A617 PolarHBondContact O-N 2.8Å; T614-A617 VanDerWaalsContact O-N 3.17Å; T614-W618 PolarHBondContact O-N 2.91Å
615	L	52.3	Low	59.6	Low	97 Å²	97	112.7 Å²	112.7	51%	0.508	56%	0.561	S	S	.	*	H	α-helix	trans	-63.2	-36	-179.9	-145.2	155	0	0	0	112.8	T611 T612 W618 Q619	T611-L615 WeakPolarHBondContact O-CB 3.35Å; T611-L615 PolarHBondContact O-N 2.84Å; T612-L615 PolarHBondContact O-N 2.97Å; L615-W618 PolarHBondContact O-N 2.89Å; L615-Q619 WeakPolarHBondContact O-CG 3.39Å; L615-Q619 PolarHBondContact O-N 2.71Å
616	T	54.3	Low	58.1	Low	81 Å²	81	117.3 Å²	117.3	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-75	-32.1	173.2	45.4	0	0	0	0	113	T612 Q613 T614 W618 Q619 G620	T612-T616 WeakPolarHBondContact O-CB 3.31Å; T612-T616 PolarHBondContact O-N 3.07Å; T612-T616 PolarHBondContact O-OG1 2.73Å; Q613-T616 WeakPolarHBondContact CA-OG1 3.15Å; Q613-T616 PolarHBondContact O-OG1 2.84Å; T614-T616 VanDerWaalsContact C-N 3.34Å; T614-T616 PolarHBondContact O-N 2.95Å; T616-W618 VanDerWaalsContact C-N 3.34Å; T616-Q619 PolarHBondContact O-N 2.8Å; T616-G620 PolarHBondContact O-N 2.9Å
617	A	53.2	Low	56.5	Low	60 Å²	60	117.4 Å²	117.4	50%	0.496	58%	0.581	S	S	.	*	H	α-helix	trans	-62.6	-40.4	168.7	0	0	0	0	0	111.9	Q613 T614 G620 L621	Q613-A617 WeakPolarHBondContact O-CB 3.4Å; Q613-A617 PolarHBondContact O-N 3Å; T614-A617 WeakPolarHBondContact O-CB 3.38Å; T614-A617 PolarHBondContact O-N 2.8Å; T614-A617 VanDerWaalsContact O-N 3.17Å; A617-G620 PolarHBondContact O-N 2.82Å; A617-L621 PolarHBondContact O-N 2.91Å; A617-L621 VanDerWaalsContact O-N 3.12Å
618	W	49.2	Very low	55.4	Low	177 Å²	177	115.2 Å²	115.2	67%	0.67	57%	0.572	S	S	*	*	H	α-helix	trans	-65.5	-34.3	172.8	-74.8	111.3	0	0	0	113.1	T614 L615 T616	T614-W618 PolarHBondContact O-N 2.91Å; L615-W618 PolarHBondContact O-N 2.89Å; T616-W618 VanDerWaalsContact C-N 3.34Å
619	Q	48.9	Very low	54.8	Low	123 Å²	123	118.4 Å²	118.4	58%	0.575	58%	0.584	S	S	*	*	H	α-helix	trans	-70.2	-35.7	171.4	-73.8	176.7	-29.9	0	0	112.3	L615 T616 L621 R622	L615-Q619 WeakPolarHBondContact O-CG 3.39Å; L615-Q619 PolarHBondContact O-N 2.71Å; T616-Q619 PolarHBondContact O-N 2.8Å; Q619-L621 VanDerWaalsContact C-N 3.34Å; Q619-L621 PolarHBondContact O-N 2.65Å; Q619-R622 VanDerWaalsContact O-CB 3.25Å; Q619-R622 WeakPolarHBondContact O-CB 3.49Å; Q619-R622 PolarHBondContact O-N 3.14Å
620	G	44.7	Very low	54.8	Low	52 Å²	52	115.8 Å²	115.8	54%	0.536	58%	0.576	S	S	.	*	H	α-helix	trans	-60.8	-39.7	173.8	0	0	0	0	0	113	T616 A617 R622 L623	T616-G620 PolarHBondContact O-N 2.9Å; A617-G620 PolarHBondContact O-N 2.82Å; G620-R622 PolarHBondContact O-N 2.74Å; G620-R622 VanDerWaalsContact O-N 3.14Å; G620-L623 PolarHBondContact O-N 2.78Å
621	L	42.9	Very low	54.6	Low	124 Å²	124	117.8 Å²	117.8	65%	0.649	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-11.3	172.4	-101.7	119.7	0	0	0	114.3	A617 Q619 L623	A617-L621 PolarHBondContact O-N 2.91Å; A617-L621 VanDerWaalsContact O-N 3.12Å; Q619-L621 VanDerWaalsContact C-N 3.34Å; Q619-L621 PolarHBondContact O-N 2.65Å; L621-L623 VanDerWaalsContact C-N 3.31Å
622	R	47.3	Very low	54.8	Low	185 Å²	185	119.1 Å²	119.1	70%	0.698	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-3.6	177.8	-142.5	179.5	-171.5	-161.7	0.3	113.7	Q619 G620	Q619-R622 VanDerWaalsContact O-CB 3.25Å; Q619-R622 WeakPolarHBondContact O-CB 3.49Å; Q619-R622 PolarHBondContact O-N 3.14Å; G620-R622 PolarHBondContact O-N 2.74Å; G620-R622 VanDerWaalsContact O-N 3.14Å
623	L	41.6	Very low	55.5	Low	143 Å²	143	119.9 Å²	119.9	75%	0.749	60%	0.597	S	S	*	*			trans	-113.4	49.1	178.8	-153.9	86	0	0	0	112.7	G620 L621 E625	G620-L623 PolarHBondContact O-N 2.78Å; L621-L623 VanDerWaalsContact C-N 3.31Å; L623-E625 PolarHBondContact O-N 2.82Å
624	Q	44.2	Very low	56	Low	165 Å²	165	120.4 Å²	120.4	77%	0.771	60%	0.595	S	S	*	*			trans	-69	117.8	172.4	-171	156.2	-45	0	0	109.8	R626	Q624-R626 PolarHBondContact O-N 3.45Å
625	E	43.3	Very low	57	Low	195 Å²	195	120.5 Å²	120.5	91%	0.911	60%	0.601	S	S	*	*	S	Bend	trans	-70.6	30.1	-163.5	-58.4	-173.3	121	0	0	116.4	L623	L623-E625 PolarHBondContact O-N 2.82Å
626	R	54.3	Low	58.2	Low	205 Å²	205	122.4 Å²	122.4	77%	0.774	61%	0.607	S	S	*	*			trans	-136.1	104.1	-179.2	-150.1	171.9	-169.5	161.2	2.6	110.9	Q624	Q624-R626 PolarHBondContact O-N 3.45Å
627	L	51.3	Low	59.2	Low	140 Å²	140	121.8 Å²	121.8	73%	0.733	60%	0.601	S	S	*	*			trans	-59.2	135.1	168.6	-90.9	71.7	0	0	0	109.1	Q629	L627-Q629 PolarHBondContact O-N 3.14Å
628	P	57.8	Low	60.3	Low	29 Å²	29	123.9 Å²	123.9	19%	0.188	60%	0.603	C	S	.	*			trans	-61.2	133.4	174.6	-16.5	27	0	0	0	111	E633 W634 L637	P628-E633 HydrophobicContact CB-CB 3.68Å; P628-W634 HydrophobicContact CB-CD2 4.16Å; P628-W634 HydrophobicContact CB-CG 4.08Å; P628-W634 HydrophobicContact CG-CD2 4.02Å; P628-W634 HydrophobicContact CG-CE3 4.41Å; P628-W634 HydrophobicContact CG-CG 4.4Å; P628-W634 HydrophobicContact CG-CZ2 4.15Å; P628-W634 PolarHBondContact O-NE1 3.42Å; P628-L637 HydrophobicContact CG-CD2 3.91Å
629	Q	62.5	Low	61.7	Low	177 Å²	177	120.3 Å²	120.3	83%	0.827	59%	0.594	S	S	*	*			trans	-100.4	-12.7	-175.2	-70.9	-171.1	-35.9	0	0	113.1	L627 E633	L627-Q629 PolarHBondContact O-N 3.14Å; Q629-E633 PolarHBondContact N-OE2 2.78Å; Q629-E633 VanDerWaalsContact N-OE2 3.09Å
630	S	76.1	Confident	62.8	Low	41 Å²	41	117.6 Å²	117.6	29%	0.287	59%	0.588	S	S	.	*	S	Bend	trans	-116.9	150	176.4	71	0	0	0	0	113	T632 E633 W634	S630-T632 PolarHBondContact O-N 2.71Å; S630-T632 PolarHBondContact OG-OG1 3.06Å; S630-T632 VanDerWaalsContact OG-OG1 3.11Å; S630-E633 WeakPolarHBondContact CB-OE2 3.49Å; S630-E633 PolarHBondContact N-OE2 2.8Å; S630-E633 PolarHBondContact O-N 3.13Å; S630-E633 WeakPolarHBondContact OG-CG 3.49Å; S630-E633 PolarHBondContact OG-N 2.95Å; S630-E633 PolarHBondContact OG-OE2 3.46Å; S630-W634 PolarHBondContact O-N 2.98Å
631	Q	72.5	Confident	64	Low	176 Å²	176	118.9 Å²	118.9	82%	0.822	58%	0.58	S	S	*	*	H	α-helix	trans	-59.7	-30.1	176.8	-173.9	177	-4.9	0	0	112.7	A635	Q631-A635 PolarHBondContact O-N 2.81Å
632	T	76	Confident	65.7	Low	98 Å²	98	119 Å²	119	60%	0.601	58%	0.577	S	S	*	*	H	α-helix	trans	-71.3	-38.3	177.1	37.1	0	0	0	0	113.3	S630 A635 Q636	S630-T632 PolarHBondContact O-N 2.71Å; S630-T632 PolarHBondContact OG-OG1 3.06Å; S630-T632 VanDerWaalsContact OG-OG1 3.11Å; T632-A635 PolarHBondContact O-N 3.05Å; T632-Q636 WeakPolarHBondContact O-CG 3.41Å; T632-Q636 PolarHBondContact O-N 3.47Å
633	E	74.2	Confident	67.2	Low	90 Å²	90	116.1 Å²	116.1	42%	0.421	57%	0.57	S	S	.	*	H	α-helix	trans	-68.7	-38.8	174	-66.7	159	134	0	0	110.9	P628 Q629 S630 A635 Q636 L637	P628-E633 HydrophobicContact CB-CB 3.68Å; Q629-E633 PolarHBondContact N-OE2 2.78Å; Q629-E633 VanDerWaalsContact N-OE2 3.09Å; S630-E633 WeakPolarHBondContact CB-OE2 3.49Å; S630-E633 PolarHBondContact N-OE2 2.8Å; S630-E633 PolarHBondContact O-N 3.13Å; S630-E633 WeakPolarHBondContact OG-CG 3.49Å; S630-E633 PolarHBondContact OG-N 2.95Å; S630-E633 PolarHBondContact OG-OE2 3.46Å; E633-A635 PolarHBondContact O-N 2.95Å; E633-Q636 PolarHBondContact O-N 2.84Å; E633-L637 WeakPolarHBondContact O-CB 3.28Å; E633-L637 PolarHBondContact O-N 3.14Å
634	W	72.8	Confident	68.8	Low	116 Å²	116	115.2 Å²	115.2	44%	0.439	56%	0.557	S	S	.	*	H	α-helix	trans	-59.9	-43.5	172.3	-83.4	105.7	0	0	0	112.3	P628 S630 L637 L638	P628-W634 HydrophobicContact CB-CD2 4.16Å; P628-W634 HydrophobicContact CB-CG 4.08Å; P628-W634 HydrophobicContact CG-CD2 4.02Å; P628-W634 HydrophobicContact CG-CE3 4.41Å; P628-W634 HydrophobicContact CG-CG 4.4Å; P628-W634 HydrophobicContact CG-CZ2 4.15Å; P628-W634 PolarHBondContact O-NE1 3.42Å; S630-W634 PolarHBondContact O-N 2.98Å; W634-L637 HydrophobicContact CE3-CD2 4.45Å; W634-L637 HydrophobicContact CZ3-CD2 4.36Å; W634-L637 PolarHBondContact O-N 2.91Å; W634-L638 WeakPolarHBondContact O-CB 3.46Å; W634-L638 VanDerWaalsContact O-CG 3.28Å; W634-L638 WeakPolarHBondContact O-CG 3.33Å; W634-L638 PolarHBondContact O-N 3.01Å
635	A	77.3	Confident	70	Confident	57 Å²	57	112.6 Å²	112.6	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-61.3	-46.3	175.8	0	0	0	0	0	112	Q631 T632 E633 L638 E639	Q631-A635 PolarHBondContact O-N 2.81Å; T632-A635 PolarHBondContact O-N 3.05Å; E633-A635 PolarHBondContact O-N 2.95Å; A635-L638 PolarHBondContact O-N 3.25Å; A635-E639 WeakPolarHBondContact O-CB 3.14Å; A635-E639 PolarHBondContact O-N 3.32Å
636	Q	77.2	Confident	71.8	Confident	137 Å²	137	107 Å²	107	64%	0.64	52%	0.522	S	S	*	.	H	α-helix	trans	-64.5	-40.2	177.5	-72.3	178.3	-9.8	0	0	112.6	T632 E633 E639 S640	T632-Q636 WeakPolarHBondContact O-CG 3.41Å; T632-Q636 PolarHBondContact O-N 3.47Å; E633-Q636 PolarHBondContact O-N 2.84Å; Q636-E639 PolarHBondContact O-N 3.28Å; Q636-S640 WeakPolarHBondContact O-CB 3.5Å; Q636-S640 PolarHBondContact O-N 3.39Å; Q636-S640 PolarHBondContact O-OG 3.43Å; Q636-S640 VanDerWaalsContact O-OG 3.1Å
637	L	76.2	Confident	73.1	Confident	68 Å²	68	100.9 Å²	100.9	36%	0.356	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.2	-177.5	61.9	0	0	0	111.5	P628 E633 W634 S640 Q641	P628-L637 HydrophobicContact CG-CD2 3.91Å; E633-L637 WeakPolarHBondContact O-CB 3.28Å; E633-L637 PolarHBondContact O-N 3.14Å; W634-L637 HydrophobicContact CE3-CD2 4.45Å; W634-L637 HydrophobicContact CZ3-CD2 4.36Å; W634-L637 PolarHBondContact O-N 2.91Å; L637-S640 PolarHBondContact O-OG 3.44Å; L637-Q641 WeakPolarHBondContact O-CG 3.45Å; L637-Q641 PolarHBondContact O-N 2.87Å
638	L	75.3	Confident	74.4	Confident	104 Å²	104	96.7 Å²	96.7	55%	0.545	48%	0.484	S	S	.	.	H	α-helix	trans	-67.2	-42.8	176.5	-69.8	169.3	0	0	0	112	W634 A635 S640 Q641 Q642	W634-L638 WeakPolarHBondContact O-CB 3.46Å; W634-L638 VanDerWaalsContact O-CG 3.28Å; W634-L638 WeakPolarHBondContact O-CG 3.33Å; W634-L638 PolarHBondContact O-N 3.01Å; A635-L638 PolarHBondContact O-N 3.25Å; L638-S640 VanDerWaalsContact C-N 3.35Å; L638-S640 PolarHBondContact O-N 2.93Å; L638-Q641 PolarHBondContact O-N 3.4Å; L638-Q642 WeakPolarHBondContact O-CB 3.2Å; L638-Q642 PolarHBondContact O-N 2.92Å
639	E	78.8	Confident	75.3	Confident	102 Å²	102	99.3 Å²	99.3	48%	0.477	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-39.8	177.2	-163.8	-166	144.8	0	0	112	A635 Q636 Q642 K643	A635-E639 WeakPolarHBondContact O-CB 3.14Å; A635-E639 PolarHBondContact O-N 3.32Å; Q636-E639 PolarHBondContact O-N 3.28Å; E639-Q642 PolarHBondContact O-N 3.18Å; E639-K643 HydrophobicContact CG-CD 4.49Å; E639-K643 WeakPolarHBondContact O-CB 3.47Å; E639-K643 WeakPolarHBondContact O-CG 3.27Å; E639-K643 PolarHBondContact O-N 3.26Å; E639-K643 WeakPolarHBondContact OE1-CE 3.34Å; E639-K643 IonicContact OE1-NZ 3.1Å; E639-K643 PolarHBondContact OE1-NZ 3.08Å
640	S	71.9	Confident	76.3	Confident	65 Å²	65	97.5 Å²	97.5	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-68.1	-38.4	174.3	64.3	0	0	0	0	112.9	Q636 L637 L638 Y644	Q636-S640 WeakPolarHBondContact O-CB 3.5Å; Q636-S640 PolarHBondContact O-N 3.39Å; Q636-S640 PolarHBondContact O-OG 3.43Å; Q636-S640 VanDerWaalsContact O-OG 3.1Å; L637-S640 PolarHBondContact O-OG 3.44Å; L638-S640 VanDerWaalsContact C-N 3.35Å; L638-S640 PolarHBondContact O-N 2.93Å; S640-Y644 WeakPolarHBondContact O-CB 3.26Å; S640-Y644 PolarHBondContact O-N 2.92Å
641	Q	71.3	Confident	76.6	Confident	79 Å²	79	100.6 Å²	100.6	37%	0.369	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-37.1	172.5	-76.3	-162.1	29.6	0	0	112.4	L637 L638 Y644 H645	L637-Q641 WeakPolarHBondContact O-CG 3.45Å; L637-Q641 PolarHBondContact O-N 2.87Å; L638-Q641 PolarHBondContact O-N 3.4Å; Q641-Y644 PolarHBondContact O-N 3.13Å; Q641-H645 PolarHBondContact O-N 2.97Å
642	Q	77.9	Confident	76.5	Confident	127 Å²	127	99.2 Å²	99.2	59%	0.593	48%	0.483	S	S	*	.	H	α-helix	trans	-65.3	-50.8	175.8	-176.3	172.3	-14.3	0	0	110.9	L638 E639 Y644 H645 D646	L638-Q642 WeakPolarHBondContact O-CB 3.2Å; L638-Q642 PolarHBondContact O-N 2.92Å; E639-Q642 PolarHBondContact O-N 3.18Å; Q642-Y644 PolarHBondContact O-N 3.04Å; Q642-H645 CarbonylContact O-C 3.5Å; Q642-H645 WeakPolarHBondContact O-CA 3.18Å; Q642-H645 WeakPolarHBondContact O-CB 3.47Å; Q642-H645 PolarHBondContact O-N 2.96Å; Q642-D646 PolarHBondContact O-N 3.43Å
643	K	79.6	Confident	76.8	Confident	124 Å²	124	102.9 Å²	102.9	54%	0.539	49%	0.485	S	S	.	.	H	α-helix	trans	-58.1	-35	174.7	-76.5	170.2	171	169.5	0	112.8	E639 T647	E639-K643 HydrophobicContact CG-CD 4.49Å; E639-K643 WeakPolarHBondContact O-CB 3.47Å; E639-K643 WeakPolarHBondContact O-CG 3.27Å; E639-K643 PolarHBondContact O-N 3.26Å; E639-K643 WeakPolarHBondContact OE1-CE 3.34Å; E639-K643 IonicContact OE1-NZ 3.1Å; E639-K643 PolarHBondContact OE1-NZ 3.08Å; K643-T647 WeakPolarHBondContact O-CG2 3.45Å; K643-T647 PolarHBondContact O-N 3.04Å; K643-T647 VanDerWaalsContact O-N 3.11Å; K643-T647 PolarHBondContact O-OG1 3.38Å
644	Y	73.4	Confident	77.3	Confident	124 Å²	124	103.4 Å²	103.4	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-46.6	171.8	-168.5	-85.4	0	0	0	111.8	S640 Q641 Q642 D646 T647 E648	S640-Y644 WeakPolarHBondContact O-CB 3.26Å; S640-Y644 PolarHBondContact O-N 2.92Å; Q641-Y644 PolarHBondContact O-N 3.13Å; Q642-Y644 PolarHBondContact O-N 3.04Å; Y644-D646 PolarHBondContact O-N 3.26Å; Y644-T647 PolarHBondContact O-N 3.49Å; Y644-T647 PolarHBondContact O-OG1 2.69Å; Y644-E648 HydrophobicContact CD1-CG 3.85Å; Y644-E648 HydrophobicContact CE1-CG 3.42Å; Y644-E648 VanDerWaalsContact CE1-CG 3.42Å; Y644-E648 WeakPolarHBondContact O-CG 3.48Å; Y644-E648 PolarHBondContact O-N 3Å
645	H	70.3	Confident	77.9	Confident	111 Å²	111	101.8 Å²	101.8	51%	0.514	49%	0.487	S	S	.	.	H	α-helix	trans	-61.1	-41.2	175.6	-107.3	84.4	0	0	0	113.1	Q641 Q642 E648 L649	Q641-H645 PolarHBondContact O-N 2.97Å; Q642-H645 CarbonylContact O-C 3.5Å; Q642-H645 WeakPolarHBondContact O-CA 3.18Å; Q642-H645 WeakPolarHBondContact O-CB 3.47Å; Q642-H645 PolarHBondContact O-N 2.96Å; H645-E648 WeakPolarHBondContact O-CB 3.47Å; H645-E648 PolarHBondContact O-N 2.94Å; H645-L649 WeakPolarHBondContact O-CB 3.41Å; H645-L649 VanDerWaalsContact O-CG 3.27Å; H645-L649 WeakPolarHBondContact O-CG 3.24Å; H645-L649 PolarHBondContact O-N 3.31Å
646	D	80.4	Confident	78.3	Confident	78 Å²	78	103.9 Å²	103.9	42%	0.417	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-41.3	177.9	-69.1	-35	0	0	0	111.2	Q642 Y644 L649 Q650	Q642-D646 PolarHBondContact O-N 3.43Å; Y644-D646 PolarHBondContact O-N 3.26Å; D646-L649 PolarHBondContact O-N 2.85Å; D646-Q650 WeakPolarHBondContact O-CB 3.42Å; D646-Q650 PolarHBondContact O-N 2.76Å
647	T	83.4	Confident	78.7	Confident	75 Å²	75	102.3 Å²	102.3	46%	0.46	48%	0.48	S	S	.	.	H	α-helix	trans	-71.5	-32.4	175.8	53.9	0	0	0	0	113.5	K643 Y644 K651	K643-T647 WeakPolarHBondContact O-CG2 3.45Å; K643-T647 PolarHBondContact O-N 3.04Å; K643-T647 VanDerWaalsContact O-N 3.11Å; K643-T647 PolarHBondContact O-OG1 3.38Å; Y644-T647 PolarHBondContact O-N 3.49Å; Y644-T647 PolarHBondContact O-OG1 2.69Å; T647-K651 WeakPolarHBondContact O-CG 3.29Å; T647-K651 PolarHBondContact O-N 2.98Å
648	E	77.4	Confident	79.2	Confident	53 Å²	53	102.3 Å²	102.3	25%	0.248	49%	0.486	C	S	.	.	H	α-helix	trans	-61.3	-53	166.6	-78.4	-73.2	106.6	0	0	111.2	Y644 H645 Q650 K651 W652	Y644-E648 HydrophobicContact CD1-CG 3.85Å; Y644-E648 HydrophobicContact CE1-CG 3.42Å; Y644-E648 VanDerWaalsContact CE1-CG 3.42Å; Y644-E648 WeakPolarHBondContact O-CG 3.48Å; Y644-E648 PolarHBondContact O-N 3Å; H645-E648 WeakPolarHBondContact O-CB 3.47Å; H645-E648 PolarHBondContact O-N 2.94Å; E648-Q650 PolarHBondContact O-N 3.17Å; E648-K651 WeakPolarHBondContact O-CB 3.48Å; E648-K651 PolarHBondContact O-N 2.85Å; E648-K651 IonicContact OE1-NZ 2.75Å; E648-K651 PolarHBondContact OE1-NZ 2.9Å; E648-W652 PolarHBondContact O-N 3Å
649	L	77	Confident	79.5	Confident	84 Å²	84	100 Å²	100	44%	0.44	48%	0.479	S	S	.	.	H	α-helix	trans	-57.1	-36	179.2	-75.8	168.3	0	0	0	112.1	H645 D646 W652 R653	H645-L649 WeakPolarHBondContact O-CB 3.41Å; H645-L649 VanDerWaalsContact O-CG 3.27Å; H645-L649 WeakPolarHBondContact O-CG 3.24Å; H645-L649 PolarHBondContact O-N 3.31Å; D646-L649 PolarHBondContact O-N 2.85Å; L649-W652 PolarHBondContact O-N 2.77Å; L649-R653 VanDerWaalsContact O-CG 3.27Å; L649-R653 WeakPolarHBondContact O-CG 3.17Å; L649-R653 PolarHBondContact O-N 2.97Å
650	Q	83.9	Confident	79.9	Confident	139 Å²	139	99.4 Å²	99.4	65%	0.65	48%	0.482	S	S	*	.	H	α-helix	trans	-68.8	-39.7	176.5	-163.9	129.8	-3	0	0	112.5	D646 E648 R653 E654	D646-Q650 WeakPolarHBondContact O-CB 3.42Å; D646-Q650 PolarHBondContact O-N 2.76Å; E648-Q650 PolarHBondContact O-N 3.17Å; Q650-R653 PolarHBondContact O-N 2.94Å; Q650-E654 PolarHBondContact O-N 2.97Å
651	K	82.3	Confident	80.6	Confident	105 Å²	105	102.5 Å²	102.5	46%	0.457	49%	0.491	S	S	.	.	H	α-helix	trans	-61.2	-47.9	170.7	-63.3	165.5	-158.8	166.4	0	110.8	T647 E648 R653 E654 I655	T647-K651 WeakPolarHBondContact O-CG 3.29Å; T647-K651 PolarHBondContact O-N 2.98Å; E648-K651 WeakPolarHBondContact O-CB 3.48Å; E648-K651 PolarHBondContact O-N 2.85Å; E648-K651 IonicContact OE1-NZ 2.75Å; E648-K651 PolarHBondContact OE1-NZ 2.9Å; K651-R653 VanDerWaalsContact C-N 3.3Å; K651-R653 PolarHBondContact O-N 3.1Å; K651-E654 PolarHBondContact O-N 2.81Å; K651-I655 VanDerWaalsContact O-CG1 3.31Å; K651-I655 WeakPolarHBondContact O-CG1 3.37Å; K651-I655 PolarHBondContact O-N 3.1Å
652	W	69.1	Low	81.4	Confident	148 Å²	148	104.5 Å²	104.5	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-60.1	-38.2	179.4	-76.1	110.8	0	0	0	112.5	E648 L649 I655 I656	E648-W652 PolarHBondContact O-N 3Å; L649-W652 PolarHBondContact O-N 2.77Å; W652-I655 HydrophobicContact CE3-CD1 4.41Å; W652-I655 PolarHBondContact O-N 2.77Å; W652-I656 WeakPolarHBondContact O-CB 3.5Å; W652-I656 WeakPolarHBondContact O-CD1 3.33Å; W652-I656 VanDerWaalsContact O-CG1 3.24Å; W652-I656 WeakPolarHBondContact O-CG1 3.5Å; W652-I656 PolarHBondContact O-N 3.24Å
653	R	83.5	Confident	81.8	Confident	174 Å²	174	103.6 Å²	103.6	66%	0.657	50%	0.502	S	S	*	.	H	α-helix	trans	-62.2	-45.3	174	-75.1	171.9	-172.3	-79.1	1.4	112.8	L649 Q650 K651 I656 K657	L649-R653 VanDerWaalsContact O-CG 3.27Å; L649-R653 WeakPolarHBondContact O-CG 3.17Å; L649-R653 PolarHBondContact O-N 2.97Å; Q650-R653 PolarHBondContact O-N 2.94Å; K651-R653 VanDerWaalsContact C-N 3.3Å; K651-R653 PolarHBondContact O-N 3.1Å; R653-I656 PolarHBondContact O-N 3.01Å; R653-K657 VanDerWaalsContact O-CB 3.24Å; R653-K657 WeakPolarHBondContact O-CB 3.25Å; R653-K657 PolarHBondContact O-N 2.6Å
654	E	84.6	Confident	82.1	Confident	102 Å²	102	101.7 Å²	101.7	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-35.5	177.1	-71.4	-62	139.7	0	0	112.3	Q650 K651 K657 S658	Q650-E654 PolarHBondContact O-N 2.97Å; K651-E654 PolarHBondContact O-N 2.81Å; E654-K657 PolarHBondContact O-N 2.82Å; E654-K657 IonicContact OE1-NZ 2.9Å; E654-K657 PolarHBondContact OE1-NZ 2.92Å; E654-K657 IonicContact OE2-NZ 2.87Å; E654-K657 PolarHBondContact OE2-NZ 3.3Å; E654-S658 WeakPolarHBondContact O-CB 3.32Å; E654-S658 PolarHBondContact O-N 3.04Å; E654-S658 PolarHBondContact O-OG 3.32Å
655	I	84.9	Confident	82.8	Confident	82 Å²	82	101.9 Å²	101.9	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-60.5	-50.6	172.2	-69.5	165.3	0	0	0	110.7	K651 W652 K657 S658 S659	K651-I655 VanDerWaalsContact O-CG1 3.31Å; K651-I655 WeakPolarHBondContact O-CG1 3.37Å; K651-I655 PolarHBondContact O-N 3.1Å; W652-I655 HydrophobicContact CE3-CD1 4.41Å; W652-I655 PolarHBondContact O-N 2.77Å; I655-K657 PolarHBondContact O-N 2.87Å; I655-S658 PolarHBondContact O-N 3.08Å; I655-S658 PolarHBondContact O-OG 3.37Å; I655-S659 WeakPolarHBondContact O-CB 3.35Å; I655-S659 PolarHBondContact O-N 3.25Å; I655-S659 PolarHBondContact O-OG 3.1Å
656	I	85.1	Confident	83.5	Confident	101 Å²	101	101.7 Å²	101.7	52%	0.518	50%	0.504	S	S	.	.	H	α-helix	trans	-58.8	-46.7	177.1	-70.2	164.4	0	0	0	110.8	W652 R653 S658 S659 V660	W652-I656 WeakPolarHBondContact O-CB 3.5Å; W652-I656 WeakPolarHBondContact O-CD1 3.33Å; W652-I656 VanDerWaalsContact O-CG1 3.24Å; W652-I656 WeakPolarHBondContact O-CG1 3.5Å; W652-I656 PolarHBondContact O-N 3.24Å; R653-I656 PolarHBondContact O-N 3.01Å; I656-S658 PolarHBondContact O-N 3.01Å; I656-S659 WeakPolarHBondContact O-CB 3.46Å; I656-S659 PolarHBondContact O-N 2.96Å; I656-S659 VanDerWaalsContact O-N 3.12Å; I656-V660 WeakPolarHBondContact O-CG2 3.41Å; I656-V660 PolarHBondContact O-N 3Å
657	K	86.9	Confident	83.9	Confident	103 Å²	103	102.5 Å²	102.5	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-59.9	-43	177.8	176.6	178.8	160	-142.9	0	112.7	R653 E654 I655 S659 V660 M661	R653-K657 VanDerWaalsContact O-CB 3.24Å; R653-K657 WeakPolarHBondContact O-CB 3.25Å; R653-K657 PolarHBondContact O-N 2.6Å; E654-K657 PolarHBondContact O-N 2.82Å; E654-K657 IonicContact OE1-NZ 2.9Å; E654-K657 PolarHBondContact OE1-NZ 2.92Å; E654-K657 IonicContact OE2-NZ 2.87Å; E654-K657 PolarHBondContact OE2-NZ 3.3Å; I655-K657 PolarHBondContact O-N 2.87Å; K657-S659 VanDerWaalsContact C-N 3.32Å; K657-S659 PolarHBondContact O-N 3.31Å; K657-V660 PolarHBondContact O-N 3.32Å; K657-M661 PolarHBondContact O-N 3.46Å
658	S	85.8	Confident	84.2	Confident	68 Å²	68	102.4 Å²	102.4	48%	0.476	50%	0.5	S	S	.	.	H	α-helix	trans	-65.7	-34.7	174.2	73.6	0	0	0	0	112.6	E654 I655 I656 M661 L662	E654-S658 WeakPolarHBondContact O-CB 3.32Å; E654-S658 PolarHBondContact O-N 3.04Å; E654-S658 PolarHBondContact O-OG 3.32Å; I655-S658 PolarHBondContact O-N 3.08Å; I655-S658 PolarHBondContact O-OG 3.37Å; I656-S658 PolarHBondContact O-N 3.01Å; S658-M661 PolarHBondContact O-N 3.41Å; S658-L662 PolarHBondContact O-N 2.81Å
659	S	81.6	Confident	84.7	Confident	57 Å²	57	103.2 Å²	103.2	40%	0.399	51%	0.512	S	S	.	.	H	α-helix	trans	-70.4	-37.3	177.5	-55.3	0	0	0	0	111.8	I655 I656 K657 L662 L663	I655-S659 WeakPolarHBondContact O-CB 3.35Å; I655-S659 PolarHBondContact O-N 3.25Å; I655-S659 PolarHBondContact O-OG 3.1Å; I656-S659 WeakPolarHBondContact O-CB 3.46Å; I656-S659 PolarHBondContact O-N 2.96Å; I656-S659 VanDerWaalsContact O-N 3.12Å; K657-S659 VanDerWaalsContact C-N 3.32Å; K657-S659 PolarHBondContact O-N 3.31Å; S659-L662 PolarHBondContact O-N 2.71Å; S659-L663 WeakPolarHBondContact O-CG 3.36Å; S659-L663 PolarHBondContact O-N 3.41Å
660	V	88	Confident	85	Confident	89 Å²	89	104 Å²	104	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-65	-44.1	172.6	170.2	0	0	0	0	111.1	I656 K657 L662 L663 D664	I656-V660 WeakPolarHBondContact O-CG2 3.41Å; I656-V660 PolarHBondContact O-N 3Å; K657-V660 PolarHBondContact O-N 3.32Å; V660-L662 VanDerWaalsContact C-N 3.32Å; V660-L662 PolarHBondContact O-N 2.81Å; V660-L663 PolarHBondContact O-N 2.86Å; V660-D664 PolarHBondContact O-N 3.14Å
661	M	86.7	Confident	85.2	Confident	130 Å²	130	100.7 Å²	100.7	64%	0.64	50%	0.502	S	S	*	.	H	α-helix	trans	-59.4	-41.3	173.5	-75.9	-179.4	163.1	0	0	112.3	K657 S658 D664 Q665	K657-M661 PolarHBondContact O-N 3.46Å; S658-M661 PolarHBondContact O-N 3.41Å; M661-D664 PolarHBondContact O-N 3.08Å; M661-Q665 WeakPolarHBondContact O-CB 3.48Å; M661-Q665 PolarHBondContact O-N 3.26Å
662	L	88.1	Confident	85.3	Confident	121 Å²	121	100.9 Å²	100.9	63%	0.634	51%	0.508	S	S	*	.	H	α-helix	trans	-66.2	-37.8	178.2	-154.2	81.8	0	0	0	112.4	S658 S659 V660 M666	S658-L662 PolarHBondContact O-N 2.81Å; S659-L662 PolarHBondContact O-N 2.71Å; V660-L662 VanDerWaalsContact C-N 3.32Å; V660-L662 PolarHBondContact O-N 2.81Å; L662-M666 WeakPolarHBondContact O-CB 3.48Å; L662-M666 PolarHBondContact O-N 2.97Å
663	L	84.9	Confident	86	Confident	107 Å²	107	99 Å²	99	56%	0.56	51%	0.508	S	S	*	.	H	α-helix	trans	-66.1	-40.6	174.7	-77.2	167.5	0	0	0	112.1	S659 V660 M666 K667	S659-L663 WeakPolarHBondContact O-CG 3.36Å; S659-L663 PolarHBondContact O-N 3.41Å; V660-L663 PolarHBondContact O-N 2.86Å; L663-M666 HydrophobicContact CD2-CE 4.05Å; L663-M666 PolarHBondContact O-N 2.95Å; L663-K667 WeakPolarHBondContact O-CB 3.43Å; L663-K667 PolarHBondContact O-N 3.33Å
664	D	87.8	Confident	85.9	Confident	85 Å²	85	97 Å²	97	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-70.1	-40.1	178.4	-141.1	25.3	0	0	0	111.1	V660 M661 M666 K667 D668	V660-D664 PolarHBondContact O-N 3.14Å; M661-D664 PolarHBondContact O-N 3.08Å; D664-M666 VanDerWaalsContact C-N 3.32Å; D664-M666 PolarHBondContact O-N 3.34Å; D664-K667 WeakPolarHBondContact O-CB 3.33Å; D664-K667 PolarHBondContact O-N 3.39Å; D664-K667 WeakPolarHBondContact OD1-CD 3.47Å; D664-K667 WeakPolarHBondContact OD1-CE 3.38Å; D664-K667 IonicContact OD1-NZ 2.74Å; D664-K667 PolarHBondContact OD1-NZ 2.87Å; D664-D668 PolarHBondContact O-N 3.23Å
665	Q	87.8	Confident	85.7	Confident	127 Å²	127	96.3 Å²	96.3	59%	0.593	51%	0.506	S	S	*	.	H	α-helix	trans	-61.6	-37.3	171.3	-172.4	179.6	6.9	0	0	112.4	M661 S669	M661-Q665 WeakPolarHBondContact O-CB 3.48Å; M661-Q665 PolarHBondContact O-N 3.26Å; Q665-S669 WeakPolarHBondContact O-CB 3.3Å; Q665-S669 PolarHBondContact O-N 3.34Å; Q665-S669 PolarHBondContact O-OG 3.45Å
666	M	83.5	Confident	85.2	Confident	108 Å²	108	94.6 Å²	94.6	53%	0.532	51%	0.508	S	S	.	.	H	α-helix	trans	-68.6	-40.9	174.4	-172.6	-176	74	0	0	111.8	L662 L663 D664 S669 L670	L662-M666 WeakPolarHBondContact O-CB 3.48Å; L662-M666 PolarHBondContact O-N 2.97Å; L663-M666 HydrophobicContact CD2-CE 4.05Å; L663-M666 PolarHBondContact O-N 2.95Å; D664-M666 VanDerWaalsContact C-N 3.32Å; D664-M666 PolarHBondContact O-N 3.34Å; M666-S669 WeakPolarHBondContact O-CB 3.16Å; M666-S669 PolarHBondContact O-N 3.45Å; M666-L670 PolarHBondContact O-N 3.19Å
667	K	89.1	Confident	84.6	Confident	94 Å²	94	93.8 Å²	93.8	41%	0.409	50%	0.504	S	S	.	.	H	α-helix	trans	-59.9	-47.7	173.3	161.8	-176.6	137.2	-74.2	0	111.3	L663 D664 S669 L670 I671	L663-K667 WeakPolarHBondContact O-CB 3.43Å; L663-K667 PolarHBondContact O-N 3.33Å; D664-K667 WeakPolarHBondContact O-CB 3.33Å; D664-K667 PolarHBondContact O-N 3.39Å; D664-K667 WeakPolarHBondContact OD1-CD 3.47Å; D664-K667 WeakPolarHBondContact OD1-CE 3.38Å; D664-K667 IonicContact OD1-NZ 2.74Å; D664-K667 PolarHBondContact OD1-NZ 2.87Å; K667-S669 VanDerWaalsContact C-N 3.3Å; K667-S669 PolarHBondContact O-N 3.41Å; K667-L670 WeakPolarHBondContact O-CB 3.34Å; K667-L670 PolarHBondContact O-N 3.26Å; K667-L670 VanDerWaalsContact O-N 3.15Å; K667-I671 HydrophobicContact CG-CD1 3.86Å; K667-I671 WeakPolarHBondContact O-CG1 3.48Å; K667-I671 PolarHBondContact O-N 3.2Å
668	D	89.5	Confident	83.6	Confident	73 Å²	73	97.5 Å²	97.5	39%	0.39	52%	0.515	S	S	.	.	H	α-helix	trans	-67	-34.3	179.1	-69.3	-2.6	0	0	0	111.3	D664 I671 N672	D664-D668 PolarHBondContact O-N 3.23Å; D668-I671 PolarHBondContact O-N 2.85Å; D668-N672 WeakPolarHBondContact O-CB 3.48Å; D668-N672 VanDerWaalsContact O-CG 3.3Å; D668-N672 PolarHBondContact O-N 3.33Å; D668-N672 PolarHBondContact O-ND2 3.42Å
669	S	87.8	Confident	82.3	Confident	71 Å²	71	98.1 Å²	98.1	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-63.7	-39.8	171.3	-58.1	0	0	0	0	112.2	Q665 M666 K667 L673	Q665-S669 WeakPolarHBondContact O-CB 3.3Å; Q665-S669 PolarHBondContact O-N 3.34Å; Q665-S669 PolarHBondContact O-OG 3.45Å; M666-S669 WeakPolarHBondContact O-CB 3.16Å; M666-S669 PolarHBondContact O-N 3.45Å; K667-S669 VanDerWaalsContact C-N 3.3Å; K667-S669 PolarHBondContact O-N 3.41Å; S669-L673 WeakPolarHBondContact O-CB 3.49Å; S669-L673 PolarHBondContact O-N 2.91Å
670	L	84.7	Confident	81	Confident	99 Å²	99	103.9 Å²	103.9	52%	0.518	53%	0.533	S	S	.	.	H	α-helix	trans	-66.2	-41.9	173.8	-90.4	159.7	0	0	0	112.6	M666 K667 L673 Q674	M666-L670 PolarHBondContact O-N 3.19Å; K667-L670 WeakPolarHBondContact O-CB 3.34Å; K667-L670 PolarHBondContact O-N 3.26Å; K667-L670 VanDerWaalsContact O-N 3.15Å; L670-L673 PolarHBondContact O-N 2.99Å; L670-Q674 WeakPolarHBondContact O-CB 3.32Å; L670-Q674 PolarHBondContact O-N 3.21Å
671	I	88.1	Confident	79.4	Confident	71 Å²	71	103.8 Å²	103.8	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-43.8	175.8	-68.9	164.3	0	0	0	110.4	K667 D668 L673 Q674 N675	K667-I671 HydrophobicContact CG-CD1 3.86Å; K667-I671 WeakPolarHBondContact O-CG1 3.48Å; K667-I671 PolarHBondContact O-N 3.2Å; D668-I671 PolarHBondContact O-N 2.85Å; I671-L673 PolarHBondContact O-N 2.88Å; I671-Q674 PolarHBondContact O-N 3.03Å; I671-N675 WeakPolarHBondContact O-CB 3.49Å; I671-N675 VanDerWaalsContact O-CG 3.28Å; I671-N675 PolarHBondContact O-N 3.29Å; I671-N675 PolarHBondContact O-ND2 3.15Å
672	N	84.5	Confident	77.8	Confident	108 Å²	108	105.7 Å²	105.7	58%	0.578	53%	0.531	S	S	*	.	H	α-helix	trans	-64.1	-38.7	175.4	-74.7	-42	0	0	0	112.3	D668 N675 G676	D668-N672 WeakPolarHBondContact O-CB 3.48Å; D668-N672 VanDerWaalsContact O-CG 3.3Å; D668-N672 PolarHBondContact O-N 3.33Å; D668-N672 PolarHBondContact O-ND2 3.42Å; N672-N675 PolarHBondContact O-N 3.1Å; N672-G676 PolarHBondContact O-N 3.22Å
673	L	82.8	Confident	76.1	Confident	108 Å²	108	103.3 Å²	103.3	57%	0.565	52%	0.521	S	S	*	.	H	α-helix	trans	-62.9	-46.2	173.1	-170	76.8	0	0	0	111.6	S669 L670 I671 N675 G676 I677	S669-L673 WeakPolarHBondContact O-CB 3.49Å; S669-L673 PolarHBondContact O-N 2.91Å; L670-L673 PolarHBondContact O-N 2.99Å; I671-L673 PolarHBondContact O-N 2.88Å; L673-N675 PolarHBondContact O-N 3.28Å; L673-G676 PolarHBondContact O-N 2.89Å; L673-I677 HydrophobicContact CG-CD1 4.14Å; L673-I677 WeakPolarHBondContact O-CG1 3.49Å; L673-I677 PolarHBondContact O-N 3.41Å
674	Q	82.2	Confident	74.5	Confident	133 Å²	133	101.3 Å²	101.3	62%	0.621	52%	0.516	S	S	*	.	H	α-helix	trans	-61.1	-42.5	178.3	-174.3	179.1	8.3	0	0	111.9	L670 I671 I677 R678	L670-Q674 WeakPolarHBondContact O-CB 3.32Å; L670-Q674 PolarHBondContact O-N 3.21Å; I671-Q674 PolarHBondContact O-N 3.03Å; Q674-I677 PolarHBondContact O-N 2.87Å; Q674-R678 WeakPolarHBondContact O-CB 3.49Å; Q674-R678 PolarHBondContact O-N 2.72Å
675	N	79.5	Confident	72.7	Confident	88 Å²	88	102.4 Å²	102.4	47%	0.471	52%	0.518	S	S	.	.	H	α-helix	trans	-66.4	-40.2	175	-70.7	-26.7	0	0	0	112	I671 N672 L673 R678 S679	I671-N675 WeakPolarHBondContact O-CB 3.49Å; I671-N675 VanDerWaalsContact O-CG 3.28Å; I671-N675 PolarHBondContact O-N 3.29Å; I671-N675 PolarHBondContact O-ND2 3.15Å; N672-N675 PolarHBondContact O-N 3.1Å; L673-N675 PolarHBondContact O-N 3.28Å; N675-R678 PolarHBondContact O-N 3.41Å; N675-S679 WeakPolarHBondContact O-CB 3.44Å; N675-S679 PolarHBondContact O-N 3.25Å
676	G	74.3	Confident	70.9	Confident	45 Å²	45	99.7 Å²	99.7	46%	0.464	51%	0.514	S	S	.	.	H	α-helix	trans	-63.4	-39.9	175.6	0	0	0	0	0	113.4	N672 L673 R680	N672-G676 PolarHBondContact O-N 3.22Å; L673-G676 PolarHBondContact O-N 2.89Å; G676-R680 PolarHBondContact O-N 3.29Å
677	I	74.1	Confident	69.4	Low	85 Å²	85	101 Å²	101	44%	0.436	52%	0.518	S	S	.	.	H	α-helix	trans	-62.6	-54.6	173.2	-67.9	163.2	0	0	0	109.7	L673 Q674 S679 R680 D681	L673-I677 HydrophobicContact CG-CD1 4.14Å; L673-I677 WeakPolarHBondContact O-CG1 3.49Å; L673-I677 PolarHBondContact O-N 3.41Å; Q674-I677 PolarHBondContact O-N 2.87Å; I677-S679 PolarHBondContact O-N 3.08Å; I677-R680 WeakPolarHBondContact O-CB 3.47Å; I677-R680 PolarHBondContact O-N 2.83Å; I677-D681 PolarHBondContact O-N 2.68Å
678	R	65.6	Low	67.5	Low	180 Å²	180	103.6 Å²	103.6	68%	0.679	53%	0.532	S	S	*	.	H	α-helix	trans	-59.8	-30.7	-179	-168.9	177.1	-173.8	175.3	3.1	113.6	Q674 N675 R680	Q674-R678 WeakPolarHBondContact O-CB 3.49Å; Q674-R678 PolarHBondContact O-N 2.72Å; N675-R678 PolarHBondContact O-N 3.41Å; R678-R680 VanDerWaalsContact C-N 3.33Å
679	S	58.4	Low	65.7	Low	81 Å²	81	106.3 Å²	106.3	57%	0.566	54%	0.54	S	S	*	.	H	α-helix	trans	-70.6	-27.4	174.4	-171.2	0	0	0	0	113.2	N675 I677 T683	N675-S679 WeakPolarHBondContact O-CB 3.44Å; N675-S679 PolarHBondContact O-N 3.25Å; I677-S679 PolarHBondContact O-N 3.08Å; S679-T683 PolarHBondContact O-OG1 3.22Å
680	R	54.6	Low	63.9	Low	178 Å²	178	111.9 Å²	111.9	67%	0.672	55%	0.55	S	S	*	*	H	α-helix	trans	-79.5	-38	-178.7	-164.8	174	67.9	169.7	3.3	112	G676 I677 R678 Y682 T683 S684	G676-R680 PolarHBondContact O-N 3.29Å; I677-R680 WeakPolarHBondContact O-CB 3.47Å; I677-R680 PolarHBondContact O-N 2.83Å; R678-R680 VanDerWaalsContact C-N 3.33Å; R680-Y682 VanDerWaalsContact C-N 3.26Å; R680-Y682 PolarHBondContact O-N 3.32Å; R680-T683 WeakPolarHBondContact CA-OG1 3.42Å; R680-T683 PolarHBondContact O-N 2.82Å; R680-T683 PolarHBondContact O-OG1 3.48Å; R680-T683 VanDerWaalsContact O-OG1 3.08Å; R680-S684 PolarHBondContact O-N 3.3Å
681	D	53.7	Low	62.2	Low	88 Å²	88	113.8 Å²	113.8	47%	0.471	56%	0.561	S	S	.	*	H	α-helix	trans	-63.2	-36	177.6	-52	-32.4	0	0	0	111.2	I677 T683 S684	I677-D681 PolarHBondContact O-N 2.68Å; D681-T683 VanDerWaalsContact C-N 3.31Å; D681-T683 PolarHBondContact O-N 2.73Å; D681-S684 PolarHBondContact O-OG 3.42Å
682	Y	53.1	Low	60.5	Low	170 Å²	170	120.7 Å²	120.7	67%	0.667	58%	0.582	S	S	*	*	H	α-helix	trans	-68.1	-23.7	173.1	-107.6	-79.8	0	0	0	114.3	R680 S686	R680-Y682 VanDerWaalsContact C-N 3.26Å; R680-Y682 PolarHBondContact O-N 3.32Å; Y682-S686 PolarHBondContact O-OG 3.19Å
683	T	52.5	Low	58.8	Low	71 Å²	71	125 Å²	125	44%	0.436	59%	0.592	S	S	.	*	H	α-helix	trans	-80.8	-38.7	177.7	-1.4	0	0	0	0	111.5	S679 R680 D681 E685 S686 E687	S679-T683 PolarHBondContact O-OG1 3.22Å; R680-T683 WeakPolarHBondContact CA-OG1 3.42Å; R680-T683 PolarHBondContact O-N 2.82Å; R680-T683 PolarHBondContact O-OG1 3.48Å; R680-T683 VanDerWaalsContact O-OG1 3.08Å; D681-T683 VanDerWaalsContact C-N 3.31Å; D681-T683 PolarHBondContact O-N 2.73Å; T683-E685 PolarHBondContact O-N 2.65Å; T683-S686 PolarHBondContact O-N 3.33Å; T683-S686 PolarHBondContact O-OG 2.91Å; T683-S686 VanDerWaalsContact O-OG 3.04Å; T683-E687 PolarHBondContact O-N 2.94Å; T683-E687 VanDerWaalsContact O-N 3.13Å
684	S	50.1	Low	56.8	Low	65 Å²	65	131.5 Å²	131.5	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-63	-43.6	177.4	42.2	0	0	0	0	113.2	R680 D681 S686 E687 E688	R680-S684 PolarHBondContact O-N 3.3Å; D681-S684 PolarHBondContact O-OG 3.42Å; S684-S686 PolarHBondContact O-N 3.02Å; S684-E687 PolarHBondContact O-N 3.18Å; S684-E688 PolarHBondContact O-N 3.43Å; S684-E688 VanDerWaalsContact O-N 3.1Å
685	E	50.7	Low	55.5	Low	108 Å²	108	131.4 Å²	131.4	51%	0.505	62%	0.619	S	S	.	*	H	α-helix	trans	-63.3	-24.5	178.1	-97.5	-140.1	103	0	0	113.8	T683 K689	T683-E685 PolarHBondContact O-N 2.65Å; E685-K689 WeakPolarHBondContact O-CD 3.31Å; E685-K689 WeakPolarHBondContact O-CG 3.42Å; E685-K689 IonicContact OE1-NZ 2.7Å; E685-K689 PolarHBondContact OE1-NZ 2.68Å; E685-K689 IonicContact OE2-NZ 2.68Å
686	S	51.1	Low	54.2	Low	70 Å²	70	133.7 Å²	133.7	49%	0.49	63%	0.626	S	S	.	*	H	α-helix	trans	-92.1	-28.3	-178.1	45.7	0	0	0	0	113	Y682 T683 S684	Y682-S686 PolarHBondContact O-OG 3.19Å; T683-S686 PolarHBondContact O-N 3.33Å; T683-S686 PolarHBondContact O-OG 2.91Å; T683-S686 VanDerWaalsContact O-OG 3.04Å; S684-S686 PolarHBondContact O-N 3.02Å
687	E	50.8	Low	53.1	Low	135 Å²	135	138.6 Å²	138.6	63%	0.631	64%	0.636	S	S	*	*	H	α-helix	trans	-77.1	-40.6	171.1	-67	-163.9	131.7	0	0	112.8	T683 S684 K689 R690 N691	T683-E687 PolarHBondContact O-N 2.94Å; T683-E687 VanDerWaalsContact O-N 3.13Å; S684-E687 PolarHBondContact O-N 3.18Å; E687-K689 VanDerWaalsContact C-N 3.28Å; E687-K689 PolarHBondContact O-N 3.12Å; E687-R690 WeakPolarHBondContact O-CB 3.45Å; E687-R690 PolarHBondContact O-N 2.99Å; E687-N691 PolarHBondContact O-N 3.29Å
688	E	50.1	Low	51.9	Low	148 Å²	148	141.8 Å²	141.8	69%	0.692	65%	0.647	S	S	*	*	H	α-helix	trans	-60.9	-35.6	177.7	-79	-159.9	125.9	0	0	113	S684 R690	S684-E688 PolarHBondContact O-N 3.43Å; S684-E688 VanDerWaalsContact O-N 3.1Å; E688-R690 VanDerWaalsContact C-N 3.28Å; E688-R690 PolarHBondContact O-N 3.19Å
689	K	51.6	Low	51	Low	131 Å²	131	139.4 Å²	139.4	57%	0.57	65%	0.645	S	S	*	*	H	α-helix	trans	-71.1	-21.9	176.8	-72.8	170.8	-170.7	148.2	0	112.8	E685 E687	E685-K689 WeakPolarHBondContact O-CD 3.31Å; E685-K689 WeakPolarHBondContact O-CG 3.42Å; E685-K689 IonicContact OE1-NZ 2.7Å; E685-K689 PolarHBondContact OE1-NZ 2.68Å; E685-K689 IonicContact OE2-NZ 2.68Å; E687-K689 VanDerWaalsContact C-N 3.28Å; E687-K689 PolarHBondContact O-N 3.12Å
690	R	50.3	Low	50.5	Low	188 Å²	188	143.3 Å²	143.3	71%	0.709	65%	0.651	S	S	*	*	H	α-helix	trans	-81	-34.5	177.8	-167.8	173.3	-178.3	176.6	-0.6	112.6	E687 E688 R692	E687-R690 WeakPolarHBondContact O-CB 3.45Å; E687-R690 PolarHBondContact O-N 2.99Å; E688-R690 VanDerWaalsContact C-N 3.28Å; E688-R690 PolarHBondContact O-N 3.19Å; R690-R692 VanDerWaalsContact C-N 3.25Å; R690-R692 PolarHBondContact O-N 3.4Å
691	N	49.2	Very low	50.2	Low	138 Å²	138	140.8 Å²	140.8	74%	0.738	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	9.1	-178.3	-70.4	-15.2	0	0	0	114.7	E687	E687-N691 PolarHBondContact O-N 3.29Å
692	R	50.9	Low	50	Low	216 Å²	216	144.8 Å²	144.8	82%	0.815	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	2.7	171.5	-74.5	-168.9	178.3	-172.8	2	114.7	R690	R690-R692 VanDerWaalsContact C-N 3.25Å; R690-R692 PolarHBondContact O-N 3.4Å
693	Y	48.6	Very low	49.7	Very low	199 Å²	199	142.8 Å²	142.8	78%	0.78	66%	0.662	S	S	*	*			trans	-135.2	58	179.6	-76.2	-76.5	0	0	0	112.2
694	H	40.8	Very low	49.5	Very low	244 Å²	244	149.3 Å²	149.3	100%	1.13	68%	0.683	S	S	*	*			trans	-149.8	0	162.8	-93.5	-56.3	0	0	0	110.8

Retrieved 694 of 694 residues in 604 ms (Link to these results)

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