A0A077ZD15_TRITR Loading...

RNA-binding protein 5

AlphaFold DB , UniProt , Accession A0A077ZD15, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 693 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	41.9	Very low	41.7	Very low	248 Å²	248	159 Å²	159	100%	1.222	82%	0.823	S	S	*	*				0	140.8	0	-73.4	177.9	169.2	0	0	107.6
2	G	47.6	Very low	41.5	Very low	89 Å²	89	165.2 Å²	165.2	92%	0.918	83%	0.827	S	S	*	*			trans	73.8	99	-177.7	0	0	0	0	0	113
3	S	46.4	Very low	41.4	Very low	110 Å²	110	164.6 Å²	164.6	77%	0.769	82%	0.82	S	S	*	*			trans	-121.4	159.9	178.6	55.5	0	0	0	0	111.2
4	D	44.3	Very low	41.1	Very low	136 Å²	136	161.5 Å²	161.5	73%	0.727	81%	0.808	S	S	*	*			trans	-58.4	169.3	176	-51.3	-102	0	0	0	114.1
5	Y	46	Very low	41	Very low	227 Å²	227	162.1 Å²	162.1	89%	0.89	81%	0.807	S	S	*	*				-174.2	178.1	109.3	-96.4	-62.4	0	0	0	112.6
6	R	39.1	Very low	40.7	Very low	211 Å²	211	159.1 Å²	159.1	80%	0.796	81%	0.805	S	S	*	*			trans	-154.3	126.4	-148.2	-179.7	-172.4	-166.5	-178.8	6.6	113.7
7	R	37.8	Very low	40.6	Very low	220 Å²	220	158.4 Å²	158.4	83%	0.83	80%	0.804	S	S	*	*			trans	62	144	169.9	-69.7	175.5	170	175	-5.3	117.4
8	K	41.3	Very low	40.3	Very low	174 Å²	174	154.4 Å²	154.4	76%	0.757	79%	0.793	S	S	*	*				173.9	150.1	110.2	-96.1	-169.8	158.8	-131.1	0	114.2
9	D	39.4	Very low	40.3	Very low	118 Å²	118	153.4 Å²	153.4	63%	0.631	80%	0.795	S	S	*	*				37.6	148.7	123.8	-43.5	-13.7	0	0	0	119.4
10	S	38.5	Very low	40.3	Very low	114 Å²	114	156.2 Å²	156.2	80%	0.797	80%	0.796	S	S	*	*			cis	-170.5	168.7	1.7	38.5	0	0	0	0	113.4
11	S	36.5	Very low	40.2	Very low	102 Å²	102	157.8 Å²	157.8	71%	0.713	79%	0.793	S	S	*	*			trans	-39.8	153	172	-35.9	0	0	0	0	120.7
12	R	39.1	Very low	40	Very low	233 Å²	233	151.7 Å²	151.7	88%	0.879	78%	0.776	S	S	*	*			trans	-164.9	134.1	144.5	-96	147.4	-173.1	-168.7	0.8	107.6
13	H	40.8	Very low	39.4	Very low	158 Å²	158	155.4 Å²	155.4	73%	0.731	77%	0.769	S	S	*	*				67	137.4	54.5	-70.9	-68.6	0	0	0	113.6
14	N	36.3	Very low	39	Very low	121 Å²	121	158 Å²	158	65%	0.647	77%	0.774	S	S	*	*			cis	-168.3	-168.3	-19.6	-127.1	17.1	0	0	0	109.4
15	E	40	Very low	38.4	Very low	170 Å²	170	155.5 Å²	155.5	79%	0.794	77%	0.767	S	S	*	*			trans	68.1	139.6	163.7	-65.7	123.5	157	0	0	118.5
16	C	36.3	Very low	37.9	Very low	115 Å²	115	156.4 Å²	156.4	78%	0.777	77%	0.769	S	S	*	*			cis	103.9	94.8	2.5	-166.6	0	0	0	0	118.7
17	D	38.5	Very low	37.8	Very low	146 Å²	146	155 Å²	155	78%	0.781	77%	0.772	S	S	*	*			trans	-168.3	145.2	138.5	-110.2	-32.9	0	0	0	107.4
18	S	35.4	Very low	37.7	Very low	87 Å²	87	153.6 Å²	153.6	61%	0.608	78%	0.775	S	S	*	*			cis	101.6	160.8	21	115	0	0	0	0	116
19	T	41.4	Very low	37.3	Very low	135 Å²	135	149.9 Å²	149.9	83%	0.828	77%	0.769	S	S	*	*			trans	71.7	149.2	-168.8	74	0	0	0	0	116.4
20	Y	40.3	Very low	37.2	Very low	209 Å²	209	152.7 Å²	152.7	82%	0.82	78%	0.784	S	S	*	*			cis	-157.5	178.4	-28.6	-169.3	-106.9	0	0	0	109.5
21	Y	36.8	Very low	37.4	Very low	190 Å²	190	153.3 Å²	153.3	75%	0.745	78%	0.779	S	S	*	*			trans	-68.3	149.9	-173.5	-73.9	-105.2	0	0	0	115.9
22	S	39	Very low	37.7	Very low	121 Å²	121	156.8 Å²	156.8	85%	0.846	78%	0.781	S	S	*	*				-156.3	147.2	121.8	-160.7	0	0	0	0	110.4
23	E	34.5	Very low	37.7	Very low	166 Å²	166	154.6 Å²	154.6	78%	0.776	78%	0.778	S	S	*	*			trans	-90.5	143.6	174.6	-65.1	157.6	115.2	0	0	110.1
24	D	37.6	Very low	37.6	Very low	166 Å²	166	150.3 Å²	150.3	89%	0.888	77%	0.766	S	S	*	*				-176.7	151.3	125	-109.1	-33.1	0	0	0	114.5
25	S	32.5	Very low	37.9	Very low	83 Å²	83	149.4 Å²	149.4	58%	0.58	77%	0.765	S	S	*	*			trans	-16.2	125.1	169.5	169.8	0	0	0	0	119.4
26	W	35.8	Very low	38.2	Very low	246 Å²	246	145 Å²	145	93%	0.932	75%	0.754	S	S	*	*				-158.8	152.4	120.4	-82.8	113	0	0	0	110.9
27	E	35.4	Very low	38.6	Very low	181 Å²	181	148.4 Å²	148.4	85%	0.846	75%	0.751	S	S	*	*			trans	-83.4	-173.8	174.6	-61.9	178.8	120.4	0	0	111.6
28	E	36.1	Very low	39.2	Very low	190 Å²	190	146.3 Å²	146.3	89%	0.888	74%	0.74	S	S	*	*			trans	67.7	98.8	178.2	-55.1	-166.7	121.3	0	0	118.5
29	C	33.4	Very low	40	Very low	96 Å²	96	149.7 Å²	149.7	65%	0.649	74%	0.744	S	S	*	*			trans	-154.8	12.5	155	-114.3	0	0	0	0	117.7	D31	C29-D31 PolarHBondContact O-N 2.73Å
30	D	38	Very low	40.4	Very low	177 Å²	177	150.5 Å²	150.5	95%	0.947	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	61.9	-175.9	-99.6	-39.4	0	0	0	114.2
31	D	41.4	Very low	40.7	Very low	128 Å²	128	145.7 Å²	145.7	68%	0.684	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.3	3.6	179.8	-134.8	-19.4	0	0	0	116.9	C29 F33	C29-D31 PolarHBondContact O-N 2.73Å; D31-F33 PolarHBondContact O-N 3.05Å
32	K	43.5	Very low	41.5	Very low	174 Å²	174	138.9 Å²	138.9	76%	0.757	71%	0.707	S	S	*	*	S	Bend	trans	-87.3	4.3	-167.8	-76.5	170.3	-177.9	154.4	0	116.7
33	F	38.5	Very low	42.2	Very low	187 Å²	187	138.7 Å²	138.7	82%	0.82	69%	0.693	S	S	*	*	S	Bend	trans	-111.9	-14.5	-178.4	-145.4	-100.3	0	0	0	115.8	D31	D31-F33 PolarHBondContact O-N 3.05Å
34	S	39.9	Very low	42.9	Very low	69 Å²	69	139.2 Å²	139.2	48%	0.483	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.8	-44.6	-174.6	-171.8	0	0	0	0	113.5	S36 Y37	S34-S36 PolarHBondContact O-N 2.94Å; S34-Y37 PolarHBondContact O-N 3.21Å
35	T	42.1	Very low	43.8	Very low	101 Å²	101	133.8 Å²	133.8	62%	0.62	66%	0.663	S	S	*	*	H	α-helix	trans	-66.8	-8.8	-162.8	59.1	0	0	0	0	116.7
36	S	47	Very low	44.8	Very low	79 Å²	79	137.4 Å²	137.4	55%	0.552	66%	0.664	S	S	*	*	H	α-helix	trans	-83.3	-32.8	-179.1	-169.5	0	0	0	0	113.4	S34	S34-S36 PolarHBondContact O-N 2.94Å
37	Y	44.2	Very low	45.3	Very low	186 Å²	186	133.8 Å²	133.8	73%	0.729	65%	0.651	S	S	*	*	H	α-helix	trans	-78.3	-41	-178.5	-98.8	-88.6	0	0	0	112.6	S34 K39 K40 N41	S34-Y37 PolarHBondContact O-N 3.21Å; Y37-K39 PolarHBondContact O-N 3.12Å; Y37-K40 PolarHBondContact O-N 2.86Å; Y37-N41 PolarHBondContact O-N 3.32Å
38	D	51.5	Low	45.8	Very low	101 Å²	101	133 Å²	133	54%	0.54	64%	0.641	S	S	.	*	H	α-helix	trans	-66.5	-33.7	-177.5	-80.5	-36.5	0	0	0	113.7	K40 N41 A42	D38-K40 VanDerWaalsContact C-N 3.34Å; D38-K40 PolarHBondContact O-N 2.98Å; D38-N41 PolarHBondContact O-N 3.23Å; D38-N41 VanDerWaalsContact O-N 3.15Å; D38-A42 WeakPolarHBondContact O-CB 3.26Å; D38-A42 PolarHBondContact O-N 3.21Å
39	K	51.2	Low	46.4	Very low	159 Å²	159	131 Å²	131	69%	0.691	63%	0.625	S	S	*	*	H	α-helix	trans	-56.5	-46.4	174.5	-95.8	180	174.8	173.3	0	112.1	Y37 N41 A42 E43	Y37-K39 PolarHBondContact O-N 3.12Å; K39-N41 VanDerWaalsContact C-N 3.33Å; K39-N41 PolarHBondContact O-N 3.34Å; K39-A42 PolarHBondContact O-N 3.19Å; K39-E43 WeakPolarHBondContact O-CG 3.44Å; K39-E43 PolarHBondContact O-N 2.72Å
40	K	49.5	Very low	47.3	Very low	151 Å²	151	131 Å²	131	66%	0.657	62%	0.618	S	S	*	*	H	α-helix	trans	-68.2	-31.9	178.2	-75.3	176.2	177	169.1	0	112.7	Y37 D38 R44	Y37-K40 PolarHBondContact O-N 2.86Å; D38-K40 VanDerWaalsContact C-N 3.34Å; D38-K40 PolarHBondContact O-N 2.98Å; K40-R44 WeakPolarHBondContact O-CB 3.35Å; K40-R44 PolarHBondContact O-N 3.05Å; K40-R44 VanDerWaalsContact O-N 3.17Å
41	N	48.1	Very low	47.6	Very low	108 Å²	108	130.1 Å²	130.1	58%	0.578	60%	0.603	S	S	*	*	H	α-helix	trans	-74.5	-38.5	177.1	-146.1	18.8	0	0	0	111.5	Y37 D38 K39 R44 S45	Y37-N41 PolarHBondContact O-N 3.32Å; D38-N41 PolarHBondContact O-N 3.23Å; D38-N41 VanDerWaalsContact O-N 3.15Å; K39-N41 VanDerWaalsContact C-N 3.33Å; K39-N41 PolarHBondContact O-N 3.34Å; N41-R44 PolarHBondContact O-N 3.18Å; N41-S45 WeakPolarHBondContact O-CB 3.3Å; N41-S45 PolarHBondContact O-N 3Å
42	A	53.5	Low	48	Very low	47 Å²	47	129.9 Å²	129.9	39%	0.388	60%	0.598	S	S	.	*	H	α-helix	trans	-64.7	-42.4	173.8	0	0	0	0	0	112.6	D38 K39 R44 S45 R46	D38-A42 WeakPolarHBondContact O-CB 3.26Å; D38-A42 PolarHBondContact O-N 3.21Å; K39-A42 PolarHBondContact O-N 3.19Å; A42-R44 VanDerWaalsContact C-N 3.34Å; A42-R44 PolarHBondContact O-N 3.48Å; A42-S45 WeakPolarHBondContact O-CB 3.11Å; A42-S45 PolarHBondContact O-N 3.16Å; A42-R46 PolarHBondContact O-N 3.1Å
43	E	52	Low	48	Very low	118 Å²	118	130.2 Å²	130.2	55%	0.551	59%	0.594	S	S	*	*	H	α-helix	trans	-60.4	-43.3	172.6	-75.1	173.9	164.9	0	0	111.7	K39 S45 R46 Y47	K39-E43 WeakPolarHBondContact O-CG 3.44Å; K39-E43 PolarHBondContact O-N 2.72Å; E43-S45 VanDerWaalsContact C-N 3.3Å; E43-S45 PolarHBondContact O-N 3.16Å; E43-R46 PolarHBondContact O-N 2.96Å; E43-Y47 PolarHBondContact O-N 3.41Å; E43-Y47 VanDerWaalsContact O-N 3.11Å
44	R	50.6	Low	48.4	Very low	176 Å²	176	125.1 Å²	125.1	66%	0.664	58%	0.582	S	S	*	*	H	α-helix	trans	-64	-34.5	175.7	-154.1	171.4	-161.9	153.8	4.8	112.4	K40 N41 A42 W48	K40-R44 WeakPolarHBondContact O-CB 3.35Å; K40-R44 PolarHBondContact O-N 3.05Å; K40-R44 VanDerWaalsContact O-N 3.17Å; N41-R44 PolarHBondContact O-N 3.18Å; A42-R44 VanDerWaalsContact C-N 3.34Å; A42-R44 PolarHBondContact O-N 3.48Å; R44-W48 VanDerWaalsContact O-CD1 3.27Å; R44-W48 PolarHBondContact O-N 3.27Å
45	S	55.2	Low	48.8	Very low	52 Å²	52	126.1 Å²	126.1	36%	0.364	59%	0.588	S	S	.	*	H	α-helix	trans	-70.3	-28.4	174.5	-176.8	0	0	0	0	113.8	N41 A42 E43 R49	N41-S45 WeakPolarHBondContact O-CB 3.3Å; N41-S45 PolarHBondContact O-N 3Å; A42-S45 WeakPolarHBondContact O-CB 3.11Å; A42-S45 PolarHBondContact O-N 3.16Å; E43-S45 VanDerWaalsContact C-N 3.3Å; E43-S45 PolarHBondContact O-N 3.16Å; S45-R49 PolarHBondContact O-NE 3.46Å; S45-R49 VanDerWaalsContact O-NE 3.15Å; S45-R49 PolarHBondContact OG-NH2 3.23Å
46	R	53.6	Low	48.9	Very low	160 Å²	160	128.7 Å²	128.7	60%	0.604	59%	0.593	S	S	*	*	H	α-helix	trans	-70.2	-50	170.5	-69.3	178.9	-174.5	153.7	1.3	110.9	A42 E43 W48 R49 D50	A42-R46 PolarHBondContact O-N 3.1Å; E43-R46 PolarHBondContact O-N 2.96Å; R46-W48 VanDerWaalsContact C-N 3.26Å; R46-W48 PolarHBondContact O-N 3.42Å; R46-W48 VanDerWaalsContact O-N 3.15Å; R46-R49 PolarHBondContact O-N 3.28Å; R46-D50 PolarHBondContact O-N 3.33Å
47	Y	46.9	Very low	48.9	Very low	169 Å²	169	130 Å²	130	66%	0.663	60%	0.598	S	S	*	*	H	α-helix	trans	-54.5	-38.9	-177.2	-168.8	-89.1	0	0	0	113.5	E43 Y51	E43-Y47 PolarHBondContact O-N 3.41Å; E43-Y47 VanDerWaalsContact O-N 3.11Å; Y47-Y51 WeakPolarHBondContact O-CB 3.28Å; Y47-Y51 PolarHBondContact O-N 2.79Å
48	W	44.8	Very low	48.8	Very low	165 Å²	165	132 Å²	132	63%	0.625	60%	0.604	S	S	*	*	H	α-helix	trans	-68.9	-44.6	174	-77.3	109.3	0	0	0	113.3	R44 R46 D50 Y51 E52	R44-W48 VanDerWaalsContact O-CD1 3.27Å; R44-W48 PolarHBondContact O-N 3.27Å; R46-W48 VanDerWaalsContact C-N 3.26Å; R46-W48 PolarHBondContact O-N 3.42Å; R46-W48 VanDerWaalsContact O-N 3.15Å; W48-D50 PolarHBondContact O-N 3.34Å; W48-Y51 WeakPolarHBondContact O-CB 3.42Å; W48-Y51 PolarHBondContact O-N 2.84Å; W48-E52 PolarHBondContact O-N 3.06Å; W48-E52 VanDerWaalsContact O-N 3.09Å
49	R	49.9	Very low	48.4	Very low	149 Å²	149	135.9 Å²	135.9	56%	0.562	62%	0.617	S	S	*	*	H	α-helix	trans	-65.1	-37.3	178.5	-85.6	-179	-79.3	177.9	-12.7	113.2	S45 R46 Y51 E52 R53	S45-R49 PolarHBondContact O-NE 3.46Å; S45-R49 VanDerWaalsContact O-NE 3.15Å; S45-R49 PolarHBondContact OG-NH2 3.23Å; R46-R49 PolarHBondContact O-N 3.28Å; R49-Y51 VanDerWaalsContact C-N 3.32Å; R49-E52 PolarHBondContact O-N 3.32Å; R49-R53 VanDerWaalsContact O-CB 3.31Å; R49-R53 WeakPolarHBondContact O-CB 3.38Å; R49-R53 PolarHBondContact O-N 3Å
50	D	52.8	Low	47.9	Very low	94 Å²	94	136.8 Å²	136.8	50%	0.503	62%	0.623	S	S	.	*	H	α-helix	trans	-71.1	-29.9	177.2	-65.8	-37.6	0	0	0	111.6	R46 W48 S54	R46-D50 PolarHBondContact O-N 3.33Å; W48-D50 PolarHBondContact O-N 3.34Å; D50-S54 WeakPolarHBondContact O-CB 3.5Å; D50-S54 PolarHBondContact O-N 3.36Å; D50-S54 PolarHBondContact O-OG 3.14Å
51	Y	44.1	Very low	47.5	Very low	159 Å²	159	137.2 Å²	137.2	62%	0.624	63%	0.633	S	S	*	*	H	α-helix	trans	-68.8	-45.4	172.9	-167	-94.7	0	0	0	112.1	Y47 W48 R49 S54 S55	Y47-Y51 WeakPolarHBondContact O-CB 3.28Å; Y47-Y51 PolarHBondContact O-N 2.79Å; W48-Y51 WeakPolarHBondContact O-CB 3.42Å; W48-Y51 PolarHBondContact O-N 2.84Å; R49-Y51 VanDerWaalsContact C-N 3.32Å; Y51-S54 PolarHBondContact O-N 2.95Å; Y51-S55 PolarHBondContact O-N 2.92Å
52	E	48.8	Very low	47.3	Very low	123 Å²	123	137.1 Å²	137.1	58%	0.575	64%	0.64	S	S	*	*	H	α-helix	trans	-63.2	-50.7	175.7	-70.6	179.2	141	0	0	111.4	W48 R49 S54 S55	W48-E52 PolarHBondContact O-N 3.06Å; W48-E52 VanDerWaalsContact O-N 3.09Å; R49-E52 PolarHBondContact O-N 3.32Å; E52-S54 PolarHBondContact O-N 3.45Å; E52-S55 WeakPolarHBondContact O-CB 3.47Å; E52-S55 PolarHBondContact O-N 3.12Å; E52-S55 PolarHBondContact O-OG 3.21Å
53	R	44.1	Very low	46.9	Very low	182 Å²	182	140.5 Å²	140.5	69%	0.687	66%	0.658	S	S	*	*	H	α-helix	trans	-61.7	-27.3	178.6	179.4	169.3	-79.2	-162.1	-6	113.6	R49 S55 T57	R49-R53 VanDerWaalsContact O-CB 3.31Å; R49-R53 WeakPolarHBondContact O-CB 3.38Å; R49-R53 PolarHBondContact O-N 3Å; R53-S55 VanDerWaalsContact C-N 3.3Å; R53-T57 PolarHBondContact O-OG1 3.48Å; R53-T57 VanDerWaalsContact O-OG1 3.14Å
54	S	47.3	Very low	46.6	Very low	80 Å²	80	146.2 Å²	146.2	56%	0.559	68%	0.675	S	S	*	*	H	α-helix	trans	-75.4	-15.7	173.8	-64.3	0	0	0	0	113.9	D50 Y51 E52	D50-S54 WeakPolarHBondContact O-CB 3.5Å; D50-S54 PolarHBondContact O-N 3.36Å; D50-S54 PolarHBondContact O-OG 3.14Å; Y51-S54 PolarHBondContact O-N 2.95Å; E52-S54 PolarHBondContact O-N 3.45Å
55	S	46.9	Very low	46.4	Very low	89 Å²	89	143.5 Å²	143.5	62%	0.622	68%	0.68	S	S	*	*	H	α-helix	trans	-86.5	-30.4	-179	77.3	0	0	0	0	113.5	Y51 E52 R53	Y51-S55 PolarHBondContact O-N 2.92Å; E52-S55 WeakPolarHBondContact O-CB 3.47Å; E52-S55 PolarHBondContact O-N 3.12Å; E52-S55 PolarHBondContact O-OG 3.21Å; R53-S55 VanDerWaalsContact C-N 3.3Å
56	E	44.5	Very low	45.8	Very low	155 Å²	155	151.5 Å²	151.5	72%	0.724	70%	0.702	S	S	*	*	H	α-helix	trans	-87.1	-21.7	-171.3	-59.9	-173.6	113.3	0	0	113.9	R58	E56-R58 PolarHBondContact O-N 2.94Å
57	T	47.7	Very low	45.2	Very low	106 Å²	106	154.9 Å²	154.9	65%	0.65	72%	0.715	S	S	*	*	S	Bend	trans	-89	18.2	-163.9	44.3	0	0	0	0	115.7	R53	R53-T57 PolarHBondContact O-OG1 3.48Å; R53-T57 VanDerWaalsContact O-OG1 3.14Å
58	R	41.8	Very low	44.7	Very low	228 Å²	228	159 Å²	159	86%	0.86	73%	0.73	S	S	*	*			trans	-121.1	33.2	-175.5	-70.3	-169.7	175.8	177.6	1.5	115.8	E56	E56-R58 PolarHBondContact O-N 2.94Å
59	K	42.3	Very low	44.2	Very low	183 Å²	183	156.4 Å²	156.4	80%	0.796	74%	0.736	S	S	*	*			trans	-120.8	140.6	171	-67.7	175	179.1	169.7	0	110.7
60	H	40.5	Very low	43.6	Very low	179 Å²	179	161.3 Å²	161.3	83%	0.829	76%	0.755	S	S	*	*			trans	68.9	96.8	176.9	-62.8	-87.4	0	0	0	119.1
61	N	41.1	Very low	42.8	Very low	160 Å²	160	162.6 Å²	162.6	86%	0.856	77%	0.771	S	S	*	*				-179.9	110	127.2	-89.4	-32.7	0	0	0	107.9
62	S	45.4	Very low	42.3	Very low	105 Å²	105	166.6 Å²	166.6	73%	0.734	79%	0.785	S	S	*	*				84.9	147.2	79.9	-164.7	0	0	0	0	112.9
63	P	44.8	Very low	42	Very low	119 Å²	119	165.8 Å²	165.8	77%	0.773	79%	0.793	S	S	*	*			cis	-126	-174.6	-42.8	37.6	-22.8	0	0	0	113.6
64	R	44.7	Very low	41.8	Very low	237 Å²	237	168 Å²	168	89%	0.894	80%	0.802	S	S	*	*			trans	-77.2	161.9	178.5	-66.6	175.1	166.8	176.8	-4.7	113.6
65	P	47	Very low	41.7	Very low	120 Å²	120	171.3 Å²	171.3	78%	0.779	81%	0.813	S	S	*	*				-145.7	136.9	107.3	36.4	-21.1	0	0	0	118.7
66	R	42.7	Very low	41.4	Very low	219 Å²	219	176.1 Å²	176.1	83%	0.826	83%	0.826	S	S	*	*			trans	35.9	122.8	138.1	-66.6	177.7	173.2	166.6	-1.9	123.5
67	R	41.3	Very low	41.2	Very low	231 Å²	231	174.1 Å²	174.1	87%	0.872	82%	0.819	S	S	*	*				61.2	110.6	129.6	-62.3	179.9	174.1	-171.2	-1.9	120.2
68	R	36.5	Very low	41.2	Very low	257 Å²	257	172.6 Å²	172.6	97%	0.97	82%	0.818	S	S	*	*				-163.1	157.4	96.8	-115.6	174	174.8	145.3	-3.2	111.4
69	S	34.4	Very low	41.2	Very low	110 Å²	110	171.8 Å²	171.8	77%	0.769	82%	0.821	S	S	*	*			trans	-124.5	137.8	-178.7	44.4	0	0	0	0	111.2
70	R	37	Very low	41.1	Very low	251 Å²	251	171.9 Å²	171.9	95%	0.947	82%	0.816	S	S	*	*			trans	-163.1	135.2	139.9	-113.1	165.9	-179.9	141.4	1.4	110.5
71	S	34.9	Very low	41.2	Very low	122 Å²	122	167.2 Å²	167.2	85%	0.853	80%	0.804	S	S	*	*			trans	-81.2	131.7	-172.8	30.5	0	0	0	0	112.1
72	R	35.3	Very low	41.2	Very low	243 Å²	243	169 Å²	169	92%	0.917	80%	0.804	S	S	*	*			trans	-153.6	146.9	158	-109.1	168.4	-172.4	170.3	1.4	110.2
73	S	41.4	Very low	40.9	Very low	106 Å²	106	175.3 Å²	175.3	74%	0.741	81%	0.811	S	S	*	*			trans	20.9	119.8	158.7	-53.1	0	0	0	0	120.4
74	R	39.7	Very low	40.6	Very low	228 Å²	228	177 Å²	177	86%	0.86	81%	0.813	S	S	*	*	S	Bend		34.5	95.8	116.2	-177.8	-167.1	-72.1	-169.4	-3.7	115.1
75	D	45.9	Very low	40.3	Very low	149 Å²	149	176.3 Å²	176.3	80%	0.797	81%	0.811	S	S	*	*			trans	173.8	-18.9	136.6	-85.8	-16.3	0	0	0	113.8	L77	D75-L77 PolarHBondContact O-N 3.34Å; D75-L77 VanDerWaalsContact O-N 3.13Å
76	E	40.8	Very low	39.8	Very low	191 Å²	191	180.7 Å²	180.7	89%	0.893	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	25.4	-157.8	-145.2	-156.4	158.1	0	0	119.3
77	L	39.3	Very low	39.6	Very low	113 Å²	113	178 Å²	178	59%	0.592	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.5	17.2	177.3	-81.3	-173.7	0	0	0	117.3	D75 F79 R80	D75-L77 PolarHBondContact O-N 3.34Å; D75-L77 VanDerWaalsContact O-N 3.13Å; L77-F79 PolarHBondContact O-N 2.67Å; L77-R80 HydrophobicContact CD2-CB 4.19Å; L77-R80 HydrophobicContact CD2-CG 4.06Å; L77-R80 PolarHBondContact O-N 3.33Å
78	A	48.1	Very low	39.5	Very low	74 Å²	74	173.6 Å²	173.6	61%	0.612	81%	0.809	S	S	*	*	G	3₁₀ helix	trans	-50.8	-29.5	174.7	0	0	0	0	0	114.1	S81	A78-S81 PolarHBondContact O-OG 2.95Å
79	F	41.8	Very low	39.6	Very low	211 Å²	211	169.3 Å²	169.3	93%	0.925	81%	0.805	S	S	*	*	G	3₁₀ helix	trans	-88.2	-2.7	-179.3	-78.2	-87	0	0	0	116.4	L77	L77-F79 PolarHBondContact O-N 2.67Å
80	R	40.2	Very low	39.9	Very low	184 Å²	184	171.7 Å²	171.7	69%	0.694	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-86.8	-10.3	171.2	-101.2	-168.5	168.1	115.7	-4.2	114.3	L77 K82	L77-R80 HydrophobicContact CD2-CB 4.19Å; L77-R80 HydrophobicContact CD2-CG 4.06Å; L77-R80 PolarHBondContact O-N 3.33Å; R80-K82 PolarHBondContact O-N 2.87Å
81	S	43.5	Very low	40.1	Very low	82 Å²	82	163.3 Å²	163.3	57%	0.573	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-5	-171.3	58.3	0	0	0	0	117.1	A78	A78-S81 PolarHBondContact O-OG 2.95Å
82	K	41.3	Very low	40.4	Very low	198 Å²	198	161.8 Å²	161.8	86%	0.861	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	7.2	-173.4	-84	-175.4	174.5	177.9	0	116.3	R80	R80-K82 PolarHBondContact O-N 2.87Å
83	R	38.3	Very low	40.5	Very low	236 Å²	236	157.1 Å²	157.1	89%	0.891	76%	0.756	S	S	*	*	S	Bend	trans	-128.8	11.1	-178.9	-101.7	-175	-175.7	174.9	3.7	117.2
84	L	39.5	Very low	40.5	Very low	155 Å²	155	156.6 Å²	156.6	81%	0.812	75%	0.752	S	S	*	*			trans	-127.3	84	169.3	-66.1	172.9	0	0	0	108.7
85	R	36.7	Very low	40.6	Very low	223 Å²	223	149 Å²	149	84%	0.842	73%	0.734	S	S	*	*			trans	-149.3	28.4	171.7	-71.7	-158.8	-175.2	-153.9	3	112
86	Y	37	Very low	40.3	Very low	212 Å²	212	148.8 Å²	148.8	83%	0.831	72%	0.722	S	S	*	*	S	Bend	trans	-130.4	152.3	162.3	-83.8	-97.4	0	0	0	105.2
87	D	38.4	Very low	40.3	Very low	161 Å²	161	144.8 Å²	144.8	86%	0.861	70%	0.703	S	S	*	*	S	Bend	trans	66.6	60.8	-178.6	-47.9	-48.5	0	0	0	116.1
88	D	39.1	Very low	40.3	Very low	139 Å²	139	149.6 Å²	149.6	74%	0.743	71%	0.714	S	S	*	*			trans	-163.4	59.7	135.5	-134	-33.9	0	0	0	114.5
89	D	38.8	Very low	40	Very low	168 Å²	168	152 Å²	152	90%	0.898	71%	0.712	S	S	*	*			trans	-102.9	52.7	167.9	-88.8	-54.2	0	0	0	110.6	P91	D89-P91 WeakPolarHBondContact O-CD 3.44Å
90	H	41.6	Very low	40.3	Very low	160 Å²	160	146.4 Å²	146.4	74%	0.741	69%	0.685	S	S	*	*			trans	-78.9	117.8	170.6	-85.7	11.8	0	0	0	110.7	T92	H90-T92 PolarHBondContact O-N 3.28Å
91	P	40.6	Very low	40.7	Very low	74 Å²	74	143.8 Å²	143.8	48%	0.481	68%	0.684	S	S	.	*			trans	-70.7	104.9	-177	27.5	-33.8	0	0	0	110.5	D89 R96	D89-P91 WeakPolarHBondContact O-CD 3.44Å; P91-R96 PolarHBondContact O-NE 3.15Å; P91-R96 PolarHBondContact O-NH2 3.42Å
92	T	41.5	Very low	41.1	Very low	91 Å²	91	147.5 Å²	147.5	56%	0.558	69%	0.692	S	S	*	*			trans	-52.3	151.1	170.7	56.7	0	0	0	0	111	H90 S94 S95 R96	H90-T92 PolarHBondContact O-N 3.28Å; T92-S94 PolarHBondContact O-N 2.98Å; T92-S95 WeakPolarHBondContact O-CB 3.42Å; T92-S95 PolarHBondContact O-N 3.26Å; T92-S95 PolarHBondContact OG1-OG 3.1Å; T92-R96 PolarHBondContact O-N 2.85Å
93	E	38.1	Very low	41.8	Very low	145 Å²	145	140 Å²	140	68%	0.678	66%	0.663	S	S	*	*	H	α-helix	trans	-60.9	-31.3	-172.7	-63.9	-171.2	113.6	0	0	113	S95 R96 H97	E93-S95 VanDerWaalsContact C-N 3.29Å; E93-S95 PolarHBondContact O-N 3.03Å; E93-R96 WeakPolarHBondContact O-CB 3.43Å; E93-R96 PolarHBondContact O-N 2.75Å; E93-R96 VanDerWaalsContact O-N 3.08Å; E93-H97 PolarHBondContact O-CD2 3.49Å; E93-H97 PolarHBondContact O-N 3.28Å
94	S	39.9	Very low	42.7	Very low	94 Å²	94	136.9 Å²	136.9	66%	0.657	66%	0.658	S	S	*	*	H	α-helix	trans	-57	-39.3	172.7	-45.1	0	0	0	0	112.8	T92 H97 R98	T92-S94 PolarHBondContact O-N 2.98Å; S94-H97 WeakPolarHBondContact O-CB 3.4Å; S94-H97 PolarHBondContact O-N 3.39Å; S94-R98 PolarHBondContact O-N 2.92Å
95	S	41.4	Very low	43.8	Very low	68 Å²	68	134.5 Å²	134.5	48%	0.476	65%	0.652	S	S	.	*	H	α-helix	trans	-69.7	-34.2	176.4	-62.1	0	0	0	0	111.9	T92 E93 H97 R98 H99	T92-S95 WeakPolarHBondContact O-CB 3.42Å; T92-S95 PolarHBondContact O-N 3.26Å; T92-S95 PolarHBondContact OG1-OG 3.1Å; E93-S95 VanDerWaalsContact C-N 3.29Å; E93-S95 PolarHBondContact O-N 3.03Å; S95-H97 VanDerWaalsContact C-N 3.31Å; S95-H97 PolarHBondContact O-N 3.08Å; S95-R98 PolarHBondContact O-N 2.68Å; S95-H99 PolarHBondContact O-N 3.28Å
96	R	40.3	Very low	45.1	Very low	146 Å²	146	125.9 Å²	125.9	55%	0.551	63%	0.626	S	S	*	*	H	α-helix	trans	-68.3	-29.8	173.5	-54.3	-179.2	-166.2	-179.6	1.6	112.2	P91 T92 E93	P91-R96 PolarHBondContact O-NE 3.15Å; P91-R96 PolarHBondContact O-NH2 3.42Å; T92-R96 PolarHBondContact O-N 2.85Å; E93-R96 WeakPolarHBondContact O-CB 3.43Å; E93-R96 PolarHBondContact O-N 2.75Å; E93-R96 VanDerWaalsContact O-N 3.08Å
97	H	40.1	Very low	46.6	Very low	106 Å²	106	121.8 Å²	121.8	49%	0.491	61%	0.614	S	S	.	*	H	α-helix	trans	-68.8	-37.5	170.7	-89.1	-85.9	0	0	0	113	E93 S94 S95 H99 R100	E93-H97 PolarHBondContact O-CD2 3.49Å; E93-H97 PolarHBondContact O-N 3.28Å; S94-H97 WeakPolarHBondContact O-CB 3.4Å; S94-H97 PolarHBondContact O-N 3.39Å; S95-H97 VanDerWaalsContact C-N 3.31Å; S95-H97 PolarHBondContact O-N 3.08Å; H97-H99 PolarHBondContact O-N 2.63Å; H97-R100 PolarHBondContact CD2-NH2 3.36Å; H97-R100 VanDerWaalsContact CD2-NH2 3.32Å; H97-R100 PolarHBondContact CE1-NH2 3.23Å; H97-R100 VanDerWaalsContact CE1-NH2 3.26Å; H97-R100 PolarHBondContact NE2-NH2 2.87Å; H97-R100 WeakPolarHBondContact O-CB 3.47Å; H97-R100 PolarHBondContact O-N 2.78Å
98	R	39.9	Very low	48	Very low	215 Å²	215	118.1 Å²	118.1	81%	0.811	60%	0.598	S	S	*	*	H	α-helix	trans	-66.2	-37.2	-177.9	-165.7	172.8	-74.4	-174.8	-3.9	112.8	S94 S95 R100	S94-R98 PolarHBondContact O-N 2.92Å; S95-R98 PolarHBondContact O-N 2.68Å; R98-R100 VanDerWaalsContact C-N 3.25Å; R98-R100 PolarHBondContact O-N 3.2Å
99	H	42.8	Very low	49.5	Very low	125 Å²	125	116.5 Å²	116.5	58%	0.579	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-75.8	-8.9	173.9	-156.2	-37.8	0	0	0	113.3	S95 H97 L101	S95-H99 PolarHBondContact O-N 3.28Å; H97-H99 PolarHBondContact O-N 2.63Å; H99-L101 VanDerWaalsContact C-N 3.3Å; H99-L101 PolarHBondContact O-N 2.95Å
100	R	47.4	Very low	50.9	Low	93 Å²	93	110.7 Å²	110.7	35%	0.351	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-77.6	-9.2	-172.9	-149.6	-174.3	-66.5	-148.1	12	114.2	H97 R98 E166	H97-R100 PolarHBondContact CD2-NH2 3.36Å; H97-R100 VanDerWaalsContact CD2-NH2 3.32Å; H97-R100 PolarHBondContact CE1-NH2 3.23Å; H97-R100 VanDerWaalsContact CE1-NH2 3.26Å; H97-R100 PolarHBondContact NE2-NH2 2.87Å; H97-R100 WeakPolarHBondContact O-CB 3.47Å; H97-R100 PolarHBondContact O-N 2.78Å; R98-R100 VanDerWaalsContact C-N 3.25Å; R98-R100 PolarHBondContact O-N 3.2Å; R100-E166 VanDerWaalsContact CD-OE2 3.27Å; R100-E166 WeakPolarHBondContact CD-OE2 3.37Å; R100-E166 IonicContact CZ-OE2 2.67Å; R100-E166 VanDerWaalsContact CZ-OE2 3.22Å; R100-E166 IonicContact NE-OE2 3.64Å; R100-E166 PolarHBondContact NE-OE2 2.92Å; R100-E166 IonicContact NH1-OE2 2.89Å; R100-E166 PolarHBondContact NH1-OE2 2.88Å
101	L	48.7	Very low	52.4	Low	128 Å²	128	104.3 Å²	104.3	67%	0.67	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-102.1	-6.9	-168.6	-68.2	171.9	0	0	0	115.4	H99	H99-L101 VanDerWaalsContact C-N 3.3Å; H99-L101 PolarHBondContact O-N 2.95Å
102	E	50.8	Low	53.5	Low	161 Å²	161	102.5 Å²	102.5	75%	0.752	51%	0.513	S	S	*	.			trans	-107.1	8.9	-172.6	-60.6	-174.2	146.1	0	0	114.2
103	V	57	Low	54.8	Low	41 Å²	41	101.2 Å²	101.2	25%	0.248	52%	0.518	C	S	.	.			trans	-82.8	122	-178.6	-169.9	0	0	0	0	110.7	Y167 A169	V103-Y167 HydrophobicContact CB-CD2 4.24Å; V103-Y167 HydrophobicContact CB-CG 4.22Å; V103-Y167 HydrophobicContact CG1-CG 4.28Å; V103-A169 HydrophobicContact CG1-CB 4.08Å
104	E	58.2	Low	56.3	Low	170 Å²	170	96.4 Å²	96.4	79%	0.794	50%	0.496	S	S	*	.			trans	-63	141.3	173.8	-66.4	-174	138.3	0	0	112	S106	E104-S106 PolarHBondContact O-N 2.96Å; E104-S106 VanDerWaalsContact O-N 3.14Å
105	P	61.8	Low	57.7	Low	105 Å²	105	92.5 Å²	92.5	68%	0.682	47%	0.47	S	S	*	.			trans	-72.8	107	-178.7	28.9	-34.2	0	0	0	112.2	Y167	P105-Y167 HydrophobicContact CB-CE1 4.28Å
106	S	64.5	Low	59	Low	41 Å²	41	94.8 Å²	94.8	29%	0.287	48%	0.483	S	S	.	.			trans	-75.8	164.8	169.5	141.3	0	0	0	0	112.5	E104 T108 F151 S168	E104-S106 PolarHBondContact O-N 2.96Å; E104-S106 VanDerWaalsContact O-N 3.14Å; S106-T108 PolarHBondContact OG-N 3.48Å; S106-T108 VanDerWaalsContact OG-N 3.08Å; S106-F151 VanDerWaalsContact O-CE2 3.28Å; S106-F151 WeakPolarHBondContact O-CE2 3.44Å; S106-F151 WeakPolarHBondContact O-CZ 3.49Å; S106-S168 PolarHBondContact OG-OG 3.38Å; S106-S168 VanDerWaalsContact OG-OG 3.13Å
107	Q	67.9	Low	60.5	Low	126 Å²	126	95.3 Å²	95.3	59%	0.589	49%	0.489	S	S	*	.	S	Bend	trans	-87.4	-15.9	174.3	-68.1	-173.9	26.3	0	0	114.3
108	T	67.4	Low	62	Low	84 Å²	84	91.8 Å²	91.8	52%	0.515	47%	0.472	S	S	.	.			trans	-76.3	136.3	175.8	-50.7	0	0	0	0	109	S106 I110 F151	S106-T108 PolarHBondContact OG-N 3.48Å; S106-T108 VanDerWaalsContact OG-N 3.08Å; T108-I110 HydrophobicContact CG2-CD1 3.66Å; T108-I110 HydrophobicContact CG2-CG1 4.42Å; T108-F151 WeakPolarHBondContact O-CD2 3.48Å; T108-F151 WeakPolarHBondContact O-CE2 3.48Å; T108-F151 WeakPolarHBondContact O-CG 3.3Å
109	I	70.4	Confident	63.6	Low	105 Å²	105	85.9 Å²	85.9	54%	0.538	46%	0.457	S	S	.	.			trans	-118.5	138.8	171.1	-57.6	-174	0	0	0	110.3	F151	I109-F151 VanDerWaalsContact CA-CB 3.46Å; I109-F151 HydrophobicContact CB-CB 4.22Å; I109-F151 HydrophobicContact CB-CD1 4.22Å; I109-F151 HydrophobicContact CB-CG 4.39Å; I109-F151 HydrophobicContact CD1-CD1 4.31Å; I109-F151 HydrophobicContact CD1-CE1 4.45Å; I109-F151 HydrophobicContact CG1-CD1 3.67Å; I109-F151 HydrophobicContact CG1-CE1 4.07Å; I109-F151 HydrophobicContact CG1-CG 4.15Å; I109-F151 HydrophobicContact CG2-CB 4.11Å; I109-F151 HydrophobicContact CG2-CD1 4.17Å
110	I	69.2	Low	65.2	Low	47 Å²	47	83.4 Å²	83.4	24%	0.241	45%	0.448	C	S	.	.			trans	-137.2	134.3	172.1	-50.7	92	0	0	0	111.9	T108 I149 F150 F151	T108-I110 HydrophobicContact CG2-CD1 3.66Å; T108-I110 HydrophobicContact CG2-CG1 4.42Å; I110-I149 WeakPolarHBondContact CB-O 3.41Å; I110-I149 VanDerWaalsContact CD1-O 3.29Å; I110-I149 WeakPolarHBondContact CD1-O 3.35Å; I110-I149 WeakPolarHBondContact CG1-O 3.34Å; I110-I149 WeakPolarHBondContact CG2-O 3.35Å; I110-F150 WeakPolarHBondContact CD1-O 3.13Å; I110-F150 CarbonylContact O-C 3.54Å; I110-F151 VanDerWaalsContact N-CB 3.3Å; I110-F151 PolarHBondContact O-N 2.81Å
111	V	72.1	Confident	66.6	Low	25 Å²	25	80.9 Å²	80.9	15%	0.152	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-98	132.3	-177.6	-170.7	0	0	0	0	110.6	L114 A163 M165	V111-L114 HydrophobicContact CB-CD1 4.13Å; V111-L114 HydrophobicContact CB-CG 4.2Å; V111-L114 HydrophobicContact CG1-CD1 4.38Å; V111-L114 HydrophobicContact CG1-CD2 3.96Å; V111-L114 HydrophobicContact CG1-CG 3.92Å; V111-A163 HydrophobicContact CG1-CB 3.43Å; V111-A163 VanDerWaalsContact CG1-CB 3.43Å; V111-M165 HydrophobicContact CG1-CG 4.24Å; V111-M165 HydrophobicContact CG1-SD 4.41Å; V111-M165 HydrophobicContact CG2-CG 4.36Å; V111-M165 HydrophobicContact CG2-SD 3.74Å
112	K	64.7	Low	68	Low	37 Å²	37	76.6 Å²	76.6	16%	0.161	43%	0.434	C	S	.	.	S	Bend	trans	-100.3	162.4	167.9	-49	-178.7	-156.6	156.8	0	110.4	L114 V148 A163 E164 E166	K112-L114 VanDerWaalsContact C-N 3.27Å; K112-L114 PolarHBondContact O-N 3.29Å; K112-V148 HydrophobicContact CD-CG1 4.45Å; K112-A163 WeakPolarHBondContact O-CA 3.35Å; K112-A163 WeakPolarHBondContact O-CB 3.47Å; K112-E164 WeakPolarHBondContact CA-O 3.44Å; K112-E164 VanDerWaalsContact CB-O 3.24Å; K112-E164 WeakPolarHBondContact CB-O 3.33Å; K112-E164 WeakPolarHBondContact CD-OE2 3.36Å; K112-E164 WeakPolarHBondContact CE-OE2 3.2Å; K112-E164 PolarHBondContact N-O 3.03Å; K112-E164 IonicContact NZ-OE2 3.22Å; K112-E164 PolarHBondContact NZ-OE2 3.32Å; K112-E164 PolarHBondContact O-N 3.17Å; K112-E166 IonicContact NZ-OE1 3.49Å; K112-E166 PolarHBondContact NZ-OE1 2.89Å
113	G	68.1	Low	69.3	Low	63 Å²	63	69.4 Å²	69.4	65%	0.649	40%	0.401	S	S	*	.	S	Bend	trans	81.4	-1.5	175.7	0	0	0	0	0	115.4	A115	G113-A115 PolarHBondContact O-N 3.49Å
114	L	69.7	Low	70.3	Confident	44 Å²	44	72.7 Å²	72.7	23%	0.23	41%	0.409	C	S	.	.			trans	-53.5	127.5	168.7	-65.8	177.1	0	0	0	110.4	V111 K112 V123 I139 I157	V111-L114 HydrophobicContact CB-CD1 4.13Å; V111-L114 HydrophobicContact CB-CG 4.2Å; V111-L114 HydrophobicContact CG1-CD1 4.38Å; V111-L114 HydrophobicContact CG1-CD2 3.96Å; V111-L114 HydrophobicContact CG1-CG 3.92Å; K112-L114 VanDerWaalsContact C-N 3.27Å; K112-L114 PolarHBondContact O-N 3.29Å; L114-V123 HydrophobicContact CD1-CG2 4Å; L114-V123 HydrophobicContact CD2-CG2 4.18Å; L114-I139 HydrophobicContact CD1-CG1 4.48Å; L114-I157 HydrophobicContact CD2-CD1 3.48Å; L114-I157 VanDerWaalsContact CD2-CD1 3.48Å
115	A	68.9	Low	71.4	Confident	12 Å²	12	68.2 Å²	68.2	10%	0.099	40%	0.396	C	S	.	.			trans	-69.5	146.5	173.8	0	0	0	0	0	110.3	G113 K117 Y118	G113-A115 PolarHBondContact O-N 3.49Å; A115-K117 HydrophobicContact CB-CG 3.81Å; A115-K117 PolarHBondContact O-N 3.07Å; A115-Y118 HydrophobicContact CB-CD2 3.88Å; A115-Y118 HydrophobicContact CB-CE2 3.67Å; A115-Y118 WeakPolarHBondContact O-CD2 3.33Å; A115-Y118 PolarHBondContact O-N 3.4Å
116	P	68.8	Low	72.2	Confident	116 Å²	116	64.4 Å²	64.4	75%	0.753	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-13.2	-173.7	25.4	-35.6	0	0	0	114.7	K141	P116-K141 PolarHBondContact O-NZ 3.43Å
117	K	72.8	Confident	72.8	Confident	157 Å²	157	64.1 Å²	64.1	68%	0.683	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-17.1	175.9	58.1	163.9	-176.5	157	0	115.1	A115	A115-K117 HydrophobicContact CB-CG 3.81Å; A115-K117 PolarHBondContact O-N 3.07Å
118	Y	70.6	Confident	73.4	Confident	32 Å²	32	61 Å²	61	13%	0.125	36%	0.358	C	S	.	.			trans	-80.7	146.4	171.9	-57.4	-79.5	0	0	0	110.1	A115 A122 K141 I157 D158	A115-Y118 HydrophobicContact CB-CD2 3.88Å; A115-Y118 HydrophobicContact CB-CE2 3.67Å; A115-Y118 WeakPolarHBondContact O-CD2 3.33Å; A115-Y118 PolarHBondContact O-N 3.4Å; Y118-A122 HydrophobicContact CD1-CB 4.12Å; Y118-K141 PolarHBondContact O-NZ 2.93Å; Y118-I157 HydrophobicContact CE1-CG2 3.91Å; Y118-I157 HydrophobicContact CE2-CG2 4.4Å; Y118-D158 PolarHBondContact OH-OD2 3.13Å
119	D	74.6	Confident	74.1	Confident	91 Å²	91	64.6 Å²	64.6	49%	0.487	37%	0.369	S	S	.	.			trans	-113.6	173.2	174.1	62.8	-0.8	0	0	0	110.5	G121 A122 V123 I139	D119-G121 PolarHBondContact O-N 3.18Å; D119-A122 PolarHBondContact O-N 3.14Å; D119-A122 VanDerWaalsContact OD1-CB 3.23Å; D119-A122 WeakPolarHBondContact OD1-CB 3.4Å; D119-A122 PolarHBondContact OD1-N 2.96Å; D119-V123 PolarHBondContact O-N 2.7Å; D119-I139 WeakPolarHBondContact O-CD1 3.32Å
120	D	76.1	Confident	74.4	Confident	73 Å²	73	65.5 Å²	65.5	39%	0.39	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-28.5	-176.9	-51.7	-80	0	0	0	111.4	W124 I139	D120-W124 WeakPolarHBondContact O-CB 3.24Å; D120-W124 PolarHBondContact O-N 2.87Å; D120-I139 WeakPolarHBondContact OD1-CB 3.47Å; D120-I139 WeakPolarHBondContact OD1-CG1 3.34Å; D120-I139 PolarHBondContact OD1-N 2.9Å
121	G	76.9	Confident	74.9	Confident	40 Å²	40	66.4 Å²	66.4	41%	0.412	39%	0.392	S	S	.	.	H	α-helix	trans	-69.8	-46.8	176	0	0	0	0	0	113.9	D119 V123 W124 S125	D119-G121 PolarHBondContact O-N 3.18Å; G121-V123 VanDerWaalsContact C-N 3.3Å; G121-V123 PolarHBondContact O-N 3.47Å; G121-W124 WeakPolarHBondContact O-CB 3.35Å; G121-W124 PolarHBondContact O-N 2.84Å; G121-S125 PolarHBondContact O-N 3.44Å; G121-S125 PolarHBondContact O-OG 3.12Å
122	A	78.2	Confident	75.1	Confident	39 Å²	39	71.9 Å²	71.9	32%	0.322	41%	0.414	S	S	.	.	H	α-helix	trans	-62.8	-38.4	175.7	0	0	0	0	0	111.9	Y118 D119 A126	Y118-A122 HydrophobicContact CD1-CB 4.12Å; D119-A122 PolarHBondContact O-N 3.14Å; D119-A122 VanDerWaalsContact OD1-CB 3.23Å; D119-A122 WeakPolarHBondContact OD1-CB 3.4Å; D119-A122 PolarHBondContact OD1-N 2.96Å; A122-A126 WeakPolarHBondContact O-CB 3.48Å; A122-A126 PolarHBondContact O-N 3.43Å
123	V	76.5	Confident	75.6	Confident	10 Å²	10	78.6 Å²	78.6	6%	0.061	45%	0.446	C	S	.	.	H	α-helix	trans	-67.3	-40.5	174.3	175.7	0	0	0	0	111.3	L114 D119 G121 A126 I127 V137 I139	L114-V123 HydrophobicContact CD1-CG2 4Å; L114-V123 HydrophobicContact CD2-CG2 4.18Å; D119-V123 PolarHBondContact O-N 2.7Å; G121-V123 VanDerWaalsContact C-N 3.3Å; G121-V123 PolarHBondContact O-N 3.47Å; V123-A126 PolarHBondContact O-N 2.89Å; V123-I127 HydrophobicContact CG1-CD1 3.78Å; V123-I127 HydrophobicContact CG1-CG1 4.48Å; V123-I127 VanDerWaalsContact O-CG1 3.27Å; V123-I127 WeakPolarHBondContact O-CG1 3.33Å; V123-I127 PolarHBondContact O-N 3.24Å; V123-V137 HydrophobicContact CB-CG1 4.2Å; V123-V137 HydrophobicContact CG1-CG1 3.81Å; V123-I139 HydrophobicContact CG2-CD1 3.82Å; V123-I139 HydrophobicContact CG2-CG1 4.49Å
124	W	79	Confident	75.8	Confident	110 Å²	110	76.9 Å²	76.9	42%	0.417	42%	0.424	S	S	.	.	H	α-helix	trans	-59.6	-48.2	174.4	-173.9	-73.2	0	0	0	112.1	D120 G121 I127 T128 P134 V137	D120-W124 WeakPolarHBondContact O-CB 3.24Å; D120-W124 PolarHBondContact O-N 2.87Å; G121-W124 WeakPolarHBondContact O-CB 3.35Å; G121-W124 PolarHBondContact O-N 2.84Å; W124-I127 PolarHBondContact O-N 2.6Å; W124-T128 PolarHBondContact NE1-OG1 3.32Å; W124-T128 WeakPolarHBondContact O-CB 3.44Å; W124-T128 PolarHBondContact O-N 3.46Å; W124-T128 PolarHBondContact O-OG1 2.79Å; W124-P134 HydrophobicContact CD2-CG 3.96Å; W124-P134 HydrophobicContact CE3-CG 3.8Å; W124-P134 HydrophobicContact CH2-CG 4.04Å; W124-P134 WeakPolarHBondContact CH2-O 3.38Å; W124-P134 HydrophobicContact CZ2-CG 4.19Å; W124-P134 HydrophobicContact CZ3-CG 3.84Å; W124-V137 HydrophobicContact CE3-CB 4.17Å; W124-V137 HydrophobicContact CE3-CG2 3.63Å; W124-V137 HydrophobicContact CZ3-CG2 4.11Å
125	S	80.8	Confident	75.9	Confident	76 Å²	76	83.7 Å²	83.7	53%	0.531	45%	0.451	S	S	.	.	H	α-helix	trans	-60.7	-46.5	178.1	-66.5	0	0	0	0	111.8	G121 I127 T128 E129	G121-S125 PolarHBondContact O-N 3.44Å; G121-S125 PolarHBondContact O-OG 3.12Å; S125-I127 VanDerWaalsContact C-N 3.34Å; S125-I127 PolarHBondContact O-N 2.99Å; S125-T128 PolarHBondContact O-N 2.89Å; S125-T128 VanDerWaalsContact O-N 3.14Å; S125-E129 WeakPolarHBondContact O-CB 3.3Å; S125-E129 PolarHBondContact O-N 3.18Å
126	A	78.3	Confident	76	Confident	24 Å²	24	87.5 Å²	87.5	20%	0.198	47%	0.47	C	S	.	.	H	α-helix	trans	-62	-38	178.4	0	0	0	0	0	112.9	A122 V123 Q130	A122-A126 WeakPolarHBondContact O-CB 3.48Å; A122-A126 PolarHBondContact O-N 3.43Å; V123-A126 PolarHBondContact O-N 2.89Å; A126-Q130 WeakPolarHBondContact O-CG 3.33Å; A126-Q130 PolarHBondContact O-N 2.99Å
127	I	76.9	Confident	76.3	Confident	35 Å²	35	83.3 Å²	83.3	18%	0.179	44%	0.442	C	S	.	.	H	α-helix	trans	-69.3	-38.4	175.1	-65	167.1	0	0	0	110.9	V123 W124 S125 Q130 F132 P134 V137	V123-I127 HydrophobicContact CG1-CD1 3.78Å; V123-I127 HydrophobicContact CG1-CG1 4.48Å; V123-I127 VanDerWaalsContact O-CG1 3.27Å; V123-I127 WeakPolarHBondContact O-CG1 3.33Å; V123-I127 PolarHBondContact O-N 3.24Å; W124-I127 PolarHBondContact O-N 2.6Å; S125-I127 VanDerWaalsContact C-N 3.34Å; S125-I127 PolarHBondContact O-N 2.99Å; I127-Q130 PolarHBondContact O-N 3.36Å; I127-F132 CarbonylContact C-O 3.58Å; I127-F132 HydrophobicContact CG2-CB 3.81Å; I127-F132 PolarHBondContact O-N 2.86Å; I127-P134 HydrophobicContact CG2-CB 4.43Å; I127-P134 HydrophobicContact CG2-CG 4.08Å; I127-V137 HydrophobicContact CD1-CG2 4.43Å
128	T	81.3	Confident	76.2	Confident	60 Å²	60	84.4 Å²	84.4	37%	0.368	44%	0.442	S	S	.	.	H	α-helix	trans	-67.8	-38.7	178.4	-54.3	0	0	0	0	112	W124 S125 Q130 G131 F132	W124-T128 PolarHBondContact NE1-OG1 3.32Å; W124-T128 WeakPolarHBondContact O-CB 3.44Å; W124-T128 PolarHBondContact O-N 3.46Å; W124-T128 PolarHBondContact O-OG1 2.79Å; S125-T128 PolarHBondContact O-N 2.89Å; S125-T128 VanDerWaalsContact O-N 3.14Å; T128-Q130 VanDerWaalsContact C-N 3.29Å; T128-Q130 PolarHBondContact O-N 2.84Å; T128-G131 WeakPolarHBondContact O-CA 3.42Å; T128-G131 PolarHBondContact O-N 2.95Å; T128-F132 WeakPolarHBondContact CA-O 3.36Å
129	E	81.3	Confident	76.3	Confident	160 Å²	160	84.9 Å²	84.9	75%	0.748	45%	0.446	S	S	*	.	H	α-helix	trans	-62.8	-34.3	175.6	-175.9	175	-159.6	0	0	112.2	S125 G131	S125-E129 WeakPolarHBondContact O-CB 3.3Å; S125-E129 PolarHBondContact O-N 3.18Å; E129-G131 PolarHBondContact O-N 2.88Å
130	Q	77	Confident	75.9	Confident	124 Å²	124	87.1 Å²	87.1	58%	0.579	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	7.3	171.2	-59.3	-57.4	-59	0	0	113.6	A126 I127 T128 F132	A126-Q130 WeakPolarHBondContact O-CG 3.33Å; A126-Q130 PolarHBondContact O-N 2.99Å; I127-Q130 PolarHBondContact O-N 3.36Å; T128-Q130 VanDerWaalsContact C-N 3.29Å; T128-Q130 PolarHBondContact O-N 2.84Å; Q130-F132 HydrophobicContact CB-CD2 4.08Å; Q130-F132 HydrophobicContact CB-CE2 4.4Å; Q130-F132 WeakPolarHBondContact O-CD2 3.27Å; Q130-F132 VanDerWaalsContact O-CE2 3.31Å; Q130-F132 WeakPolarHBondContact O-CE2 3.45Å
131	G	79.6	Confident	75.3	Confident	67 Å²	67	89.9 Å²	89.9	69%	0.691	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	9	174.4	0	0	0	0	0	115.7	T128 E129	T128-G131 WeakPolarHBondContact O-CA 3.42Å; T128-G131 PolarHBondContact O-N 2.95Å; E129-G131 PolarHBondContact O-N 2.88Å
132	F	76.8	Confident	74.3	Confident	140 Å²	140	94.9 Å²	94.9	61%	0.614	47%	0.472	S	S	*	.			trans	-105.9	137.1	-178.6	-62.3	-84.6	0	0	0	111.8	I127 T128 Q130 P134	I127-F132 CarbonylContact C-O 3.58Å; I127-F132 HydrophobicContact CG2-CB 3.81Å; I127-F132 PolarHBondContact O-N 2.86Å; T128-F132 WeakPolarHBondContact CA-O 3.36Å; Q130-F132 HydrophobicContact CB-CD2 4.08Å; Q130-F132 HydrophobicContact CB-CE2 4.4Å; Q130-F132 WeakPolarHBondContact O-CD2 3.27Å; Q130-F132 VanDerWaalsContact O-CE2 3.31Å; Q130-F132 WeakPolarHBondContact O-CE2 3.45Å; F132-P134 WeakPolarHBondContact O-CD 3.35Å
133	Q	75.5	Confident	73.2	Confident	178 Å²	178	104.2 Å²	104.2	83%	0.832	50%	0.499	S	S	*	.			trans	-102.2	104	172.4	-68.4	-174.6	-5.2	0	0	109.9
134	P	71.7	Confident	72	Confident	27 Å²	27	110 Å²	110	18%	0.175	53%	0.53	C	S	.	.			trans	-71.6	148.3	176.7	29.8	-32.5	0	0	0	110.7	W124 I127 F132 V137	W124-P134 HydrophobicContact CD2-CG 3.96Å; W124-P134 HydrophobicContact CE3-CG 3.8Å; W124-P134 HydrophobicContact CH2-CG 4.04Å; W124-P134 WeakPolarHBondContact CH2-O 3.38Å; W124-P134 HydrophobicContact CZ2-CG 4.19Å; W124-P134 HydrophobicContact CZ3-CG 3.84Å; I127-P134 HydrophobicContact CG2-CB 4.43Å; I127-P134 HydrophobicContact CG2-CG 4.08Å; F132-P134 WeakPolarHBondContact O-CD 3.35Å; P134-V137 HydrophobicContact CB-CG2 3.74Å; P134-V137 HydrophobicContact CG-CG2 3.67Å
135	K	72.4	Confident	70.2	Confident	186 Å²	186	109.5 Å²	109.5	81%	0.809	54%	0.539	S	S	*	.	S	Bend	trans	-79.1	-29.5	175.1	-69.1	178.4	-178.5	170.1	0	113
136	D	70.1	Confident	68.2	Low	92 Å²	92	110 Å²	110	49%	0.492	56%	0.556	S	S	.	*			trans	-161.5	145.7	-175.1	-169.7	-8.3	0	0	0	107.5	R138	D136-R138 WeakPolarHBondContact OD1-CG 3.31Å; D136-R138 IonicContact OD1-CZ 2.68Å; D136-R138 IonicContact OD1-NE 2.67Å; D136-R138 PolarHBondContact OD1-NE 3.36Å; D136-R138 VanDerWaalsContact OD1-NE 3.15Å; D136-R138 IonicContact OD1-NH2 2.84Å; D136-R138 IonicContact OD2-CZ 3.59Å; D136-R138 IonicContact OD2-NE 2.67Å; D136-R138 PolarHBondContact OD2-NE 3.37Å; D136-R138 IonicContact OD2-NH2 3.68Å; D136-R138 PolarHBondContact OD2-NH2 2.97Å
137	V	75.5	Confident	66.1	Low	28 Å²	28	110 Å²	110	17%	0.17	56%	0.558	C	S	.	*			trans	-140.1	126.3	178.8	176.5	0	0	0	0	107.6	V123 W124 I127 P134	V123-V137 HydrophobicContact CB-CG1 4.2Å; V123-V137 HydrophobicContact CG1-CG1 3.81Å; W124-V137 HydrophobicContact CE3-CB 4.17Å; W124-V137 HydrophobicContact CE3-CG2 3.63Å; W124-V137 HydrophobicContact CZ3-CG2 4.11Å; I127-V137 HydrophobicContact CD1-CG2 4.43Å; P134-V137 HydrophobicContact CB-CG2 3.74Å; P134-V137 HydrophobicContact CG-CG2 3.67Å
138	R	71.3	Confident	64.2	Low	180 Å²	180	111.9 Å²	111.9	68%	0.679	57%	0.571	S	S	*	*			trans	-142.4	116.7	-177.2	-54	-173.6	-170.9	-154.6	4.1	112.3	D136 L140	D136-R138 WeakPolarHBondContact OD1-CG 3.31Å; D136-R138 IonicContact OD1-CZ 2.68Å; D136-R138 IonicContact OD1-NE 2.67Å; D136-R138 PolarHBondContact OD1-NE 3.36Å; D136-R138 VanDerWaalsContact OD1-NE 3.15Å; D136-R138 IonicContact OD1-NH2 2.84Å; D136-R138 IonicContact OD2-CZ 3.59Å; D136-R138 IonicContact OD2-NE 2.67Å; D136-R138 PolarHBondContact OD2-NE 3.37Å; D136-R138 IonicContact OD2-NH2 3.68Å; D136-R138 PolarHBondContact OD2-NH2 2.97Å; R138-L140 HydrophobicContact CB-CD1 4.4Å
139	I	72.8	Confident	62.3	Low	42 Å²	42	113.5 Å²	113.5	22%	0.215	58%	0.577	C	S	.	*			trans	-89.4	110	175.8	-61.7	175.1	0	0	0	110.8	L114 D119 D120 V123 K141	L114-I139 HydrophobicContact CD1-CG1 4.48Å; D119-I139 WeakPolarHBondContact O-CD1 3.32Å; D120-I139 WeakPolarHBondContact OD1-CB 3.47Å; D120-I139 WeakPolarHBondContact OD1-CG1 3.34Å; D120-I139 PolarHBondContact OD1-N 2.9Å; V123-I139 HydrophobicContact CG2-CD1 3.82Å; V123-I139 HydrophobicContact CG2-CG1 4.49Å; I139-K141 HydrophobicContact CG2-CG 3.89Å; I139-K141 PolarHBondContact O-N 3.09Å
140	L	65.1	Low	60	Low	138 Å²	138	109 Å²	109	72%	0.723	56%	0.555	S	S	*	*			trans	-83.8	100.8	172.7	-79	72.9	0	0	0	110.7	R138 R142	R138-L140 HydrophobicContact CB-CD1 4.4Å; L140-R142 PolarHBondContact O-N 3.32Å
141	K	63.6	Low	57.9	Low	131 Å²	131	103.9 Å²	103.9	57%	0.57	53%	0.531	S	S	*	.			trans	-81.7	99.4	176.5	-56.8	-165.1	-179.4	-162.8	0	110.6	P116 Y118 I139	P116-K141 PolarHBondContact O-NZ 3.43Å; Y118-K141 PolarHBondContact O-NZ 2.93Å; I139-K141 HydrophobicContact CG2-CG 3.89Å; I139-K141 PolarHBondContact O-N 3.09Å
142	R	56.4	Low	55.4	Low	145 Å²	145	103.7 Å²	103.7	55%	0.547	52%	0.516	S	S	.	.			trans	-68.8	141.9	176.1	-170.3	169.5	172.1	177.4	-7.1	111.1	L140 T145	L140-R142 PolarHBondContact O-N 3.32Å; R142-T145 VanDerWaalsContact CD-O 3.24Å; R142-T145 WeakPolarHBondContact CD-O 3.45Å; R142-T145 WeakPolarHBondContact CG-O 3.44Å
143	R	55.5	Low	53.5	Low	236 Å²	236	98.6 Å²	98.6	89%	0.891	50%	0.503	S	S	*	.	S	Bend	trans	-90.8	-21	-152.6	-156.4	176.1	-162.1	169.9	2.3	115.9
144	D	51.2	Low	51.8	Low	130 Å²	130	99 Å²	99	70%	0.695	50%	0.498	S	S	*	.	S	Bend	trans	-133.6	-39.6	-164.9	2.9	-97.3	0	0	0	112.6
145	T	41.5	Very low	50.8	Low	100 Å²	100	98.8 Å²	98.8	61%	0.613	50%	0.495	S	S	*	.	S	Bend	trans	-139.7	131.1	168	39	0	0	0	0	109.3	R142 G147	R142-T145 VanDerWaalsContact CD-O 3.24Å; R142-T145 WeakPolarHBondContact CD-O 3.45Å; R142-T145 WeakPolarHBondContact CG-O 3.44Å; T145-G147 PolarHBondContact O-N 3.33Å; T145-G147 VanDerWaalsContact O-N 3.17Å
146	G	38.2	Very low	49.7	Very low	86 Å²	86	93.7 Å²	93.7	89%	0.887	48%	0.48	S	S	*	.			trans	-67.2	112.1	-168.6	0	0	0	0	0	112.5
147	G	34.5	Very low	49	Very low	24 Å²	24	90.2 Å²	90.2	25%	0.247	46%	0.461	C	S	.	.			trans	-151.7	123.9	-169	0	0	0	0	0	116.7	T145	T145-G147 PolarHBondContact O-N 3.33Å; T145-G147 VanDerWaalsContact O-N 3.17Å
148	V	37.4	Very low	48.1	Very low	75 Å²	75	93.9 Å²	93.9	46%	0.455	48%	0.48	S	S	.	.			trans	55	130.9	134.8	-143.6	0	0	0	0	119.5	K112 F150	K112-V148 HydrophobicContact CD-CG1 4.45Å; V148-F150 HydrophobicContact CG1-CD2 3.96Å; V148-F150 HydrophobicContact CG1-CE1 4.04Å; V148-F150 HydrophobicContact CG1-CE2 3.38Å; V148-F150 HydrophobicContact CG1-CG 4.49Å; V148-F150 HydrophobicContact CG1-CZ 3.42Å; V148-F150 VanDerWaalsContact CG1-CZ 3.42Å
149	I	40.8	Very low	47.2	Very low	95 Å²	95	92.2 Å²	92.2	49%	0.487	48%	0.484	S	S	.	.				-176.4	67.1	125.3	-87.1	149.3	0	0	0	113	I110	I110-I149 WeakPolarHBondContact CB-O 3.41Å; I110-I149 VanDerWaalsContact CD1-O 3.29Å; I110-I149 WeakPolarHBondContact CD1-O 3.35Å; I110-I149 WeakPolarHBondContact CG1-O 3.34Å; I110-I149 WeakPolarHBondContact CG2-O 3.35Å
150	F	32.7	Very low	46.3	Very low	64 Å²	64	98.8 Å²	98.8	28%	0.281	51%	0.514	S	S	.	.			trans	55.9	105.1	136.5	-55.5	-68.3	0	0	0	126.1	I110 V148 E166 S168	I110-F150 WeakPolarHBondContact CD1-O 3.13Å; I110-F150 CarbonylContact O-C 3.54Å; V148-F150 HydrophobicContact CG1-CD2 3.96Å; V148-F150 HydrophobicContact CG1-CE1 4.04Å; V148-F150 HydrophobicContact CG1-CE2 3.38Å; V148-F150 HydrophobicContact CG1-CG 4.49Å; V148-F150 HydrophobicContact CG1-CZ 3.42Å; V148-F150 VanDerWaalsContact CG1-CZ 3.42Å; F150-E166 CarbonylContact C-O 3.45Å; F150-E166 WeakPolarHBondContact CA-O 3.4Å; F150-E166 WeakPolarHBondContact CB-O 3.3Å; F150-E166 HydrophobicContact CD1-CB 3.93Å; F150-S168 VanDerWaalsContact O-CA 3.29Å; F150-S168 WeakPolarHBondContact O-CA 3.4Å; F150-S168 WeakPolarHBondContact O-CB 3.16Å; F150-S168 PolarHBondContact O-N 3.24Å
151	F	32.9	Very low	45.9	Very low	18 Å²	18	99.3 Å²	99.3	8%	0.079	51%	0.506	C	S	.	.				-154.6	146.5	129.8	-170.2	-86.4	0	0	0	114.3	S106 T108 I109 I110 M165 E166 Y167 S168	S106-F151 VanDerWaalsContact O-CE2 3.28Å; S106-F151 WeakPolarHBondContact O-CE2 3.44Å; S106-F151 WeakPolarHBondContact O-CZ 3.49Å; T108-F151 WeakPolarHBondContact O-CD2 3.48Å; T108-F151 WeakPolarHBondContact O-CE2 3.48Å; T108-F151 WeakPolarHBondContact O-CG 3.3Å; I109-F151 VanDerWaalsContact CA-CB 3.46Å; I109-F151 HydrophobicContact CB-CB 4.22Å; I109-F151 HydrophobicContact CB-CD1 4.22Å; I109-F151 HydrophobicContact CB-CG 4.39Å; I109-F151 HydrophobicContact CD1-CD1 4.31Å; I109-F151 HydrophobicContact CD1-CE1 4.45Å; I109-F151 HydrophobicContact CG1-CD1 3.67Å; I109-F151 HydrophobicContact CG1-CE1 4.07Å; I109-F151 HydrophobicContact CG1-CG 4.15Å; I109-F151 HydrophobicContact CG2-CB 4.11Å; I109-F151 HydrophobicContact CG2-CD1 4.17Å; I110-F151 VanDerWaalsContact N-CB 3.3Å; I110-F151 PolarHBondContact O-N 2.81Å; F151-M165 VanDerWaalsContact C-C 3.42Å; F151-M165 CarbonylContact O-C 3.46Å; F151-M165 WeakPolarHBondContact O-CA 3.37Å; F151-M165 WeakPolarHBondContact O-CB 3.41Å; F151-E166 VanDerWaalsContact C-CA 3.48Å; F151-E166 CarbonylContact C-O 3.54Å; F151-E166 WeakPolarHBondContact CA-O 3.42Å; F151-E166 PolarHBondContact N-O 3.23Å; F151-E166 PolarHBondContact O-N 2.87Å; F151-Y167 HydrophobicContact CD1-CD1 4.46Å; F151-Y167 HydrophobicContact CD2-CD1 4.04Å; F151-Y167 HydrophobicContact CE1-CD1 4.03Å; F151-Y167 AromaticContact CE1-CE1 3.96Å; F151-Y167 HydrophobicContact CE1-CE1 3.96Å; F151-Y167 AromaticContact CE2-CD1 3.58Å; F151-Y167 HydrophobicContact CE2-CD1 3.58Å; F151-Y167 HydrophobicContact CE2-CE1 4.03Å; F151-Y167 HydrophobicContact CG-CD1 4.47Å; F151-Y167 AromaticContact CZ-CD1 3.58Å; F151-Y167 HydrophobicContact CZ-CD1 3.58Å; F151-Y167 AromaticContact CZ-CE1 3.55Å; F151-Y167 HydrophobicContact CZ-CE1 3.55Å; F151-S168 VanDerWaalsContact CD2-N 3.32Å
152	V	28.2	Very low	45.6	Very low	63 Å²	63	98.1 Å²	98.1	38%	0.382	51%	0.509	S	S	.	.	S	Bend	trans	-52.6	140.8	-166	137	0	0	0	0	118.9	M165 Y167	V152-M165 CarbonylContact C-O 3.57Å; V152-M165 VanDerWaalsContact CA-C 3.47Å; V152-M165 VanDerWaalsContact CA-O 3.25Å; V152-M165 WeakPolarHBondContact CA-O 3.46Å; V152-Y167 HydrophobicContact CB-CD1 3.92Å; V152-Y167 HydrophobicContact CB-CD2 4.03Å; V152-Y167 HydrophobicContact CB-CE1 3.92Å; V152-Y167 HydrophobicContact CB-CE2 4.05Å; V152-Y167 HydrophobicContact CB-CG 3.95Å; V152-Y167 HydrophobicContact CG1-CE1 4.34Å; V152-Y167 HydrophobicContact CG1-CE2 4.39Å; V152-Y167 HydrophobicContact CG2-CD1 4.23Å; V152-Y167 HydrophobicContact CG2-CD2 3.44Å; V152-Y167 VanDerWaalsContact CG2-CD2 3.44Å; V152-Y167 HydrophobicContact CG2-CE1 4.4Å; V152-Y167 HydrophobicContact CG2-CE2 3.65Å; V152-Y167 HydrophobicContact CG2-CG 3.75Å; V152-Y167 VanDerWaalsContact N-N 3.11Å
153	G	36.9	Very low	45.8	Very low	32 Å²	32	91.4 Å²	91.4	33%	0.33	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	138.7	-170.5	165.9	0	0	0	0	0	115.1	M165	G153-M165 PolarHBondContact N-O 3.2Å; G153-M165 WeakPolarHBondContact O-CA 3.35Å; G153-M165 WeakPolarHBondContact O-CB 3.11Å; G153-M165 WeakPolarHBondContact O-CG 3.43Å; G153-M165 PolarHBondContact O-N 3.03Å; G153-M165 VanDerWaalsContact O-O 3.12Å
154	Y	39.4	Very low	45.9	Very low	187 Å²	187	84.2 Å²	84.2	73%	0.733	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.9	165.8	50.3	-97.3	0	0	0	111	A163	Y154-A163 WeakPolarHBondContact CA-O 3.42Å
155	L	50.9	Low	46.3	Very low	22 Å²	22	79.3 Å²	79.3	12%	0.115	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.7	169.2	-153.7	77.8	0	0	0	108.6	I157 A163 M165	L155-I157 HydrophobicContact CD2-CD1 4.22Å; L155-I157 HydrophobicContact CD2-CG1 4.17Å; L155-I157 HydrophobicContact CG-CG1 4.49Å; L155-A163 HydrophobicContact CB-CB 4.24Å; L155-A163 PolarHBondContact N-O 3.21Å; L155-A163 VanDerWaalsContact N-O 3.09Å; L155-A163 WeakPolarHBondContact O-CB 3.26Å; L155-A163 PolarHBondContact O-N 2.9Å; L155-M165 HydrophobicContact CB-SD 3.92Å
156	V	48.9	Very low	47.1	Very low	80 Å²	80	76.2 Å²	76.2	49%	0.485	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.2	172.8	-179.1	0	0	0	0	108
157	I	56.6	Low	48	Very low	18 Å²	18	76 Å²	76	9%	0.092	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.3	176.9	-54.9	175.1	0	0	0	107.9	L114 Y118 L155 N159 R161 A163	L114-I157 HydrophobicContact CD2-CD1 3.48Å; L114-I157 VanDerWaalsContact CD2-CD1 3.48Å; Y118-I157 HydrophobicContact CE1-CG2 3.91Å; Y118-I157 HydrophobicContact CE2-CG2 4.4Å; L155-I157 HydrophobicContact CD2-CD1 4.22Å; L155-I157 HydrophobicContact CD2-CG1 4.17Å; L155-I157 HydrophobicContact CG-CG1 4.49Å; I157-N159 VanDerWaalsContact C-N 3.33Å; I157-N159 PolarHBondContact O-N 2.98Å; I157-R161 PolarHBondContact N-O 3.49Å; I157-R161 PolarHBondContact O-N 3.41Å; I157-R161 VanDerWaalsContact O-N 3.16Å; I157-A163 HydrophobicContact CD1-CB 4.32Å
158	D	55.8	Low	49	Very low	106 Å²	106	75.8 Å²	75.8	57%	0.567	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	41.7	175.8	-54.1	-28.8	0	0	0	114.7	Y118 H160	Y118-D158 PolarHBondContact OH-OD2 3.13Å; D158-H160 PolarHBondContact O-CD2 3.02Å; D158-H160 PolarHBondContact O-N 2.82Å
159	N	52.9	Low	49.8	Very low	145 Å²	145	74.6 Å²	74.6	78%	0.775	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	-3.4	178.2	-73	-17.2	0	0	0	117.8	I157	I157-N159 VanDerWaalsContact C-N 3.33Å; I157-N159 PolarHBondContact O-N 2.98Å
160	H	53.9	Low	50	Low	180 Å²	180	75.2 Å²	75.2	83%	0.833	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.3	-0.4	-169.1	-63.7	-55.6	0	0	0	114	D158	D158-H160 PolarHBondContact O-CD2 3.02Å; D158-H160 PolarHBondContact O-N 2.82Å
161	R	56.3	Low	50.4	Low	148 Å²	148	81.4 Å²	81.4	56%	0.558	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	120.1	173.3	-68.3	-170.5	175.2	-142.2	-3.9	111.7	I157	I157-R161 PolarHBondContact N-O 3.49Å; I157-R161 PolarHBondContact O-N 3.41Å; I157-R161 VanDerWaalsContact O-N 3.16Å
162	V	58.1	Low	50.7	Low	106 Å²	106	86 Å²	86	64%	0.642	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	115.8	169.1	-174.7	0	0	0	0	107.9
163	A	59.2	Low	51.3	Low	4 Å²	4	86.8 Å²	86.8	3%	0.033	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	115.2	176.1	0	0	0	0	0	109.3	V111 K112 Y154 L155 I157 M165	V111-A163 HydrophobicContact CG1-CB 3.43Å; V111-A163 VanDerWaalsContact CG1-CB 3.43Å; K112-A163 WeakPolarHBondContact O-CA 3.35Å; K112-A163 WeakPolarHBondContact O-CB 3.47Å; Y154-A163 WeakPolarHBondContact CA-O 3.42Å; L155-A163 HydrophobicContact CB-CB 4.24Å; L155-A163 PolarHBondContact N-O 3.21Å; L155-A163 VanDerWaalsContact N-O 3.09Å; L155-A163 WeakPolarHBondContact O-CB 3.26Å; L155-A163 PolarHBondContact O-N 2.9Å; I157-A163 HydrophobicContact CD1-CB 4.32Å; A163-M165 WeakPolarHBondContact O-CG 3.35Å
164	E	58	Low	51.2	Low	86 Å²	86	91.4 Å²	91.4	40%	0.402	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	130.2	178.2	-174.7	-163	-137.9	0	0	110.1	K112 E166	K112-E164 WeakPolarHBondContact CA-O 3.44Å; K112-E164 VanDerWaalsContact CB-O 3.24Å; K112-E164 WeakPolarHBondContact CB-O 3.33Å; K112-E164 WeakPolarHBondContact CD-OE2 3.36Å; K112-E164 WeakPolarHBondContact CE-OE2 3.2Å; K112-E164 PolarHBondContact N-O 3.03Å; K112-E164 IonicContact NZ-OE2 3.22Å; K112-E164 PolarHBondContact NZ-OE2 3.32Å; K112-E164 PolarHBondContact O-N 3.17Å; E164-E166 HydrophobicContact CG-CG 4.25Å
165	M	59.8	Low	50.7	Low	27 Å²	27	85.7 Å²	85.7	13%	0.133	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131	170.5	-23.5	-169.6	-75.8	0	0	106.2	V111 F151 V152 G153 L155 A163	V111-M165 HydrophobicContact CG1-CG 4.24Å; V111-M165 HydrophobicContact CG1-SD 4.41Å; V111-M165 HydrophobicContact CG2-CG 4.36Å; V111-M165 HydrophobicContact CG2-SD 3.74Å; F151-M165 VanDerWaalsContact C-C 3.42Å; F151-M165 CarbonylContact O-C 3.46Å; F151-M165 WeakPolarHBondContact O-CA 3.37Å; F151-M165 WeakPolarHBondContact O-CB 3.41Å; V152-M165 CarbonylContact C-O 3.57Å; V152-M165 VanDerWaalsContact CA-C 3.47Å; V152-M165 VanDerWaalsContact CA-O 3.25Å; V152-M165 WeakPolarHBondContact CA-O 3.46Å; G153-M165 PolarHBondContact N-O 3.2Å; G153-M165 WeakPolarHBondContact O-CA 3.35Å; G153-M165 WeakPolarHBondContact O-CB 3.11Å; G153-M165 WeakPolarHBondContact O-CG 3.43Å; G153-M165 PolarHBondContact O-N 3.03Å; G153-M165 VanDerWaalsContact O-O 3.12Å; L155-M165 HydrophobicContact CB-SD 3.92Å; A163-M165 WeakPolarHBondContact O-CG 3.35Å
166	E	57.2	Low	49.9	Very low	34 Å²	34	90.1 Å²	90.1	16%	0.159	49%	0.491	C	S	.	.			trans	-138.3	129.2	-177.8	-95	-152.2	-56.4	0	0	114.4	R100 K112 F150 F151 E164	R100-E166 VanDerWaalsContact CD-OE2 3.27Å; R100-E166 WeakPolarHBondContact CD-OE2 3.37Å; R100-E166 IonicContact CZ-OE2 2.67Å; R100-E166 VanDerWaalsContact CZ-OE2 3.22Å; R100-E166 IonicContact NE-OE2 3.64Å; R100-E166 PolarHBondContact NE-OE2 2.92Å; R100-E166 IonicContact NH1-OE2 2.89Å; R100-E166 PolarHBondContact NH1-OE2 2.88Å; K112-E166 IonicContact NZ-OE1 3.49Å; K112-E166 PolarHBondContact NZ-OE1 2.89Å; F150-E166 CarbonylContact C-O 3.45Å; F150-E166 WeakPolarHBondContact CA-O 3.4Å; F150-E166 WeakPolarHBondContact CB-O 3.3Å; F150-E166 HydrophobicContact CD1-CB 3.93Å; F151-E166 VanDerWaalsContact C-CA 3.48Å; F151-E166 CarbonylContact C-O 3.54Å; F151-E166 WeakPolarHBondContact CA-O 3.42Å; F151-E166 PolarHBondContact N-O 3.23Å; F151-E166 PolarHBondContact O-N 2.87Å; E164-E166 HydrophobicContact CG-CG 4.25Å
167	Y	58.9	Low	49.3	Very low	81 Å²	81	90.1 Å²	90.1	32%	0.318	49%	0.492	S	S	.	.			trans	-36.2	128.7	-164.5	-81.4	-58.8	0	0	0	119.9	V103 P105 F151 V152 A169	V103-Y167 HydrophobicContact CB-CD2 4.24Å; V103-Y167 HydrophobicContact CB-CG 4.22Å; V103-Y167 HydrophobicContact CG1-CG 4.28Å; P105-Y167 HydrophobicContact CB-CE1 4.28Å; F151-Y167 HydrophobicContact CD1-CD1 4.46Å; F151-Y167 HydrophobicContact CD2-CD1 4.04Å; F151-Y167 HydrophobicContact CE1-CD1 4.03Å; F151-Y167 AromaticContact CE1-CE1 3.96Å; F151-Y167 HydrophobicContact CE1-CE1 3.96Å; F151-Y167 AromaticContact CE2-CD1 3.58Å; F151-Y167 HydrophobicContact CE2-CD1 3.58Å; F151-Y167 HydrophobicContact CE2-CE1 4.03Å; F151-Y167 HydrophobicContact CG-CD1 4.47Å; F151-Y167 AromaticContact CZ-CD1 3.58Å; F151-Y167 HydrophobicContact CZ-CD1 3.58Å; F151-Y167 AromaticContact CZ-CE1 3.55Å; F151-Y167 HydrophobicContact CZ-CE1 3.55Å; V152-Y167 HydrophobicContact CB-CD1 3.92Å; V152-Y167 HydrophobicContact CB-CD2 4.03Å; V152-Y167 HydrophobicContact CB-CE1 3.92Å; V152-Y167 HydrophobicContact CB-CE2 4.05Å; V152-Y167 HydrophobicContact CB-CG 3.95Å; V152-Y167 HydrophobicContact CG1-CE1 4.34Å; V152-Y167 HydrophobicContact CG1-CE2 4.39Å; V152-Y167 HydrophobicContact CG2-CD1 4.23Å; V152-Y167 HydrophobicContact CG2-CD2 3.44Å; V152-Y167 VanDerWaalsContact CG2-CD2 3.44Å; V152-Y167 HydrophobicContact CG2-CE1 4.4Å; V152-Y167 HydrophobicContact CG2-CE2 3.65Å; V152-Y167 HydrophobicContact CG2-CG 3.75Å; V152-Y167 VanDerWaalsContact N-N 3.11Å; Y167-A169 PolarHBondContact O-N 3.06Å
168	S	54.8	Low	48.1	Very low	20 Å²	20	94.5 Å²	94.5	14%	0.14	52%	0.524	C	S	.	.			trans	-75.6	90.3	169.3	88.7	0	0	0	0	110.7	S106 F150 F151 N170	S106-S168 PolarHBondContact OG-OG 3.38Å; S106-S168 VanDerWaalsContact OG-OG 3.13Å; F150-S168 VanDerWaalsContact O-CA 3.29Å; F150-S168 WeakPolarHBondContact O-CA 3.4Å; F150-S168 WeakPolarHBondContact O-CB 3.16Å; F150-S168 PolarHBondContact O-N 3.24Å; F151-S168 VanDerWaalsContact CD2-N 3.32Å; S168-N170 PolarHBondContact O-N 3.4Å
169	A	54.6	Low	46.9	Very low	50 Å²	50	99.3 Å²	99.3	41%	0.413	54%	0.54	S	S	.	.			trans	-59	129.9	170.2	0	0	0	0	0	110.5	V103 Y167 R171	V103-A169 HydrophobicContact CG1-CB 4.08Å; Y167-A169 PolarHBondContact O-N 3.06Å; A169-R171 PolarHBondContact O-N 2.92Å
170	N	43.5	Very low	45.8	Very low	109 Å²	109	98.7 Å²	98.7	58%	0.583	54%	0.542	S	S	*	.			trans	-68.6	96.5	-178.5	-166.9	-1.7	0	0	0	109.7	S168 S172 S173	S168-N170 PolarHBondContact O-N 3.4Å; N170-S172 PolarHBondContact O-N 2.87Å; N170-S173 WeakPolarHBondContact O-CB 3.2Å; N170-S173 PolarHBondContact O-N 3.42Å
171	R	42.3	Very low	44.6	Very low	194 Å²	194	93.1 Å²	93.1	73%	0.732	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-65.1	-12.1	-170.1	-74.5	-169.4	171	-149.1	-5.3	114.5	A169 S173	A169-R171 PolarHBondContact O-N 2.92Å; R171-S173 PolarHBondContact O-N 2.9Å
172	S	38.8	Very low	43.4	Very low	113 Å²	113	92.5 Å²	92.5	79%	0.79	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-63.4	-16.6	167.3	-52	0	0	0	0	113.7	N170	N170-S172 PolarHBondContact O-N 2.87Å
173	S	39.8	Very low	42.4	Very low	81 Å²	81	94.8 Å²	94.8	57%	0.566	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-98.2	2.6	-176.7	-57.9	0	0	0	0	115.2	N170 R171 G175	N170-S173 WeakPolarHBondContact O-CB 3.2Å; N170-S173 PolarHBondContact O-N 3.42Å; R171-S173 PolarHBondContact O-N 2.9Å; S173-G175 PolarHBondContact O-N 3.13Å
174	H	36.2	Very low	41.6	Very low	128 Å²	128	101.3 Å²	101.3	59%	0.593	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	58.6	170.9	-89.8	-63.9	0	0	0	112.1	T177	H174-T177 WeakPolarHBondContact ND1-CG2 3.42Å; H174-T177 PolarHBondContact ND1-OG1 2.61Å
175	G	28.9	Very low	40.6	Very low	68 Å²	68	107.7 Å²	107.7	70%	0.701	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	-11.7	172.5	0	0	0	0	0	114.2	S173	S173-G175 PolarHBondContact O-N 3.13Å
176	S	32.9	Very low	39.9	Very low	115 Å²	115	108.1 Å²	108.1	80%	0.804	61%	0.607	S	S	*	*			trans	-165.1	58.8	171.4	-78.9	0	0	0	0	112	S178	S176-S178 PolarHBondContact O-N 2.95Å
177	T	36.6	Very low	40.5	Very low	80 Å²	80	109.1 Å²	109.1	49%	0.491	63%	0.627	S	S	.	*			trans	-74.6	111.8	164.6	41.5	0	0	0	0	109.4	H174 F179	H174-T177 WeakPolarHBondContact ND1-CG2 3.42Å; H174-T177 PolarHBondContact ND1-OG1 2.61Å; T177-F179 PolarHBondContact O-N 3.08Å
178	S	31.8	Very low	41.7	Very low	110 Å²	110	109 Å²	109	77%	0.769	63%	0.632	S	S	*	*			trans	-59.6	99.6	-173.5	-58.4	0	0	0	0	113.5	S176 T180	S176-S178 PolarHBondContact O-N 2.95Å; S178-T180 PolarHBondContact O-N 3.25Å
179	F	30.5	Very low	43	Very low	207 Å²	207	109 Å²	109	91%	0.908	63%	0.629	S	S	*	*			trans	-80.2	93.1	160.4	-127.5	-85.3	0	0	0	108.6	T177 G181	T177-F179 PolarHBondContact O-N 3.08Å; F179-G181 PolarHBondContact O-N 3.03Å
180	T	30.4	Very low	44.4	Very low	132 Å²	132	109.6 Å²	109.6	81%	0.81	62%	0.624	S	S	*	*			trans	-66.1	120.1	175.1	37.5	0	0	0	0	109.9	S178	S178-T180 PolarHBondContact O-N 3.25Å
181	G	27.8	Very low	46.2	Very low	62 Å²	62	104.4 Å²	104.4	64%	0.639	60%	0.596	S	S	*	*	S	Bend	trans	90	68.2	172.2	0	0	0	0	0	116.5	F179	F179-G181 PolarHBondContact O-N 3.03Å
182	N	31.7	Very low	47.9	Very low	136 Å²	136	95.2 Å²	95.2	73%	0.727	56%	0.562	S	S	*	*				-179.8	125.7	125.9	-101.2	-57.2	0	0	0	113.2
183	M	37.4	Very low	49.7	Very low	154 Å²	154	94.3 Å²	94.3	76%	0.759	54%	0.544	S	S	*	.			trans	40.3	143.2	159	-64	-176	76.9	0	0	120.6	R185	M183-R185 VanDerWaalsContact C-N 3.26Å; M183-R185 HydrophobicContact CB-CG 4.44Å; M183-R185 PolarHBondContact O-N 3.44Å
184	Q	41.3	Very low	51.5	Low	141 Å²	141	92 Å²	92	66%	0.659	53%	0.528	S	S	*	.			trans	-59.1	70.5	171.2	-61.9	160.5	-13	0	0	113.3	G186 D216	Q184-G186 PolarHBondContact O-N 3.47Å; Q184-D216 PolarHBondContact NE2-OD2 2.87Å
185	R	36.9	Very low	53.5	Low	220 Å²	220	87.4 Å²	87.4	83%	0.83	51%	0.51	S	S	*	.			trans	-80.5	60.6	-177.2	-71.5	-165.1	-178.3	-163.5	3.9	113.4	M183	M183-R185 VanDerWaalsContact C-N 3.26Å; M183-R185 HydrophobicContact CB-CG 4.44Å; M183-R185 PolarHBondContact O-N 3.44Å
186	G	45.8	Very low	55.9	Low	35 Å²	35	85.3 Å²	85.3	36%	0.361	48%	0.483	S	S	.	.	S	Bend	trans	92.7	25.3	147.5	0	0	0	0	0	117.8	Q184 K200	Q184-G186 PolarHBondContact O-N 3.47Å; G186-K200 VanDerWaalsContact O-CD 3.28Å; G186-K200 WeakPolarHBondContact O-CD 3.28Å; G186-K200 VanDerWaalsContact O-CE 3.31Å; G186-K200 WeakPolarHBondContact O-CE 3.33Å; G186-K200 PolarHBondContact O-NZ 3.3Å
187	G	68.8	Low	58.4	Low	55 Å²	55	84.1 Å²	84.1	57%	0.567	47%	0.468	S	S	*	.	S	Bend	trans	-93.5	-166.3	160.2	0	0	0	0	0	112.8	K200	G187-K200 VanDerWaalsContact O-CB 3.31Å; G187-K200 WeakPolarHBondContact O-CB 3.13Å; G187-K200 WeakPolarHBondContact O-CG 3.38Å
188	D	84.3	Confident	60.8	Low	79 Å²	79	80.3 Å²	80.3	42%	0.422	45%	0.445	S	S	.	.			trans	-74.7	165.6	172.2	-70	-16.3	0	0	0	112	N197 N198 F199 K200	D188-N197 WeakPolarHBondContact CB-OD1 3.47Å; D188-N198 WeakPolarHBondContact CB-O 3.4Å; D188-F199 VanDerWaalsContact OD1-CA 3.26Å; D188-F199 WeakPolarHBondContact OD1-CA 3.38Å; D188-K200 PolarHBondContact OD1-N 3.02Å
189	W	83.6	Confident	63.4	Low	20 Å²	20	80.5 Å²	80.5	8%	0.076	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.5	-175	69.7	-79.5	0	0	0	112	C191 N198 R202 C205 R212 S215	W189-C191 HydrophobicContact CZ3-CB 4.04Å; W189-N198 VanDerWaalsContact CD1-O 3.31Å; W189-N198 HydrophobicContact CD2-CB 3.94Å; W189-N198 VanDerWaalsContact CE2-CB 3.46Å; W189-N198 HydrophobicContact CG-CB 4.28Å; W189-N198 HydrophobicContact CZ2-CB 3.82Å; W189-N198 WeakPolarHBondContact CZ3-ND2 3.35Å; W189-N198 PolarHBondContact N-O 3.03Å; W189-N198 WeakPolarHBondContact O-CA 3.29Å; W189-N198 VanDerWaalsContact O-CB 3.27Å; W189-N198 WeakPolarHBondContact O-CB 3.44Å; W189-N198 PolarHBondContact O-N 2.85Å; W189-N198 PolarHBondContact O-ND2 2.87Å; W189-R202 VanDerWaalsContact CE2-O 3.32Å; W189-R202 WeakPolarHBondContact CZ2-O 3.42Å; W189-R202 PolarHBondContact NE1-O 3.09Å; W189-C205 HydrophobicContact CH2-CB 3.75Å; W189-C205 HydrophobicContact CZ2-CB 4.41Å; W189-C205 HydrophobicContact CZ3-CB 4.41Å; W189-R212 HydrophobicContact CB-CG 4.48Å; W189-R212 HydrophobicContact CD2-CB 4.13Å; W189-R212 HydrophobicContact CD2-CG 3.78Å; W189-R212 HydrophobicContact CE3-CB 4.13Å; W189-R212 HydrophobicContact CE3-CG 3.84Å; W189-R212 HydrophobicContact CG-CG 4.08Å; W189-R212 VanDerWaalsContact CG-NE 3.32Å; W189-R212 HydrophobicContact CH2-CB 4.14Å; W189-R212 HydrophobicContact CZ2-CB 4.16Å; W189-R212 HydrophobicContact CZ3-CB 4.15Å; W189-R212 HydrophobicContact CZ3-CG 4.33Å; W189-S215 VanDerWaalsContact CZ3-OG 3.25Å; W189-S215 WeakPolarHBondContact CZ3-OG 3.16Å
190	I	82.2	Confident	66.1	Low	62 Å²	62	76 Å²	76	32%	0.318	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131	-175.7	-57.9	169.3	0	0	0	109.3	G192 S195 T196 N197 F223	I190-G192 PolarHBondContact O-N 3.48Å; I190-G192 VanDerWaalsContact O-N 3.11Å; I190-S195 VanDerWaalsContact CG2-C 3.41Å; I190-S195 VanDerWaalsContact CG2-O 3.31Å; I190-S195 WeakPolarHBondContact CG2-O 3.21Å; I190-T196 WeakPolarHBondContact CA-O 3.45Å; I190-N197 HydrophobicContact CG1-CB 4.15Å; I190-F223 HydrophobicContact CB-CE2 4.32Å; I190-F223 HydrophobicContact CB-CZ 3.65Å; I190-F223 HydrophobicContact CD1-CZ 4.02Å; I190-F223 HydrophobicContact CG1-CZ 4.43Å; I190-F223 HydrophobicContact CG2-CE2 3.88Å; I190-F223 HydrophobicContact CG2-CZ 3.6Å
191	C	82.8	Confident	68.8	Low	0 Å²	0	78 Å²	78	0%	0	41%	0.41	C	S	.	.			trans	-67.3	110.8	173.2	166.8	0	0	0	0	109.4	W189 K193 C194 S195 T196 N198 C205 C208	W189-C191 HydrophobicContact CZ3-CB 4.04Å; C191-K193 PolarHBondContact O-N 3.4Å; C191-K193 PolarHBondContact SG-N 3.34Å; C191-C194 PolarHBondContact O-N 3.48Å; C191-C194 VanDerWaalsContact SG-SG 3.62Å; C191-S195 VanDerWaalsContact O-CA 3.26Å; C191-S195 WeakPolarHBondContact O-CA 3.08Å; C191-S195 PolarHBondContact O-N 2.81Å; C191-T196 PolarHBondContact N-O 2.92Å; C191-N198 PolarHBondContact N-ND2 2.93Å; C191-C205 HydrophobicContact CB-CB 3.69Å; C191-C205 WeakPolarHBondContact CB-SG 3.22Å; C191-C208 HydrophobicContact CB-CB 4.46Å; C191-C208 WeakPolarHBondContact CB-SG 3.25Å; C191-C208 WeakPolarHBondContact SG-CB 3.36Å; C191-C208 CovalentContact SG-SG 2.06Å; C191-C208 PolarHBondContact SG-SG 3.06Å
192	G	78.5	Confident	71.7	Confident	2 Å²	2	79.9 Å²	79.9	2%	0.021	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.6	-179.8	0	0	0	0	0	114	I190 C219 R259	I190-G192 PolarHBondContact O-N 3.48Å; I190-G192 VanDerWaalsContact O-N 3.11Å; G192-C219 WeakPolarHBondContact CA-SG 3.19Å; G192-R259 PolarHBondContact O-NH1 3.44Å; G192-R259 PolarHBondContact O-NH2 3.08Å
193	K	75.5	Confident	74.4	Confident	93 Å²	93	78 Å²	78	40%	0.404	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-35.3	-177.3	-172.1	179.4	-179	176.5	0	113.1	C191 V210 V218 C219 L331	C191-K193 PolarHBondContact O-N 3.4Å; C191-K193 PolarHBondContact SG-N 3.34Å; K193-V210 HydrophobicContact CB-CG2 4.46Å; K193-V210 HydrophobicContact CD-CG2 3.7Å; K193-V218 HydrophobicContact CB-CG1 4.39Å; K193-V218 HydrophobicContact CD-CG1 4.46Å; K193-V218 HydrophobicContact CG-CG1 4.43Å; K193-C219 PolarHBondContact N-SG 3.38Å; K193-L331 HydrophobicContact CG-CD2 4.4Å
194	C	77.3	Confident	77	Confident	34 Å²	34	76.5 Å²	76.5	23%	0.23	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	4.5	-177.5	73.4	0	0	0	0	114.7	C191 T196 C208	C191-C194 PolarHBondContact O-N 3.48Å; C191-C194 VanDerWaalsContact SG-SG 3.62Å; C194-T196 PolarHBondContact O-N 3.3Å; C194-T196 VanDerWaalsContact O-N 3.08Å; C194-T196 PolarHBondContact SG-OG1 3.21Å; C194-C208 HydrophobicContact CB-CB 3.93Å; C194-C208 VanDerWaalsContact SG-CB 3.52Å
195	S	77.6	Confident	79.3	Confident	31 Å²	31	70.1 Å²	70.1	22%	0.217	35%	0.345	C	S	.	.			trans	56.1	15.1	-179	56.1	0	0	0	0	117.2	I190 C191	I190-S195 VanDerWaalsContact CG2-C 3.41Å; I190-S195 VanDerWaalsContact CG2-O 3.31Å; I190-S195 WeakPolarHBondContact CG2-O 3.21Å; C191-S195 VanDerWaalsContact O-CA 3.26Å; C191-S195 WeakPolarHBondContact O-CA 3.08Å; C191-S195 PolarHBondContact O-N 2.81Å
196	T	80.4	Confident	81.8	Confident	23 Å²	23	65.3 Å²	65.3	14%	0.141	33%	0.33	C	S	.	.			trans	-81.2	132.1	175.9	60.5	0	0	0	0	112.3	I190 C191 C194 N198 C205 F206 K207	I190-T196 WeakPolarHBondContact CA-O 3.45Å; C191-T196 PolarHBondContact N-O 2.92Å; C194-T196 PolarHBondContact O-N 3.3Å; C194-T196 VanDerWaalsContact O-N 3.08Å; C194-T196 PolarHBondContact SG-OG1 3.21Å; T196-N198 PolarHBondContact O-ND2 3.23Å; T196-N198 VanDerWaalsContact O-ND2 3.15Å; T196-C205 PolarHBondContact OG1-SG 3.23Å; T196-F206 HydrophobicContact CG2-CE1 4.42Å; T196-F206 HydrophobicContact CG2-CZ 4.09Å; T196-K207 HydrophobicContact CG2-CB 3.93Å; T196-K207 HydrophobicContact CG2-CD 3.58Å; T196-K207 HydrophobicContact CG2-CG 4.34Å
197	N	85.8	Confident	83.7	Confident	91 Å²	91	71 Å²	71	49%	0.487	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.3	172.1	-171.8	26.5	0	0	0	111.7	D188 I190 F206	D188-N197 WeakPolarHBondContact CB-OD1 3.47Å; I190-N197 HydrophobicContact CG1-CB 4.15Å; N197-F206 WeakPolarHBondContact O-CE1 3.46Å
198	N	87.3	Confident	84.5	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.7	-178.7	-57.7	-75.4	0	0	0	110.4	D188 W189 C191 T196 K200 C205 F206	D188-N198 WeakPolarHBondContact CB-O 3.4Å; W189-N198 VanDerWaalsContact CD1-O 3.31Å; W189-N198 HydrophobicContact CD2-CB 3.94Å; W189-N198 VanDerWaalsContact CE2-CB 3.46Å; W189-N198 HydrophobicContact CG-CB 4.28Å; W189-N198 HydrophobicContact CZ2-CB 3.82Å; W189-N198 WeakPolarHBondContact CZ3-ND2 3.35Å; W189-N198 PolarHBondContact N-O 3.03Å; W189-N198 WeakPolarHBondContact O-CA 3.29Å; W189-N198 VanDerWaalsContact O-CB 3.27Å; W189-N198 WeakPolarHBondContact O-CB 3.44Å; W189-N198 PolarHBondContact O-N 2.85Å; W189-N198 PolarHBondContact O-ND2 2.87Å; C191-N198 PolarHBondContact N-ND2 2.93Å; T196-N198 PolarHBondContact O-ND2 3.23Å; T196-N198 VanDerWaalsContact O-ND2 3.15Å; N198-K200 PolarHBondContact O-N 2.92Å; N198-C205 PolarHBondContact ND2-SG 2.86Å; N198-C205 VanDerWaalsContact OD1-CA 3.24Å; N198-C205 WeakPolarHBondContact OD1-CA 3.45Å; N198-C205 PolarHBondContact OD1-SG 3.46Å; N198-F206 VanDerWaalsContact OD1-CD1 3.22Å; N198-F206 WeakPolarHBondContact OD1-CD1 3.27Å; N198-F206 PolarHBondContact OD1-N 3.41Å
199	F	86.6	Confident	84.6	Confident	113 Å²	113	68.3 Å²	68.3	50%	0.496	33%	0.331	S	S	.	.			trans	-53.4	137.6	174	-59.4	-60.8	0	0	0	112.6	D188 K201 R202	D188-F199 VanDerWaalsContact OD1-CA 3.26Å; D188-F199 WeakPolarHBondContact OD1-CA 3.38Å; F199-K201 HydrophobicContact CB-CG 4.06Å; F199-K201 PolarHBondContact O-N 3.08Å; F199-R202 WeakPolarHBondContact O-CB 3.32Å; F199-R202 PolarHBondContact O-N 3.27Å
200	K	86.8	Confident	84.7	Confident	113 Å²	113	68.5 Å²	68.5	49%	0.491	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.4	-33.4	175.9	-176.9	-175.8	-179.3	173.2	0	115	G186 G187 D188 N198 R202 R212	G186-K200 VanDerWaalsContact O-CD 3.28Å; G186-K200 WeakPolarHBondContact O-CD 3.28Å; G186-K200 VanDerWaalsContact O-CE 3.31Å; G186-K200 WeakPolarHBondContact O-CE 3.33Å; G186-K200 PolarHBondContact O-NZ 3.3Å; G187-K200 VanDerWaalsContact O-CB 3.31Å; G187-K200 WeakPolarHBondContact O-CB 3.13Å; G187-K200 WeakPolarHBondContact O-CG 3.38Å; D188-K200 PolarHBondContact OD1-N 3.02Å; N198-K200 PolarHBondContact O-N 2.92Å; K200-R202 VanDerWaalsContact C-N 3.3Å; K200-R202 PolarHBondContact O-N 3.37Å; K200-R212 PolarHBondContact O-NH2 3.42Å
201	K	87.4	Confident	85	Confident	175 Å²	175	70.9 Å²	70.9	76%	0.761	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-3.6	-179.8	69.1	175.4	-177.9	178.6	0	115.2	F199	F199-K201 HydrophobicContact CB-CG 4.06Å; F199-K201 PolarHBondContact O-N 3.08Å
202	R	87.3	Confident	85.1	Confident	100 Å²	100	73.7 Å²	73.7	38%	0.377	35%	0.35	S	S	.	.			trans	-104.4	123.7	178.6	-75.1	-177	162.5	144.7	-5.4	109.5	W189 F199 K200 Y204 R212	W189-R202 VanDerWaalsContact CE2-O 3.32Å; W189-R202 WeakPolarHBondContact CZ2-O 3.42Å; W189-R202 PolarHBondContact NE1-O 3.09Å; F199-R202 WeakPolarHBondContact O-CB 3.32Å; F199-R202 PolarHBondContact O-N 3.27Å; K200-R202 VanDerWaalsContact C-N 3.3Å; K200-R202 PolarHBondContact O-N 3.37Å; R202-Y204 WeakPolarHBondContact CB-O 3.36Å; R202-R212 PolarHBondContact O-NH2 3.4Å
203	D	89.3	Confident	85.3	Confident	97 Å²	97	80.2 Å²	80.2	52%	0.519	38%	0.38	S	S	.	.	S	Bend	trans	-88.8	-16.4	174.4	-50.4	-52.3	0	0	0	112.3	R211 R212	D203-R211 CarbonylContact O-C 3.51Å; D203-R211 VanDerWaalsContact O-CA 3.25Å; D203-R211 WeakPolarHBondContact O-CA 3.19Å; D203-R212 PolarHBondContact O-N 2.99Å; D203-R212 IonicContact OD1-NH2 3.97Å
204	Y	91.4	Very high	85.6	Confident	123 Å²	123	79.4 Å²	79.4	48%	0.482	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-114.3	141.7	174.1	-56.1	-96.4	0	0	0	109.8	R202 R211	R202-Y204 WeakPolarHBondContact CB-O 3.36Å; Y204-R211 HydrophobicContact CD1-CG 3.67Å; Y204-R211 HydrophobicContact CE1-CG 3.4Å; Y204-R211 PolarHBondContact OH-NE 3.17Å; Y204-R211 PolarHBondContact OH-NH2 3.09Å
205	C	90.4	Very high	85.5	Confident	7 Å²	7	77.8 Å²	77.8	5%	0.047	37%	0.369	C	S	.	.			trans	-71.3	138.9	179.5	175	0	0	0	0	112.4	W189 C191 T196 N198 K207 C208 G209 V210	W189-C205 HydrophobicContact CH2-CB 3.75Å; W189-C205 HydrophobicContact CZ2-CB 4.41Å; W189-C205 HydrophobicContact CZ3-CB 4.41Å; C191-C205 HydrophobicContact CB-CB 3.69Å; C191-C205 WeakPolarHBondContact CB-SG 3.22Å; T196-C205 PolarHBondContact OG1-SG 3.23Å; N198-C205 PolarHBondContact ND2-SG 2.86Å; N198-C205 VanDerWaalsContact OD1-CA 3.24Å; N198-C205 WeakPolarHBondContact OD1-CA 3.45Å; N198-C205 PolarHBondContact OD1-SG 3.46Å; C205-K207 VanDerWaalsContact C-N 3.27Å; C205-K207 PolarHBondContact O-N 2.83Å; C205-K207 PolarHBondContact SG-N 2.92Å; C205-C208 HydrophobicContact CB-CB 4.3Å; C205-C208 WeakPolarHBondContact CB-SG 3.25Å; C205-C208 PolarHBondContact SG-N 3.48Å; C205-C208 PolarHBondContact SG-SG 3.32Å; C205-G209 WeakPolarHBondContact O-CA 3.12Å; C205-G209 PolarHBondContact O-N 2.85Å; C205-G209 VanDerWaalsContact O-N 3.13Å; C205-V210 PolarHBondContact N-O 3.23Å
206	F	89.5	Confident	85.1	Confident	119 Å²	119	80.8 Å²	80.8	52%	0.522	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-22.1	-179.6	83.3	-97.1	0	0	0	114.4	T196 N197 N198	T196-F206 HydrophobicContact CG2-CE1 4.42Å; T196-F206 HydrophobicContact CG2-CZ 4.09Å; N197-F206 WeakPolarHBondContact O-CE1 3.46Å; N198-F206 VanDerWaalsContact OD1-CD1 3.22Å; N198-F206 WeakPolarHBondContact OD1-CD1 3.27Å; N198-F206 PolarHBondContact OD1-N 3.41Å
207	K	85	Confident	84.4	Confident	154 Å²	154	84.5 Å²	84.5	67%	0.67	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-45.4	178.6	-172.1	178.8	-177.8	-179.2	0	113.2	T196 C205	T196-K207 HydrophobicContact CG2-CB 3.93Å; T196-K207 HydrophobicContact CG2-CD 3.58Å; T196-K207 HydrophobicContact CG2-CG 4.34Å; C205-K207 VanDerWaalsContact C-N 3.27Å; C205-K207 PolarHBondContact O-N 2.83Å; C205-K207 PolarHBondContact SG-N 2.92Å
208	C	86	Confident	83.2	Confident	32 Å²	32	83.3 Å²	83.3	22%	0.216	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-12.7	-175.1	75	0	0	0	0	114.4	C191 C194 C205 V210	C191-C208 HydrophobicContact CB-CB 4.46Å; C191-C208 WeakPolarHBondContact CB-SG 3.25Å; C191-C208 WeakPolarHBondContact SG-CB 3.36Å; C191-C208 CovalentContact SG-SG 2.06Å; C191-C208 PolarHBondContact SG-SG 3.06Å; C194-C208 HydrophobicContact CB-CB 3.93Å; C194-C208 VanDerWaalsContact SG-CB 3.52Å; C205-C208 HydrophobicContact CB-CB 4.3Å; C205-C208 WeakPolarHBondContact CB-SG 3.25Å; C205-C208 PolarHBondContact SG-N 3.48Å; C205-C208 PolarHBondContact SG-SG 3.32Å; C208-V210 HydrophobicContact CB-CG2 4.12Å; C208-V210 PolarHBondContact O-N 3.42Å; C208-V210 VanDerWaalsContact SG-CB 3.55Å
209	G	85.9	Confident	81.8	Confident	46 Å²	46	83.4 Å²	83.4	47%	0.474	41%	0.406	S	S	.	.			trans	69.1	-22.1	-175.5	0	0	0	0	0	115.7	C205	C205-G209 WeakPolarHBondContact O-CA 3.12Å; C205-G209 PolarHBondContact O-N 2.85Å; C205-G209 VanDerWaalsContact O-N 3.13Å
210	V	85.6	Confident	80.4	Confident	24 Å²	24	80 Å²	80	15%	0.145	40%	0.403	C	S	.	.			trans	-56.5	141.7	178.6	-171.1	0	0	0	0	111.1	K193 C205 C208 D214	K193-V210 HydrophobicContact CB-CG2 4.46Å; K193-V210 HydrophobicContact CD-CG2 3.7Å; C205-V210 PolarHBondContact N-O 3.23Å; C208-V210 HydrophobicContact CB-CG2 4.12Å; C208-V210 PolarHBondContact O-N 3.42Å; C208-V210 VanDerWaalsContact SG-CB 3.55Å; V210-D214 HydrophobicContact CG1-CB 3.48Å; V210-D214 VanDerWaalsContact CG1-CB 3.48Å
211	R	87.7	Confident	79.2	Confident	111 Å²	111	78.9 Å²	78.9	42%	0.419	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-67.2	157.2	172.8	-67	175.6	156.6	-168.2	-3.3	111.3	D203 Y204 E213 D214 S215	D203-R211 CarbonylContact O-C 3.51Å; D203-R211 VanDerWaalsContact O-CA 3.25Å; D203-R211 WeakPolarHBondContact O-CA 3.19Å; Y204-R211 HydrophobicContact CD1-CG 3.67Å; Y204-R211 HydrophobicContact CE1-CG 3.4Å; Y204-R211 PolarHBondContact OH-NE 3.17Å; Y204-R211 PolarHBondContact OH-NH2 3.09Å; R211-E213 VanDerWaalsContact C-N 3.34Å; R211-E213 PolarHBondContact O-N 3.21Å; R211-D214 HydrophobicContact CB-CB 4.26Å; R211-D214 WeakPolarHBondContact CB-OD2 3.43Å; R211-D214 PolarHBondContact O-N 2.84Å; R211-S215 VanDerWaalsContact O-CB 3.22Å; R211-S215 WeakPolarHBondContact O-CB 3.26Å; R211-S215 PolarHBondContact O-N 2.92Å; R211-S215 PolarHBondContact O-OG 3.37Å
212	R	85.8	Confident	78.2	Confident	60 Å²	60	70.9 Å²	70.9	23%	0.226	37%	0.369	C	S	.	.	H	α-helix	trans	-54.1	-50.1	174.7	-171.7	-178.9	-57.7	147.8	9.2	112.1	W189 K200 R202 D203 S215 D216	W189-R212 HydrophobicContact CB-CG 4.48Å; W189-R212 HydrophobicContact CD2-CB 4.13Å; W189-R212 HydrophobicContact CD2-CG 3.78Å; W189-R212 HydrophobicContact CE3-CB 4.13Å; W189-R212 HydrophobicContact CE3-CG 3.84Å; W189-R212 HydrophobicContact CG-CG 4.08Å; W189-R212 VanDerWaalsContact CG-NE 3.32Å; W189-R212 HydrophobicContact CH2-CB 4.14Å; W189-R212 HydrophobicContact CZ2-CB 4.16Å; W189-R212 HydrophobicContact CZ3-CB 4.15Å; W189-R212 HydrophobicContact CZ3-CG 4.33Å; K200-R212 PolarHBondContact O-NH2 3.42Å; R202-R212 PolarHBondContact O-NH2 3.4Å; D203-R212 PolarHBondContact O-N 2.99Å; D203-R212 IonicContact OD1-NH2 3.97Å; R212-S215 PolarHBondContact O-N 3.01Å; R212-S215 PolarHBondContact O-OG 3.04Å; R212-D216 PolarHBondContact O-N 3.23Å
213	E	83	Confident	77.3	Confident	139 Å²	139	69.7 Å²	69.7	65%	0.65	37%	0.367	S	S	*	.	H	α-helix	trans	-60.6	-47.5	-178.6	-62.3	163.8	167	0	0	112.1	R211 S215 S217	R211-E213 VanDerWaalsContact C-N 3.34Å; R211-E213 PolarHBondContact O-N 3.21Å; E213-S215 VanDerWaalsContact C-N 3.27Å; E213-S215 PolarHBondContact O-N 2.75Å; E213-S217 PolarHBondContact O-N 3.06Å; E213-S217 PolarHBondContact O-OG 3.02Å
214	D	82	Confident	76.1	Confident	76 Å²	76	68.3 Å²	68.3	41%	0.406	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-35.1	173.5	-57.7	-27	0	0	0	111.3	V210 R211 S217 V218	V210-D214 HydrophobicContact CG1-CB 3.48Å; V210-D214 VanDerWaalsContact CG1-CB 3.48Å; R211-D214 HydrophobicContact CB-CB 4.26Å; R211-D214 WeakPolarHBondContact CB-OD2 3.43Å; R211-D214 PolarHBondContact O-N 2.84Å; D214-S217 PolarHBondContact O-N 3.31Å; D214-V218 WeakPolarHBondContact O-CB 3.24Å; D214-V218 WeakPolarHBondContact O-CG2 3.44Å; D214-V218 PolarHBondContact O-N 2.93Å
215	S	75.5	Confident	75.2	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-74.6	-26.1	-173	80.6	0	0	0	0	114.6	W189 R211 R212 E213 C219	W189-S215 VanDerWaalsContact CZ3-OG 3.25Å; W189-S215 WeakPolarHBondContact CZ3-OG 3.16Å; R211-S215 VanDerWaalsContact O-CB 3.22Å; R211-S215 WeakPolarHBondContact O-CB 3.26Å; R211-S215 PolarHBondContact O-N 2.92Å; R211-S215 PolarHBondContact O-OG 3.37Å; R212-S215 PolarHBondContact O-N 3.01Å; R212-S215 PolarHBondContact O-OG 3.04Å; E213-S215 VanDerWaalsContact C-N 3.27Å; E213-S215 PolarHBondContact O-N 2.75Å; S215-C219 PolarHBondContact O-SG 3.48Å
216	D	68.9	Low	74.2	Confident	93 Å²	93	64.4 Å²	64.4	50%	0.497	35%	0.351	S	S	.	.	H	α-helix	trans	-73.1	-40	168.5	-71.9	-20.7	0	0	0	109.3	Q184 R212	Q184-D216 PolarHBondContact NE2-OD2 2.87Å; R212-D216 PolarHBondContact O-N 3.23Å
217	S	66.1	Low	73.1	Confident	102 Å²	102	59.3 Å²	59.3	71%	0.713	33%	0.332	S	S	*	.	H	α-helix	trans	-70.6	-36.4	-176.6	-54.5	0	0	0	0	114.7	E213 D214 C219	E213-S217 PolarHBondContact O-N 3.06Å; E213-S217 PolarHBondContact O-OG 3.02Å; D214-S217 PolarHBondContact O-N 3.31Å; S217-C219 VanDerWaalsContact C-N 3.25Å; S217-C219 PolarHBondContact O-N 3.04Å
218	V	60.4	Low	71.9	Confident	65 Å²	65	56.8 Å²	56.8	39%	0.394	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.3	-173.6	162.5	0	0	0	0	113.8	K193 D214	K193-V218 HydrophobicContact CB-CG1 4.39Å; K193-V218 HydrophobicContact CD-CG1 4.46Å; K193-V218 HydrophobicContact CG-CG1 4.43Å; D214-V218 WeakPolarHBondContact O-CB 3.24Å; D214-V218 WeakPolarHBondContact O-CG2 3.44Å; D214-V218 PolarHBondContact O-N 2.93Å
219	C	56.6	Low	70.3	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.02	35%	0.352	C	S	.	.	S	Bend	trans	-117.8	-7.9	-149.4	-63.8	0	0	0	0	117.1	G192 K193 S215 S217	G192-C219 WeakPolarHBondContact CA-SG 3.19Å; K193-C219 PolarHBondContact N-SG 3.38Å; S215-C219 PolarHBondContact O-SG 3.48Å; S217-C219 VanDerWaalsContact C-N 3.25Å; S217-C219 PolarHBondContact O-N 3.04Å
220	G	57.7	Low	68.1	Low	42 Å²	42	61.7 Å²	61.7	43%	0.433	34%	0.344	S	S	.	.			trans	64.4	179.5	175.3	0	0	0	0	0	115
221	D	62.6	Low	65.5	Low	89 Å²	89	65.2 Å²	65.2	48%	0.476	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	161	171.5	-49.9	-80.3	0	0	0	111.3	R297 Y299	D221-R297 HydrophobicContact CB-CB 4.43Å; D221-R297 WeakPolarHBondContact CB-O 3.49Å; D221-Y299 HydrophobicContact CB-CD1 4.25Å; D221-Y299 HydrophobicContact CB-CE1 4.18Å; D221-Y299 VanDerWaalsContact O-CD1 3.32Å; D221-Y299 WeakPolarHBondContact O-CD1 3.46Å
222	G	64.8	Low	62.8	Low	6 Å²	6	66.5 Å²	66.5	6%	0.062	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	4	-179.4	0	0	0	0	0	115.1	S224 E225 Y299	G222-S224 PolarHBondContact O-N 2.06Å; G222-E225 WeakPolarHBondContact O-CB 3.3Å; G222-E225 PolarHBondContact O-N 2.89Å; G222-Y299 VanDerWaalsContact CA-CD1 3.49Å; G222-Y299 VanDerWaalsContact CA-CE1 3.4Å
223	F	68.2	Low	60.5	Low	75 Å²	75	68.5 Å²	68.5	33%	0.329	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-54.8	-32.7	171	175.6	-93	0	0	0	113	I190 E225 I226	I190-F223 HydrophobicContact CB-CE2 4.32Å; I190-F223 HydrophobicContact CB-CZ 3.65Å; I190-F223 HydrophobicContact CD1-CZ 4.02Å; I190-F223 HydrophobicContact CG1-CZ 4.43Å; I190-F223 HydrophobicContact CG2-CE2 3.88Å; I190-F223 HydrophobicContact CG2-CZ 3.6Å; F223-E225 PolarHBondContact O-N 2.91Å; F223-I226 HydrophobicContact CD2-CD1 3.41Å; F223-I226 VanDerWaalsContact CD2-CD1 3.41Å; F223-I226 HydrophobicContact CE2-CD1 3.67Å; F223-I226 HydrophobicContact CG-CD1 4.23Å; F223-I226 WeakPolarHBondContact O-CG1 3.36Å; F223-I226 PolarHBondContact O-N 2.99Å
224	S	66.1	Low	58.2	Low	68 Å²	68	70.7 Å²	70.7	48%	0.476	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-63	-21.2	176.1	53.4	0	0	0	0	114.9	G222 K336	G222-S224 PolarHBondContact O-N 2.06Å; S224-K336 WeakPolarHBondContact O-CD 3.31Å
225	E	70.7	Confident	56.2	Low	35 Å²	35	77.1 Å²	77.1	16%	0.164	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-94.9	-0.2	-172.8	-47.9	-52.8	113.7	0	0	112.7	G222 F223 G227 L257 Y299 Y301 K336 I337	G222-E225 WeakPolarHBondContact O-CB 3.3Å; G222-E225 PolarHBondContact O-N 2.89Å; F223-E225 PolarHBondContact O-N 2.91Å; E225-G227 PolarHBondContact O-N 3.11Å; E225-L257 HydrophobicContact CB-CD1 4.17Å; E225-L257 HydrophobicContact CB-CD2 4Å; E225-Y299 HydrophobicContact CG-CE2 3.97Å; E225-Y301 HydrophobicContact CB-CE1 4.43Å; E225-Y301 WeakPolarHBondContact CG-OH 3.48Å; E225-Y301 PolarHBondContact OE2-OH 3.2Å; E225-K336 WeakPolarHBondContact O-CB 3.49Å; E225-K336 PolarHBondContact O-N 3.38Å; E225-I337 WeakPolarHBondContact OE2-CD1 3.45Å
226	I	70.7	Confident	54.3	Low	14 Å²	14	85.4 Å²	85.4	7%	0.072	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	123.7	179.6	-59.2	168	0	0	0	110.4	F223 L257 R259	F223-I226 HydrophobicContact CD2-CD1 3.41Å; F223-I226 VanDerWaalsContact CD2-CD1 3.41Å; F223-I226 HydrophobicContact CE2-CD1 3.67Å; F223-I226 HydrophobicContact CG-CD1 4.23Å; F223-I226 WeakPolarHBondContact O-CG1 3.36Å; F223-I226 PolarHBondContact O-N 2.99Å; I226-L257 HydrophobicContact CB-CD2 4.5Å; I226-L257 HydrophobicContact CG1-CD2 3.76Å; I226-R259 VanDerWaalsContact CD1-CZ 3.43Å
227	G	65.6	Low	52.4	Low	12 Å²	12	86.9 Å²	86.9	12%	0.124	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	131.4	167.6	0	0	0	0	0	110.5	E225 Y334	E225-G227 PolarHBondContact O-N 3.11Å; G227-Y334 PolarHBondContact N-O 2.74Å
228	V	59.8	Low	51	Low	100 Å²	100	88.6 Å²	88.6	61%	0.606	49%	0.49	S	S	*	.			trans	-99.2	110	175.9	-178.1	0	0	0	0	108.6
229	L	52.9	Low	49.6	Very low	136 Å²	136	90.9 Å²	90.9	71%	0.712	51%	0.509	S	S	*	.			trans	70.8	135.1	173.6	-63.8	164.6	0	0	0	117.4
230	P	40.7	Very low	48.7	Very low	46 Å²	46	97.2 Å²	97.2	30%	0.299	54%	0.542	S	S	.	.	S	Bend	trans	-75.8	158.4	140.2	35.8	-30	0	0	0	109.5	I253 Y334	P230-I253 HydrophobicContact CB-CG2 3.86Å; P230-Y334 VanDerWaalsContact CD-CE2 3.5Å; P230-Y334 HydrophobicContact CG-CE2 3.87Å
231	S	30.3	Very low	48.2	Very low	98 Å²	98	100.3 Å²	100.3	69%	0.685	56%	0.556	S	S	*	*	S	Bend	trans	63.1	160.3	-173.7	68.7	0	0	0	0	116.8	S233	S231-S233 PolarHBondContact O-N 3.2Å
232	D	30.8	Very low	46.9	Very low	137 Å²	137	102.6 Å²	102.6	73%	0.733	57%	0.568	S	S	*	*			trans	62	19.4	177.4	-79.4	11.8	0	0	0	120.4	K234	D232-K234 PolarHBondContact O-N 3.5Å
233	S	37.6	Very low	45.9	Very low	102 Å²	102	109.1 Å²	109.1	71%	0.713	60%	0.601	S	S	*	*			trans	-72.8	66.9	160.8	66.5	0	0	0	0	112.7	S231 Y235	S231-S233 PolarHBondContact O-N 3.2Å; S233-Y235 PolarHBondContact O-N 3.06Å
234	K	34.4	Very low	44.9	Very low	185 Å²	185	110.8 Å²	110.8	80%	0.804	62%	0.618	S	S	*	*			trans	-69.9	62.3	169.7	-73	-179.3	-179.3	167.7	0	111.7	D232	D232-K234 PolarHBondContact O-N 3.5Å
235	Y	40.7	Very low	43.8	Very low	212 Å²	212	112.3 Å²	112.3	83%	0.831	63%	0.627	S	S	*	*			trans	-106.3	87.5	178.4	-82.4	-80.3	0	0	0	112.4	S233	S233-Y235 PolarHBondContact O-N 3.06Å
236	F	34.8	Very low	42.4	Very low	173 Å²	173	117.2 Å²	117.2	76%	0.759	65%	0.654	S	S	*	*			trans	49.5	90.7	146.2	-139	-101.7	0	0	0	118	L238	F236-L238 HydrophobicContact CD1-CB 4.45Å; F236-L238 HydrophobicContact CD1-CD1 4.09Å; F236-L238 HydrophobicContact CD1-CG 4.1Å; F236-L238 HydrophobicContact CE1-CD1 3.73Å; F236-L238 HydrophobicContact CE1-CG 3.85Å; F236-L238 PolarHBondContact O-N 3.24Å; F236-L238 VanDerWaalsContact O-N 3.12Å
237	S	28.6	Very low	41.2	Very low	124 Å²	124	120.4 Å²	120.4	87%	0.867	67%	0.674	S	S	*	*			trans	-65	105.5	162.3	53.2	0	0	0	0	111.1
238	L	37	Very low	40.3	Very low	139 Å²	139	124.5 Å²	124.5	73%	0.728	69%	0.692	S	S	*	*			trans	-114.8	132.7	159.6	-109.1	173.5	0	0	0	109.6	F236 L240	F236-L238 HydrophobicContact CD1-CB 4.45Å; F236-L238 HydrophobicContact CD1-CD1 4.09Å; F236-L238 HydrophobicContact CD1-CG 4.1Å; F236-L238 HydrophobicContact CE1-CD1 3.73Å; F236-L238 HydrophobicContact CE1-CG 3.85Å; F236-L238 PolarHBondContact O-N 3.24Å; F236-L238 VanDerWaalsContact O-N 3.12Å; L238-L240 PolarHBondContact O-N 3.43Å
239	S	32	Very low	39.8	Very low	113 Å²	113	123.5 Å²	123.5	79%	0.79	69%	0.689	S	S	*	*			trans	-83.2	114.2	-163.9	40.7	0	0	0	0	113.1
240	L	37.3	Very low	39.4	Very low	136 Å²	136	124 Å²	124	71%	0.712	69%	0.686	S	S	*	*			trans	-122	151.1	152.6	-92.2	92.9	0	0	0	111.1	L238 L242	L238-L240 PolarHBondContact O-N 3.43Å; L240-L242 PolarHBondContact O-N 3.28Å
241	S	45.8	Very low	39.8	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	69%	0.69	S	S	*	*			trans	-69.1	126.5	-167.2	52.5	0	0	0	0	113.7
242	L	35.7	Very low	41	Very low	138 Å²	138	126.5 Å²	126.5	72%	0.723	68%	0.676	S	S	*	*	S	Bend	trans	60.4	114	142	-58.5	168.7	0	0	0	117.8	L240 V244	L240-L242 PolarHBondContact O-N 3.28Å; L242-V244 PolarHBondContact O-N 2.82Å
243	N	43.4	Very low	42.5	Very low	142 Å²	142	122.2 Å²	122.2	76%	0.759	65%	0.653	S	S	*	*	S	Bend	trans	81	-9.6	149.8	-50.2	-16.8	0	0	0	120.1
244	V	47.6	Very low	44.3	Very low	111 Å²	111	118.9 Å²	118.9	67%	0.673	63%	0.625	S	S	*	*	S	Bend	trans	-102.4	-43	176.6	-173.8	0	0	0	0	113.3	L242 L246	L242-V244 PolarHBondContact O-N 2.82Å; V244-L246 PolarHBondContact O-N 3.41Å
245	C	43.6	Very low	46.6	Very low	100 Å²	100	110 Å²	110	68%	0.676	59%	0.587	S	S	*	*	H	α-helix	trans	-70.7	-29.8	-167.7	-158.1	0	0	0	0	114.6	V247	C245-V247 VanDerWaalsContact C-N 3.3Å; C245-V247 PolarHBondContact O-N 2.83Å
246	L	40.5	Very low	48.7	Very low	137 Å²	137	100 Å²	100	72%	0.717	55%	0.547	S	S	*	.	H	α-helix	trans	-70.6	-19.6	-176.2	-71.2	176.8	0	0	0	114.5	V244 F250	V244-L246 PolarHBondContact O-N 3.41Å; L246-F250 WeakPolarHBondContact O-CD2 3.19Å
247	V	45.8	Very low	51.2	Low	82 Å²	82	91.7 Å²	91.7	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-76.3	-33	-175	-166.2	0	0	0	0	111.6	C245 Y251	C245-V247 VanDerWaalsContact C-N 3.3Å; C245-V247 PolarHBondContact O-N 2.83Å; V247-Y251 HydrophobicContact CG1-CE2 3.97Å; V247-Y251 WeakPolarHBondContact O-CD2 3.46Å
248	I	47.6	Very low	54.1	Low	97 Å²	97	85.8 Å²	85.8	50%	0.497	47%	0.47	S	S	.	.	H	α-helix	trans	-73.3	-40.3	-168.8	-57.9	175.2	0	0	0	111.3	F250 Y251 Y252	I248-F250 VanDerWaalsContact C-N 3.28Å; I248-F250 PolarHBondContact O-N 2.78Å; I248-Y251 PolarHBondContact O-N 2.68Å; I248-Y252 HydrophobicContact CG2-CE2 4.25Å; I248-Y252 VanDerWaalsContact O-CE2 3.27Å; I248-Y252 WeakPolarHBondContact O-CE2 3.33Å
249	S	48.8	Very low	56.5	Low	80 Å²	80	79.2 Å²	79.2	56%	0.559	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.5	-173.2	-52.4	0	0	0	0	115.2
250	F	45	Very low	58.9	Low	146 Å²	146	76 Å²	76	64%	0.64	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-15.2	179.8	-69.9	-88.6	0	0	0	113.7	L246 I248 Y252	L246-F250 WeakPolarHBondContact O-CD2 3.19Å; I248-F250 VanDerWaalsContact C-N 3.28Å; I248-F250 PolarHBondContact O-N 2.78Å; F250-Y252 VanDerWaalsContact C-N 3.33Å; F250-Y252 PolarHBondContact O-N 3.35Å
251	Y	49.3	Very low	61.2	Low	99 Å²	99	69.5 Å²	69.5	39%	0.388	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-11.8	-171.2	-91.1	-117.8	0	0	0	114.7	V247 I248 F254	V247-Y251 HydrophobicContact CG1-CE2 3.97Å; V247-Y251 WeakPolarHBondContact O-CD2 3.46Å; I248-Y251 PolarHBondContact O-N 2.68Å; Y251-F254 HydrophobicContact CD1-CE1 4.43Å; Y251-F254 AromaticContact CD1-CZ 3.65Å; Y251-F254 HydrophobicContact CD1-CZ 3.65Å; Y251-F254 HydrophobicContact CD2-CE1 4.49Å; Y251-F254 HydrophobicContact CD2-CZ 4.47Å; Y251-F254 HydrophobicContact CE1-CZ 4.11Å; Y251-F254 HydrophobicContact CG-CE1 4.22Å; Y251-F254 AromaticContact CG-CZ 3.85Å; Y251-F254 HydrophobicContact CG-CZ 3.85Å
252	Y	54.5	Low	62.9	Low	97 Å²	97	64.8 Å²	64.8	38%	0.38	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-30	-175.8	-63.6	-81	0	0	0	113.9	I248 F250 K336	I248-Y252 HydrophobicContact CG2-CE2 4.25Å; I248-Y252 VanDerWaalsContact O-CE2 3.27Å; I248-Y252 WeakPolarHBondContact O-CE2 3.33Å; F250-Y252 VanDerWaalsContact C-N 3.33Å; F250-Y252 PolarHBondContact O-N 3.35Å; Y252-K336 WeakPolarHBondContact CD1-O 3.48Å; Y252-K336 WeakPolarHBondContact CE1-O 3.3Å
253	I	62.2	Low	65.1	Low	48 Å²	48	64.2 Å²	64.2	25%	0.246	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-27.9	-158.2	-33.5	179.5	0	0	0	113.6	P230 V307 Y334	P230-I253 HydrophobicContact CB-CG2 3.86Å; I253-V307 HydrophobicContact CB-CG1 3.84Å; I253-V307 HydrophobicContact CB-CG2 4.01Å; I253-V307 HydrophobicContact CD1-CG1 4.41Å; I253-V307 HydrophobicContact CG2-CG1 3.55Å; I253-Y334 HydrophobicContact CG2-CE1 4.14Å; I253-Y334 WeakPolarHBondContact O-CE1 3.47Å
254	F	76.5	Confident	66.9	Low	31 Å²	31	65.2 Å²	65.2	14%	0.136	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	1.5	179.6	58.2	-111.3	0	0	0	114.1	Y251 Q303 L304 V307	Y251-F254 HydrophobicContact CD1-CE1 4.43Å; Y251-F254 AromaticContact CD1-CZ 3.65Å; Y251-F254 HydrophobicContact CD1-CZ 3.65Å; Y251-F254 HydrophobicContact CD2-CE1 4.49Å; Y251-F254 HydrophobicContact CD2-CZ 4.47Å; Y251-F254 HydrophobicContact CE1-CZ 4.11Å; Y251-F254 HydrophobicContact CG-CE1 4.22Å; Y251-F254 AromaticContact CG-CZ 3.85Å; Y251-F254 HydrophobicContact CG-CZ 3.85Å; F254-Q303 HydrophobicContact CD2-CG 3.6Å; F254-Q303 HydrophobicContact CE2-CG 3.75Å; F254-L304 PolarHBondContact O-N 3.17Å; F254-L304 VanDerWaalsContact O-N 3.09Å; F254-V307 HydrophobicContact CB-CG2 4.22Å; F254-V307 HydrophobicContact CD1-CG2 4.3Å
255	S	81.6	Confident	68.6	Low	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	109.6	178.1	-63.9	0	0	0	0	110.2	S335 L339	S255-S335 WeakPolarHBondContact O-CB 3.26Å; S255-S335 PolarHBondContact O-N 3.32Å; S255-L339 PolarHBondContact OG-N 3.26Å
256	L	86.2	Confident	70.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	151.2	175.6	-64.6	177.7	0	0	0	111.5	F258 Y301 V302 L304 A310 L313 L314 V332 S333 Y334	L256-F258 HydrophobicContact CB-CD2 4.35Å; L256-F258 HydrophobicContact CB-CE2 3.98Å; L256-F258 HydrophobicContact CD1-CE2 4.44Å; L256-Y301 CarbonylContact O-C 3.42Å; L256-Y301 WeakPolarHBondContact O-CA 3.19Å; L256-V302 PolarHBondContact N-O 2.89Å; L256-V302 PolarHBondContact O-N 3.02Å; L256-L304 HydrophobicContact CD1-CD1 3.79Å; L256-L304 HydrophobicContact CG-CD1 4.5Å; L256-A310 HydrophobicContact CD1-CB 4.31Å; L256-A310 HydrophobicContact CD2-CB 4.36Å; L256-A310 HydrophobicContact CG-CB 4.19Å; L256-L313 HydrophobicContact CD1-CD2 3.52Å; L256-L314 HydrophobicContact CD2-CB 4.22Å; L256-V332 HydrophobicContact CB-CG1 4.32Å; L256-V332 HydrophobicContact CD1-CG1 4.22Å; L256-S333 WeakPolarHBondContact CA-O 3.36Å; L256-Y334 HydrophobicContact CD2-CD1 3.71Å; L256-Y334 HydrophobicContact CD2-CE1 3.92Å; L256-Y334 HydrophobicContact CD2-CG 4.35Å
257	L	87.3	Confident	72.7	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	120.9	177.4	-176.5	76.8	0	0	0	109.3	E225 I226 R259 Y299 Y301 V332 S333	E225-L257 HydrophobicContact CB-CD1 4.17Å; E225-L257 HydrophobicContact CB-CD2 4Å; I226-L257 HydrophobicContact CB-CD2 4.5Å; I226-L257 HydrophobicContact CG1-CD2 3.76Å; L257-R259 HydrophobicContact CD2-CG 3.94Å; L257-R259 HydrophobicContact CG-CG 4.02Å; L257-Y299 HydrophobicContact CD1-CD2 3.77Å; L257-Y299 HydrophobicContact CD1-CE2 4.42Å; L257-Y301 HydrophobicContact CD1-CD1 3.81Å; L257-Y301 HydrophobicContact CD1-CE1 3.61Å; L257-Y301 HydrophobicContact CD1-CE2 4.44Å; L257-Y301 HydrophobicContact CD1-CG 4.33Å; L257-V332 CarbonylContact O-C 3.56Å; L257-V332 WeakPolarHBondContact O-CA 3.15Å; L257-S333 PolarHBondContact N-O 3.33Å; L257-S333 PolarHBondContact O-N 3.02Å
258	F	88.9	Confident	74.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	116.8	178.6	-78.2	-129.6	0	0	0	108.2	L256 L261 L274 Y299 A300 V302 L313 L317 L323 V330 V332	L256-F258 HydrophobicContact CB-CD2 4.35Å; L256-F258 HydrophobicContact CB-CE2 3.98Å; L256-F258 HydrophobicContact CD1-CE2 4.44Å; F258-L261 HydrophobicContact CB-CD1 4.18Å; F258-L274 HydrophobicContact CE1-CD1 4.3Å; F258-L274 HydrophobicContact CE1-CD2 3.87Å; F258-L274 HydrophobicContact CE1-CG 4.36Å; F258-L274 HydrophobicContact CZ-CD1 4.3Å; F258-L274 HydrophobicContact CZ-CD2 3.89Å; F258-Y299 CarbonylContact O-C 2.86Å; F258-Y299 WeakPolarHBondContact O-CA 3.18Å; F258-Y299 WeakPolarHBondContact O-CB 3.42Å; F258-A300 PolarHBondContact N-O 3.45Å; F258-A300 PolarHBondContact O-N 3.17Å; F258-V302 HydrophobicContact CD1-CG2 4.42Å; F258-V302 HydrophobicContact CD2-CB 4.05Å; F258-V302 HydrophobicContact CD2-CG2 3.55Å; F258-V302 HydrophobicContact CE1-CG2 4.47Å; F258-V302 HydrophobicContact CE2-CB 3.8Å; F258-V302 HydrophobicContact CE2-CG1 4.34Å; F258-V302 HydrophobicContact CE2-CG2 3.62Å; F258-V302 HydrophobicContact CG-CG2 4.01Å; F258-V302 HydrophobicContact CZ-CB 4.47Å; F258-V302 HydrophobicContact CZ-CG2 4.11Å; F258-L313 HydrophobicContact CE2-CD2 4.48Å; F258-L313 HydrophobicContact CZ-CD2 4.07Å; F258-L317 HydrophobicContact CZ-CD1 4.32Å; F258-L323 HydrophobicContact CD1-CD1 4.49Å; F258-L323 HydrophobicContact CE1-CD1 3.74Å; F258-V330 HydrophobicContact CB-CG1 4.08Å; F258-V330 HydrophobicContact CD1-CG1 3.84Å; F258-V330 HydrophobicContact CG-CG1 4.32Å; F258-V332 HydrophobicContact CD1-CG2 4.1Å; F258-V332 HydrophobicContact CD2-CG1 3.94Å; F258-V332 HydrophobicContact CD2-CG2 4.26Å; F258-V332 HydrophobicContact CE1-CG2 3.97Å; F258-V332 HydrophobicContact CE2-CG1 3.63Å; F258-V332 HydrophobicContact CE2-CG2 4.13Å; F258-V332 HydrophobicContact CG-CG2 4.22Å; F258-V332 HydrophobicContact CZ-CG1 4.14Å; F258-V332 HydrophobicContact CZ-CG2 3.97Å
259	R	86.9	Confident	76.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	166.4	-177.6	-60.5	-180	-69.1	128.6	-8.4	111.8	G192 I226 L257 L261 V330 L331 S333	G192-R259 PolarHBondContact O-NH1 3.44Å; G192-R259 PolarHBondContact O-NH2 3.08Å; I226-R259 VanDerWaalsContact CD1-CZ 3.43Å; L257-R259 HydrophobicContact CD2-CG 3.94Å; L257-R259 HydrophobicContact CG-CG 4.02Å; R259-L261 VanDerWaalsContact C-N 3.3Å; R259-V330 WeakPolarHBondContact O-CG1 3.15Å; R259-L331 HydrophobicContact CB-CB 4.29Å; R259-L331 PolarHBondContact N-O 3.35Å; R259-L331 PolarHBondContact O-N 2.63Å; R259-S333 PolarHBondContact NH2-OG 3.3Å
260	N	83	Confident	78.2	Confident	46 Å²	46	51.1 Å²	51.1	25%	0.246	24%	0.242	C	C	.	.	S	Bend	trans	64.5	28.5	-175.8	-166.4	36.9	0	0	0	114.1	G298 R328 E329	N260-G298 PolarHBondContact N-O 3.35Å; N260-R328 WeakPolarHBondContact O-CD 3.41Å; N260-E329 PolarHBondContact ND2-O 3.19Å
261	L	85.3	Confident	80.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.226	C	C	.	.			trans	-73.3	150.8	174.2	-59.6	174.1	0	0	0	110.9	F258 R259 I265 I270 G298 A300 I325 R328 V330	F258-L261 HydrophobicContact CB-CD1 4.18Å; R259-L261 VanDerWaalsContact C-N 3.3Å; L261-I265 HydrophobicContact CB-CD1 4.3Å; L261-I265 HydrophobicContact CB-CG2 4.31Å; L261-I265 HydrophobicContact CD2-CD1 3.97Å; L261-I270 HydrophobicContact CD1-CD1 4.23Å; L261-G298 WeakPolarHBondContact CB-O 3.18Å; L261-G298 PolarHBondContact N-O 2.97Å; L261-G298 WeakPolarHBondContact O-CA 3.47Å; L261-A300 HydrophobicContact CD1-CB 3.54Å; L261-I325 HydrophobicContact CD2-CD1 4.21Å; L261-R328 PolarHBondContact O-NH1 3.26Å; L261-V330 HydrophobicContact CD2-CB 4.39Å; L261-V330 HydrophobicContact CD2-CG1 3.66Å; L261-V330 HydrophobicContact CD2-CG2 3.78Å
262	P	82	Confident	81.9	Confident	7 Å²	7	45.4 Å²	45.4	5%	0.045	23%	0.229	C	C	.	.			trans	-63	146	170.1	22.5	-29.5	0	0	0	112.1	Q264 I265 I325 E326	P262-Q264 PolarHBondContact O-N 2.96Å; P262-I265 HydrophobicContact CG-CB 4.11Å; P262-I265 HydrophobicContact CG-CD1 4.2Å; P262-I265 HydrophobicContact CG-CG1 4.44Å; P262-I265 WeakPolarHBondContact O-CB 3.32Å; P262-I265 WeakPolarHBondContact O-CG2 3.42Å; P262-I265 PolarHBondContact O-N 2.9Å; P262-I325 HydrophobicContact CG-CG2 4.4Å; P262-E326 VanDerWaalsContact CB-OE2 3.28Å; P262-E326 WeakPolarHBondContact CB-OE2 3.42Å; P262-E326 HydrophobicContact CG-CB 4.11Å; P262-E326 HydrophobicContact CG-CG 4.29Å; P262-E326 WeakPolarHBondContact CG-OE2 3.47Å
263	Y	82	Confident	83.3	Confident	125 Å²	125	42.4 Å²	42.4	49%	0.49	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.3	-176.8	-62	-62.4	0	0	0	114	S296	Y263-S296 WeakPolarHBondContact CD1-O 3.31Å; Y263-S296 VanDerWaalsContact O-CB 3.3Å; Y263-S296 WeakPolarHBondContact O-CB 3.42Å
264	Q	80.3	Confident	84.3	Confident	164 Å²	164	40.3 Å²	40.3	77%	0.766	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109	32.6	179	-64	176.2	-17.1	0	0	111.8	P262 K269	P262-Q264 PolarHBondContact O-N 2.96Å; Q264-K269 PolarHBondContact O-NZ 2.84Å
265	I	83.1	Confident	84.6	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	24%	0.239	C	C	.	.			trans	-85	138.4	179.1	-158	165.9	0	0	0	112.5	L261 P262 K269 I270 I287 I325	L261-I265 HydrophobicContact CB-CD1 4.3Å; L261-I265 HydrophobicContact CB-CG2 4.31Å; L261-I265 HydrophobicContact CD2-CD1 3.97Å; P262-I265 HydrophobicContact CG-CB 4.11Å; P262-I265 HydrophobicContact CG-CD1 4.2Å; P262-I265 HydrophobicContact CG-CG1 4.44Å; P262-I265 WeakPolarHBondContact O-CB 3.32Å; P262-I265 WeakPolarHBondContact O-CG2 3.42Å; P262-I265 PolarHBondContact O-N 2.9Å; I265-K269 HydrophobicContact CG1-CB 4.23Å; I265-K269 HydrophobicContact CG1-CD 4.37Å; I265-I270 HydrophobicContact CD1-CD1 3.95Å; I265-I270 HydrophobicContact CD1-CG1 3.41Å; I265-I270 VanDerWaalsContact CD1-CG1 3.41Å; I265-I270 HydrophobicContact CG1-CD1 4.24Å; I265-I270 HydrophobicContact CG1-CG1 3.84Å; I265-I270 HydrophobicContact CG2-CD1 4.42Å; I265-I287 HydrophobicContact CG2-CD1 4.12Å; I265-I287 HydrophobicContact CG2-CG2 4.45Å; I265-I287 WeakPolarHBondContact O-CD1 3.35Å; I265-I325 HydrophobicContact CD1-CD1 4.33Å; I265-I325 HydrophobicContact CD1-CG2 3.85Å
266	D	84.6	Confident	84.6	Confident	82 Å²	82	54.1 Å²	54.1	44%	0.439	28%	0.278	S	S	.	.			trans	-106.4	150.2	172.8	-55.6	-67.2	0	0	0	110.3	A268 K269 I270	D266-A268 PolarHBondContact O-N 2.8Å; D266-K269 HydrophobicContact CB-CD 4.49Å; D266-K269 HydrophobicContact CB-CG 4.29Å; D266-K269 WeakPolarHBondContact O-CB 3.4Å; D266-K269 PolarHBondContact O-N 3.04Å; D266-K269 VanDerWaalsContact OD2-CE 3.26Å; D266-K269 WeakPolarHBondContact OD2-CE 3.34Å; D266-K269 IonicContact OD2-NZ 3.65Å; D266-I270 PolarHBondContact O-N 2.7Å
267	E	85.5	Confident	84.1	Confident	89 Å²	89	56.3 Å²	56.3	42%	0.416	29%	0.293	S	S	.	.	H	α-helix	trans	-55	-39.7	178.1	177.2	167.9	-166.5	0	0	112.2	K269 I270 L271 I285 I287	E267-K269 VanDerWaalsContact C-N 3.3Å; E267-K269 PolarHBondContact O-N 3.23Å; E267-I270 PolarHBondContact O-N 3.17Å; E267-I270 VanDerWaalsContact O-N 3.12Å; E267-L271 HydrophobicContact CG-CD1 4.12Å; E267-L271 PolarHBondContact O-N 2.99Å; E267-I285 HydrophobicContact CG-CB 3.97Å; E267-I285 HydrophobicContact CG-CD1 4.5Å; E267-I285 HydrophobicContact CG-CG2 4.38Å; E267-I287 HydrophobicContact CB-CD1 4.42Å
268	A	85.7	Confident	83.4	Confident	70 Å²	70	57 Å²	57	58%	0.579	30%	0.297	S	S	*	.	H	α-helix	trans	-61	-32.8	176.4	0	0	0	0	0	113.7	D266 S272	D266-A268 PolarHBondContact O-N 2.8Å; A268-S272 WeakPolarHBondContact O-CB 3.34Å; A268-S272 PolarHBondContact O-N 2.91Å; A268-S272 PolarHBondContact O-OG 2.72Å
269	K	86.5	Confident	82.7	Confident	65 Å²	65	62.9 Å²	62.9	28%	0.283	34%	0.339	S	S	.	.	H	α-helix	trans	-70.9	-36.7	175.2	-62.4	178.5	-175	175.2	0	111.4	Q264 I265 D266 E267 S272 T273 E326	Q264-K269 PolarHBondContact O-NZ 2.84Å; I265-K269 HydrophobicContact CG1-CB 4.23Å; I265-K269 HydrophobicContact CG1-CD 4.37Å; D266-K269 HydrophobicContact CB-CD 4.49Å; D266-K269 HydrophobicContact CB-CG 4.29Å; D266-K269 WeakPolarHBondContact O-CB 3.4Å; D266-K269 PolarHBondContact O-N 3.04Å; D266-K269 VanDerWaalsContact OD2-CE 3.26Å; D266-K269 WeakPolarHBondContact OD2-CE 3.34Å; D266-K269 IonicContact OD2-NZ 3.65Å; E267-K269 VanDerWaalsContact C-N 3.3Å; E267-K269 PolarHBondContact O-N 3.23Å; K269-S272 PolarHBondContact O-OG 2.93Å; K269-T273 WeakPolarHBondContact O-CB 3.48Å; K269-T273 WeakPolarHBondContact O-CG2 3.49Å; K269-T273 PolarHBondContact O-N 3.19Å; K269-T273 VanDerWaalsContact O-N 3.16Å; K269-T273 PolarHBondContact O-OG1 3.48Å; K269-E326 WeakPolarHBondContact CD-OE1 3.43Å; K269-E326 WeakPolarHBondContact CE-OE1 3.39Å; K269-E326 IonicContact NZ-OE1 2.73Å; K269-E326 PolarHBondContact NZ-OE1 3.37Å
270	I	86.6	Confident	82.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-68.7	-45.5	176.3	-54.9	171.1	0	0	0	109.6	L261 I265 D266 E267 T273 L274 I285 I287 A300	L261-I270 HydrophobicContact CD1-CD1 4.23Å; I265-I270 HydrophobicContact CD1-CD1 3.95Å; I265-I270 HydrophobicContact CD1-CG1 3.41Å; I265-I270 VanDerWaalsContact CD1-CG1 3.41Å; I265-I270 HydrophobicContact CG1-CD1 4.24Å; I265-I270 HydrophobicContact CG1-CG1 3.84Å; I265-I270 HydrophobicContact CG2-CD1 4.42Å; D266-I270 PolarHBondContact O-N 2.7Å; E267-I270 PolarHBondContact O-N 3.17Å; E267-I270 VanDerWaalsContact O-N 3.12Å; I270-T273 PolarHBondContact O-OG1 3.35Å; I270-L274 HydrophobicContact CG2-CD1 3.95Å; I270-L274 HydrophobicContact CG2-CG 4.46Å; I270-L274 VanDerWaalsContact O-CB 3.3Å; I270-L274 WeakPolarHBondContact O-CB 3.27Å; I270-L274 WeakPolarHBondContact O-CG 3.46Å; I270-L274 PolarHBondContact O-N 2.77Å; I270-I285 HydrophobicContact CB-CD1 3.98Å; I270-I285 HydrophobicContact CD1-CG2 4.17Å; I270-I285 HydrophobicContact CG2-CD1 3.68Å; I270-I287 HydrophobicContact CD1-CD1 4.06Å; I270-I287 HydrophobicContact CD1-CG1 3.91Å; I270-A300 HydrophobicContact CD1-CB 4.1Å
271	L	85.4	Confident	82.2	Confident	58 Å²	58	68.2 Å²	68.2	30%	0.304	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-47.7	175.6	-71.7	169.9	0	0	0	112.3	E267 T273 L274 M275 V282 I285	E267-L271 HydrophobicContact CG-CD1 4.12Å; E267-L271 PolarHBondContact O-N 2.99Å; L271-T273 PolarHBondContact O-N 3.28Å; L271-L274 PolarHBondContact O-N 3.49Å; L271-M275 WeakPolarHBondContact O-CB 3.33Å; L271-M275 VanDerWaalsContact O-CG 3.27Å; L271-M275 WeakPolarHBondContact O-CG 3.3Å; L271-M275 PolarHBondContact O-N 2.83Å; L271-V282 HydrophobicContact CD2-CB 4.07Å; L271-V282 HydrophobicContact CD2-CG1 4.23Å; L271-V282 HydrophobicContact CD2-CG2 4.31Å; L271-I285 HydrophobicContact CD2-CD1 3.69Å; L271-I285 HydrophobicContact CD2-CG1 4.32Å; L271-I285 HydrophobicContact CG-CD1 3.83Å
272	S	85	Confident	82.1	Confident	67 Å²	67	69.9 Å²	69.9	47%	0.469	38%	0.378	S	S	.	.	H	α-helix	trans	-65.5	-41.2	-177.8	64.2	0	0	0	0	112.8	A268 K269 Q276	A268-S272 WeakPolarHBondContact O-CB 3.34Å; A268-S272 PolarHBondContact O-N 2.91Å; A268-S272 PolarHBondContact O-OG 2.72Å; K269-S272 PolarHBondContact O-OG 2.93Å; S272-Q276 WeakPolarHBondContact O-CB 3.49Å; S272-Q276 PolarHBondContact O-N 3.27Å
273	T	83.9	Confident	82.2	Confident	34 Å²	34	72.3 Å²	72.3	21%	0.209	40%	0.395	C	S	.	.	H	α-helix	trans	-71	-33.1	176.8	52	0	0	0	0	112.7	K269 I270 L271 S277 I325	K269-T273 WeakPolarHBondContact O-CB 3.48Å; K269-T273 WeakPolarHBondContact O-CG2 3.49Å; K269-T273 PolarHBondContact O-N 3.19Å; K269-T273 VanDerWaalsContact O-N 3.16Å; K269-T273 PolarHBondContact O-OG1 3.48Å; I270-T273 PolarHBondContact O-OG1 3.35Å; L271-T273 PolarHBondContact O-N 3.28Å; T273-S277 WeakPolarHBondContact O-CB 3.37Å; T273-S277 PolarHBondContact O-N 2.94Å; T273-S277 PolarHBondContact O-OG 2.95Å; T273-I325 HydrophobicContact CG2-CG1 4.29Å; T273-I325 WeakPolarHBondContact OG1-CD1 3.5Å
274	L	84.8	Confident	82.2	Confident	5 Å²	5	70.4 Å²	70.4	3%	0.026	39%	0.39	C	S	.	.	H	α-helix	trans	-64.6	-54.1	169.8	-81	173.6	0	0	0	111.1	F258 I270 L271 Q276 S277 C278 V282 I285 V302 L313 L323	F258-L274 HydrophobicContact CE1-CD1 4.3Å; F258-L274 HydrophobicContact CE1-CD2 3.87Å; F258-L274 HydrophobicContact CE1-CG 4.36Å; F258-L274 HydrophobicContact CZ-CD1 4.3Å; F258-L274 HydrophobicContact CZ-CD2 3.89Å; I270-L274 HydrophobicContact CG2-CD1 3.95Å; I270-L274 HydrophobicContact CG2-CG 4.46Å; I270-L274 VanDerWaalsContact O-CB 3.3Å; I270-L274 WeakPolarHBondContact O-CB 3.27Å; I270-L274 WeakPolarHBondContact O-CG 3.46Å; I270-L274 PolarHBondContact O-N 2.77Å; L271-L274 PolarHBondContact O-N 3.49Å; L274-Q276 PolarHBondContact O-N 2.87Å; L274-Q276 VanDerWaalsContact O-N 3.15Å; L274-S277 PolarHBondContact O-N 3.36Å; L274-S277 PolarHBondContact O-OG 2.96Å; L274-C278 CarbonylContact O-C 3.57Å; L274-C278 PolarHBondContact O-N 3.05Å; L274-V282 HydrophobicContact CD1-CG2 4.1Å; L274-I285 HydrophobicContact CD1-CD1 4.47Å; L274-V302 HydrophobicContact CD1-CG1 4.24Å; L274-L313 HydrophobicContact CD2-CD1 4.33Å; L274-L323 HydrophobicContact CD2-CD1 3.99Å
275	M	82.7	Confident	82.6	Confident	147 Å²	147	62.9 Å²	62.9	72%	0.724	36%	0.355	S	S	*	.	H	α-helix	trans	-59.2	-30.8	-178.9	-69.6	176.7	73.8	0	0	113.1	L271	L271-M275 WeakPolarHBondContact O-CB 3.33Å; L271-M275 VanDerWaalsContact O-CG 3.27Å; L271-M275 WeakPolarHBondContact O-CG 3.3Å; L271-M275 PolarHBondContact O-N 2.83Å
276	Q	81.4	Confident	82.8	Confident	174 Å²	174	65.3 Å²	65.3	81%	0.813	37%	0.366	S	S	*	.	H	α-helix	trans	-75.1	-23.5	175.8	-171.1	175.5	17.1	0	0	113.9	S272 L274	S272-Q276 WeakPolarHBondContact O-CB 3.49Å; S272-Q276 PolarHBondContact O-N 3.27Å; L274-Q276 PolarHBondContact O-N 2.87Å; L274-Q276 VanDerWaalsContact O-N 3.15Å
277	S	75.8	Confident	83	Confident	46 Å²	46	62.2 Å²	62.2	32%	0.322	35%	0.349	S	S	.	.	H	α-helix	trans	-113.6	-21.5	-172.5	58.5	0	0	0	0	114.9	T273 L274 L323	T273-S277 WeakPolarHBondContact O-CB 3.37Å; T273-S277 PolarHBondContact O-N 2.94Å; T273-S277 PolarHBondContact O-OG 2.95Å; L274-S277 PolarHBondContact O-N 3.36Å; L274-S277 PolarHBondContact O-OG 2.96Å; S277-L323 WeakPolarHBondContact OG-CD2 3.46Å
278	C	71.5	Confident	83	Confident	13 Å²	13	58.3 Å²	58.3	9%	0.088	33%	0.332	C	S	.	.			trans	-151.3	115.6	-178.6	-80.1	0	0	0	0	109.4	L274 V280 L313	L274-C278 CarbonylContact O-C 3.57Å; L274-C278 PolarHBondContact O-N 3.05Å; C278-V280 HydrophobicContact CB-CG2 4.27Å; C278-V280 PolarHBondContact O-N 3.42Å; C278-L313 HydrophobicContact CB-CD1 4.03Å
279	S	74.8	Confident	83	Confident	125 Å²	125	61.4 Å²	61.4	87%	0.874	33%	0.329	S	S	*	.			trans	-76.8	70	175.4	58.4	0	0	0	0	111.4
280	V	77.9	Confident	82.6	Confident	35 Å²	35	59.9 Å²	59.9	21%	0.212	32%	0.324	C	S	.	.			trans	-127.9	130.7	-176.7	-179.3	0	0	0	0	110.4	C278 V282 L304 D309 L313	C278-V280 HydrophobicContact CB-CG2 4.27Å; C278-V280 PolarHBondContact O-N 3.42Å; V280-V282 PolarHBondContact O-N 2.67Å; V280-L304 HydrophobicContact CG1-CD1 4.39Å; V280-L304 HydrophobicContact CG1-CD2 3.9Å; V280-D309 HydrophobicContact CG1-CB 3.9Å; V280-L313 HydrophobicContact CB-CD1 3.96Å; V280-L313 HydrophobicContact CG1-CD1 4.21Å; V280-L313 HydrophobicContact CG2-CD1 4Å
281	D	80.7	Confident	82	Confident	123 Å²	123	63 Å²	63	66%	0.658	34%	0.344	S	S	*	.			trans	-74.5	114	179.9	-70.6	-27.1	0	0	0	111.8	N305	D281-N305 VanDerWaalsContact CB-ND2 3.26Å; D281-N305 WeakPolarHBondContact CB-ND2 3.39Å
282	V	84.1	Confident	81.3	Confident	35 Å²	35	68.4 Å²	68.4	21%	0.212	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124.4	176.2	-176.9	0	0	0	0	110	L271 L274 V280 I285 V302 L304	L271-V282 HydrophobicContact CD2-CB 4.07Å; L271-V282 HydrophobicContact CD2-CG1 4.23Å; L271-V282 HydrophobicContact CD2-CG2 4.31Å; L274-V282 HydrophobicContact CD1-CG2 4.1Å; V280-V282 PolarHBondContact O-N 2.67Å; V282-I285 HydrophobicContact CG1-CD1 4.18Å; V282-I285 HydrophobicContact CG1-CG1 3.67Å; V282-V302 HydrophobicContact CG1-CG1 3.77Å; V282-V302 HydrophobicContact CG2-CG1 4.26Å; V282-L304 HydrophobicContact CB-CD2 4.28Å; V282-L304 HydrophobicContact CG2-CD2 3.83Å
283	C	83.5	Confident	81	Confident	57 Å²	57	69.2 Å²	69.2	39%	0.385	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-47.1	175.8	-49.5	0	0	0	0	111.8	Q303 L304 N305	C283-Q303 HydrophobicContact CB-CB 4.31Å; C283-Q303 HydrophobicContact CB-CG 4.28Å; C283-Q303 PolarHBondContact N-O 2.99Å; C283-L304 PolarHBondContact SG-O 3.08Å; C283-N305 VanDerWaalsContact SG-CA 3.56Å; C283-N305 PolarHBondContact SG-N 2.89Å; C283-N305 PolarHBondContact SG-OD1 2.69Å
284	Q	83.3	Confident	80.6	Confident	86 Å²	86	69.7 Å²	69.7	40%	0.402	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	142.7	-168.4	-170.2	173.1	14.5	0	0	110.3	Q303 L339	Q284-Q303 HydrophobicContact CB-CB 4.48Å; Q284-Q303 PolarHBondContact O-N 2.87Å; Q284-L339 HydrophobicContact CB-CD2 3.83Å; Q284-L339 HydrophobicContact CG-CD2 3.84Å
285	I	87.2	Confident	80.3	Confident	6 Å²	6	74.9 Å²	74.9	3%	0.031	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	150.7	168.8	-56.9	-171.1	0	0	0	109.1	E267 I270 L271 L274 V282 A300 Y301 V302	E267-I285 HydrophobicContact CG-CB 3.97Å; E267-I285 HydrophobicContact CG-CD1 4.5Å; E267-I285 HydrophobicContact CG-CG2 4.38Å; I270-I285 HydrophobicContact CB-CD1 3.98Å; I270-I285 HydrophobicContact CD1-CG2 4.17Å; I270-I285 HydrophobicContact CG2-CD1 3.68Å; L271-I285 HydrophobicContact CD2-CD1 3.69Å; L271-I285 HydrophobicContact CD2-CG1 4.32Å; L271-I285 HydrophobicContact CG-CD1 3.83Å; L274-I285 HydrophobicContact CD1-CD1 4.47Å; V282-I285 HydrophobicContact CG1-CD1 4.18Å; V282-I285 HydrophobicContact CG1-CG1 3.67Å; I285-A300 HydrophobicContact CG2-CB 4.42Å; I285-Y301 CarbonylContact C-O 3.5Å; I285-Y301 WeakPolarHBondContact CA-O 3.41Å; I285-V302 HydrophobicContact CD1-CG2 4.31Å; I285-V302 HydrophobicContact CG1-CG1 4.44Å; I285-V302 HydrophobicContact CG1-CG2 4.26Å; I285-V302 HydrophobicContact CG2-CG2 4.4Å
286	F	87.4	Confident	80.4	Confident	55 Å²	55	68.5 Å²	68.5	24%	0.241	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	111.5	169.1	-177	-92	0	0	0	110.4	A288 A300 Y301 L339 V342 I343 A346	F286-A288 PolarHBondContact O-N 3.5Å; F286-A300 CarbonylContact O-C 3.56Å; F286-A300 WeakPolarHBondContact O-CA 3.27Å; F286-Y301 HydrophobicContact CD1-CD2 4.16Å; F286-Y301 PolarHBondContact N-O 3.26Å; F286-Y301 PolarHBondContact O-N 3.49Å; F286-L339 HydrophobicContact CB-CD1 3.38Å; F286-L339 HydrophobicContact CG-CD1 4.14Å; F286-V342 HydrophobicContact CD1-CG1 3.7Å; F286-V342 HydrophobicContact CE1-CG1 3.72Å; F286-I343 HydrophobicContact CD2-CG1 3.94Å; F286-I343 HydrophobicContact CE2-CG1 4.41Å; F286-I343 HydrophobicContact CG-CG1 4.3Å; F286-A346 HydrophobicContact CE1-CB 4.25Å; F286-A346 HydrophobicContact CE2-CB 4.15Å; F286-A346 HydrophobicContact CZ-CB 3.45Å; F286-A346 VanDerWaalsContact CZ-CB 3.45Å
287	I	89.2	Confident	80.4	Confident	16 Å²	16	64.5 Å²	64.5	8%	0.082	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	121.7	174.8	-62	165.7	0	0	0	108	I265 E267 I270 R289 A300	I265-I287 HydrophobicContact CG2-CD1 4.12Å; I265-I287 HydrophobicContact CG2-CG2 4.45Å; I265-I287 WeakPolarHBondContact O-CD1 3.35Å; E267-I287 HydrophobicContact CB-CD1 4.42Å; I270-I287 HydrophobicContact CD1-CD1 4.06Å; I270-I287 HydrophobicContact CD1-CG1 3.91Å; I287-R289 HydrophobicContact CG2-CG 4.32Å; I287-R289 PolarHBondContact O-N 2.72Å; I287-R289 VanDerWaalsContact O-N 3.14Å; I287-A300 HydrophobicContact CB-CB 4.5Å; I287-A300 HydrophobicContact CG1-CB 4.1Å
288	A	85.9	Confident	80.7	Confident	7 Å²	7	62.6 Å²	62.6	6%	0.058	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	113.8	176.8	0	0	0	0	0	109.3	F286 R297 Y299 Y301	F286-A288 PolarHBondContact O-N 3.5Å; A288-R297 HydrophobicContact CB-CB 4.5Å; A288-R297 PolarHBondContact O-N 3.15Å; A288-Y299 HydrophobicContact CB-CD1 4.26Å; A288-Y299 HydrophobicContact CB-CD2 3.53Å; A288-Y299 HydrophobicContact CB-CE1 3.99Å; A288-Y299 HydrophobicContact CB-CE2 3.25Å; A288-Y299 HydrophobicContact CB-CG 4.05Å; A288-Y299 VanDerWaalsContact CB-CZ 3.48Å; A288-Y299 WeakPolarHBondContact CB-O 3.24Å; A288-Y299 PolarHBondContact N-O 3.22Å; A288-Y301 HydrophobicContact CB-CE2 4.27Å
289	R	85.4	Confident	81.5	Confident	135 Å²	135	62.6 Å²	62.6	51%	0.509	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	148.7	176.6	-68.3	175.3	179.4	-162.9	-2.3	110	I287 G294 L295	I287-R289 HydrophobicContact CG2-CG 4.32Å; I287-R289 PolarHBondContact O-N 2.72Å; I287-R289 VanDerWaalsContact O-N 3.14Å; R289-G294 WeakPolarHBondContact CD-O 3.42Å; R289-G294 WeakPolarHBondContact CG-O 3.49Å; R289-L295 CarbonylContact C-O 3.51Å; R289-L295 VanDerWaalsContact CA-O 3.24Å; R289-L295 WeakPolarHBondContact CA-O 3.44Å
290	N	77.2	Confident	82.2	Confident	34 Å²	34	56.6 Å²	56.6	18%	0.182	30%	0.3	C	S	.	.			trans	-74.9	124.3	173.6	-165.9	50.7	0	0	0	109	E292 T293 G294 L295 R297	N290-E292 PolarHBondContact ND2-OE2 2.99Å; N290-E292 PolarHBondContact O-N 3.39Å; N290-T293 PolarHBondContact ND2-OG1 3.25Å; N290-T293 PolarHBondContact O-N 3.46Å; N290-G294 WeakPolarHBondContact O-CA 3.45Å; N290-G294 PolarHBondContact O-N 3.27Å; N290-L295 PolarHBondContact N-O 3.34Å; N290-R297 HydrophobicContact CB-CG 4.33Å; N290-R297 PolarHBondContact OD1-NE 3.27Å; N290-R297 PolarHBondContact OD1-NH2 3.13Å
291	P	74.1	Confident	82.7	Confident	64 Å²	64	55.2 Å²	55.2	42%	0.416	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-31	-173	23	-33.2	0	0	0	113.2
292	E	71.5	Confident	83.1	Confident	172 Å²	172	49.3 Å²	49.3	80%	0.804	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-34	-178.2	-58.4	166.7	156.4	0	0	113.7	N290	N290-E292 PolarHBondContact ND2-OE2 2.99Å; N290-E292 PolarHBondContact O-N 3.39Å
293	T	78.3	Confident	83.3	Confident	84 Å²	84	49.2 Å²	49.2	52%	0.515	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-8.2	-171.3	58.8	0	0	0	0	114.1	N290 L295	N290-T293 PolarHBondContact ND2-OG1 3.25Å; N290-T293 PolarHBondContact O-N 3.46Å; T293-L295 PolarHBondContact O-N 3.11Å
294	G	75.4	Confident	83.4	Confident	44 Å²	44	46.6 Å²	46.6	45%	0.454	24%	0.238	S	C	.	.			trans	68	-12.8	-176.2	0	0	0	0	0	115.3	R289 N290	R289-G294 WeakPolarHBondContact CD-O 3.42Å; R289-G294 WeakPolarHBondContact CG-O 3.49Å; N290-G294 WeakPolarHBondContact O-CA 3.45Å; N290-G294 PolarHBondContact O-N 3.27Å
295	L	79.3	Confident	83.4	Confident	115 Å²	115	47.5 Å²	47.5	60%	0.602	25%	0.246	S	C	*	.			trans	-64.6	144.9	-179.4	-62.9	175.8	0	0	0	111.5	R289 N290 T293	R289-L295 CarbonylContact C-O 3.51Å; R289-L295 VanDerWaalsContact CA-O 3.24Å; R289-L295 WeakPolarHBondContact CA-O 3.44Å; N290-L295 PolarHBondContact N-O 3.34Å; T293-L295 PolarHBondContact O-N 3.11Å
296	S	83.6	Confident	83.1	Confident	12 Å²	12	49.3 Å²	49.3	8%	0.084	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	142.9	169.6	179.5	0	0	0	0	110.7	Y263 G298	Y263-S296 WeakPolarHBondContact CD1-O 3.31Å; Y263-S296 VanDerWaalsContact O-CB 3.3Å; Y263-S296 WeakPolarHBondContact O-CB 3.42Å; S296-G298 VanDerWaalsContact C-N 3.26Å; S296-G298 PolarHBondContact OG-N 3.29Å
297	R	81.5	Confident	82.9	Confident	91 Å²	91	49.5 Å²	49.5	34%	0.343	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	12.2	168.9	-64.5	-178	169.2	178.7	-2.6	112.4	D221 A288 N290 Y299	D221-R297 HydrophobicContact CB-CB 4.43Å; D221-R297 WeakPolarHBondContact CB-O 3.49Å; A288-R297 HydrophobicContact CB-CB 4.5Å; A288-R297 PolarHBondContact O-N 3.15Å; N290-R297 HydrophobicContact CB-CG 4.33Å; N290-R297 PolarHBondContact OD1-NE 3.27Å; N290-R297 PolarHBondContact OD1-NH2 3.13Å; R297-Y299 HydrophobicContact CB-CD1 3.71Å; R297-Y299 HydrophobicContact CB-CE1 3.42Å; R297-Y299 VanDerWaalsContact CB-CE1 3.42Å; R297-Y299 HydrophobicContact CG-CE1 4.32Å; R297-Y299 WeakPolarHBondContact O-CD1 3.38Å; R297-Y299 PolarHBondContact O-N 3.29Å
298	G	82.8	Confident	82.6	Confident	5 Å²	5	52.4 Å²	52.4	5%	0.052	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	70.5	13.9	179.5	0	0	0	0	0	114.7	N260 L261 S296	N260-G298 PolarHBondContact N-O 3.35Å; L261-G298 WeakPolarHBondContact CB-O 3.18Å; L261-G298 PolarHBondContact N-O 2.97Å; L261-G298 WeakPolarHBondContact O-CA 3.47Å; S296-G298 VanDerWaalsContact C-N 3.26Å; S296-G298 PolarHBondContact OG-N 3.29Å
299	Y	88.1	Confident	82.6	Confident	13 Å²	13	54.1 Å²	54.1	5%	0.051	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	152.8	170.6	68.3	-87.6	0	0	0	112.6	D221 G222 E225 L257 F258 A288 R297 Y301	D221-Y299 HydrophobicContact CB-CD1 4.25Å; D221-Y299 HydrophobicContact CB-CE1 4.18Å; D221-Y299 VanDerWaalsContact O-CD1 3.32Å; D221-Y299 WeakPolarHBondContact O-CD1 3.46Å; G222-Y299 VanDerWaalsContact CA-CD1 3.49Å; G222-Y299 VanDerWaalsContact CA-CE1 3.4Å; E225-Y299 HydrophobicContact CG-CE2 3.97Å; L257-Y299 HydrophobicContact CD1-CD2 3.77Å; L257-Y299 HydrophobicContact CD1-CE2 4.42Å; F258-Y299 CarbonylContact O-C 2.86Å; F258-Y299 WeakPolarHBondContact O-CA 3.18Å; F258-Y299 WeakPolarHBondContact O-CB 3.42Å; A288-Y299 HydrophobicContact CB-CD1 4.26Å; A288-Y299 HydrophobicContact CB-CD2 3.53Å; A288-Y299 HydrophobicContact CB-CE1 3.99Å; A288-Y299 HydrophobicContact CB-CE2 3.25Å; A288-Y299 HydrophobicContact CB-CG 4.05Å; A288-Y299 VanDerWaalsContact CB-CZ 3.48Å; A288-Y299 WeakPolarHBondContact CB-O 3.24Å; A288-Y299 PolarHBondContact N-O 3.22Å; R297-Y299 HydrophobicContact CB-CD1 3.71Å; R297-Y299 HydrophobicContact CB-CE1 3.42Å; R297-Y299 VanDerWaalsContact CB-CE1 3.42Å; R297-Y299 HydrophobicContact CG-CE1 4.32Å; R297-Y299 WeakPolarHBondContact O-CD1 3.38Å; R297-Y299 PolarHBondContact O-N 3.29Å; Y299-Y301 HydrophobicContact CD2-CE2 4.09Å; Y299-Y301 AromaticContact CE2-CE2 3.76Å; Y299-Y301 HydrophobicContact CE2-CE2 3.76Å; Y299-Y301 AromaticContact CE2-CZ 3.97Å
300	A	89.2	Confident	82.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	155	178.3	0	0	0	0	0	110.9	F258 L261 I270 I285 F286 I287	F258-A300 PolarHBondContact N-O 3.45Å; F258-A300 PolarHBondContact O-N 3.17Å; L261-A300 HydrophobicContact CD1-CB 3.54Å; I270-A300 HydrophobicContact CD1-CB 4.1Å; I285-A300 HydrophobicContact CG2-CB 4.42Å; F286-A300 CarbonylContact O-C 3.56Å; F286-A300 WeakPolarHBondContact O-CA 3.27Å; I287-A300 HydrophobicContact CB-CB 4.5Å; I287-A300 HydrophobicContact CG1-CB 4.1Å
301	Y	89.4	Confident	82.9	Confident	5 Å²	5	47.6 Å²	47.6	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.3	172.6	-59.7	-95.1	0	0	0	108.8	E225 L256 L257 I285 F286 A288 Y299 S335 V342	E225-Y301 HydrophobicContact CB-CE1 4.43Å; E225-Y301 WeakPolarHBondContact CG-OH 3.48Å; E225-Y301 PolarHBondContact OE2-OH 3.2Å; L256-Y301 CarbonylContact O-C 3.42Å; L256-Y301 WeakPolarHBondContact O-CA 3.19Å; L257-Y301 HydrophobicContact CD1-CD1 3.81Å; L257-Y301 HydrophobicContact CD1-CE1 3.61Å; L257-Y301 HydrophobicContact CD1-CE2 4.44Å; L257-Y301 HydrophobicContact CD1-CG 4.33Å; I285-Y301 CarbonylContact C-O 3.5Å; I285-Y301 WeakPolarHBondContact CA-O 3.41Å; F286-Y301 HydrophobicContact CD1-CD2 4.16Å; F286-Y301 PolarHBondContact N-O 3.26Å; F286-Y301 PolarHBondContact O-N 3.49Å; A288-Y301 HydrophobicContact CB-CE2 4.27Å; Y299-Y301 HydrophobicContact CD2-CE2 4.09Å; Y299-Y301 AromaticContact CE2-CE2 3.76Å; Y299-Y301 HydrophobicContact CE2-CE2 3.76Å; Y299-Y301 AromaticContact CE2-CZ 3.97Å; Y301-S335 WeakPolarHBondContact CD1-OG 3.4Å; Y301-S335 VanDerWaalsContact CE1-OG 3.29Å; Y301-S335 WeakPolarHBondContact CE1-OG 3.43Å; Y301-V342 HydrophobicContact CD1-CG2 4.04Å; Y301-V342 HydrophobicContact CD2-CG1 3.83Å; Y301-V342 HydrophobicContact CD2-CG2 4.26Å; Y301-V342 HydrophobicContact CE1-CG2 3.71Å; Y301-V342 HydrophobicContact CE2-CB 4.32Å; Y301-V342 HydrophobicContact CE2-CG1 3.46Å; Y301-V342 VanDerWaalsContact CE2-CG1 3.46Å; Y301-V342 HydrophobicContact CE2-CG2 3.96Å; Y301-V342 HydrophobicContact CG-CG2 4.28Å
302	V	89.4	Confident	83.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	116.2	-179.4	179.3	0	0	0	0	107.8	L256 F258 L274 V282 I285 L304	L256-V302 PolarHBondContact N-O 2.89Å; L256-V302 PolarHBondContact O-N 3.02Å; F258-V302 HydrophobicContact CD1-CG2 4.42Å; F258-V302 HydrophobicContact CD2-CB 4.05Å; F258-V302 HydrophobicContact CD2-CG2 3.55Å; F258-V302 HydrophobicContact CE1-CG2 4.47Å; F258-V302 HydrophobicContact CE2-CB 3.8Å; F258-V302 HydrophobicContact CE2-CG1 4.34Å; F258-V302 HydrophobicContact CE2-CG2 3.62Å; F258-V302 HydrophobicContact CG-CG2 4.01Å; F258-V302 HydrophobicContact CZ-CB 4.47Å; F258-V302 HydrophobicContact CZ-CG2 4.11Å; L274-V302 HydrophobicContact CD1-CG1 4.24Å; V282-V302 HydrophobicContact CG1-CG1 3.77Å; V282-V302 HydrophobicContact CG2-CG1 4.26Å; I285-V302 HydrophobicContact CD1-CG2 4.31Å; I285-V302 HydrophobicContact CG1-CG1 4.44Å; I285-V302 HydrophobicContact CG1-CG2 4.26Å; I285-V302 HydrophobicContact CG2-CG2 4.4Å; V302-L304 HydrophobicContact CG1-CD2 4.15Å; V302-L304 HydrophobicContact CG1-CG 4.49Å
303	Q	87.5	Confident	84.1	Confident	33 Å²	33	42.2 Å²	42.2	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.5	177.7	-168.4	-176.9	-39.9	0	0	110	F254 C283 Q284 L339	F254-Q303 HydrophobicContact CD2-CG 3.6Å; F254-Q303 HydrophobicContact CE2-CG 3.75Å; C283-Q303 HydrophobicContact CB-CB 4.31Å; C283-Q303 HydrophobicContact CB-CG 4.28Å; C283-Q303 PolarHBondContact N-O 2.99Å; Q284-Q303 HydrophobicContact CB-CB 4.48Å; Q284-Q303 PolarHBondContact O-N 2.87Å; Q303-L339 HydrophobicContact CB-CB 4.38Å; Q303-L339 HydrophobicContact CB-CD2 3.6Å
304	L	86.6	Confident	84.4	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	156.2	-178.4	-62.7	175.1	0	0	0	111.3	F254 L256 V280 V282 C283 V302 S306 A310 L313	F254-L304 PolarHBondContact O-N 3.17Å; F254-L304 VanDerWaalsContact O-N 3.09Å; L256-L304 HydrophobicContact CD1-CD1 3.79Å; L256-L304 HydrophobicContact CG-CD1 4.5Å; V280-L304 HydrophobicContact CG1-CD1 4.39Å; V280-L304 HydrophobicContact CG1-CD2 3.9Å; V282-L304 HydrophobicContact CB-CD2 4.28Å; V282-L304 HydrophobicContact CG2-CD2 3.83Å; C283-L304 PolarHBondContact SG-O 3.08Å; V302-L304 HydrophobicContact CG1-CD2 4.15Å; V302-L304 HydrophobicContact CG1-CG 4.49Å; L304-S306 VanDerWaalsContact C-N 3.33Å; L304-S306 PolarHBondContact O-N 3.07Å; L304-A310 HydrophobicContact CB-CB 4.49Å; L304-A310 HydrophobicContact CD1-CB 3.9Å; L304-L313 HydrophobicContact CD1-CB 4.33Å; L304-L313 HydrophobicContact CD1-CD1 4.28Å
305	N	82.2	Confident	84.8	Confident	105 Å²	105	41 Å²	41	56%	0.561	22%	0.223	S	C	*	.	S	Bend	trans	-65	-34.5	-174.7	-79.8	-38.7	0	0	0	113.2	D281 C283	D281-N305 VanDerWaalsContact CB-ND2 3.26Å; D281-N305 WeakPolarHBondContact CB-ND2 3.39Å; C283-N305 VanDerWaalsContact SG-CA 3.56Å; C283-N305 PolarHBondContact SG-N 2.89Å; C283-N305 PolarHBondContact SG-OD1 2.69Å
306	S	81.3	Confident	85	Confident	44 Å²	44	38.7 Å²	38.7	31%	0.308	21%	0.212	S	C	.	.			trans	-130.5	154.7	179.4	-175.2	0	0	0	0	113.2	L304 T308 D309 A310	L304-S306 VanDerWaalsContact C-N 3.33Å; L304-S306 PolarHBondContact O-N 3.07Å; S306-T308 VanDerWaalsContact C-N 3.31Å; S306-T308 WeakPolarHBondContact CB-OG1 3.47Å; S306-T308 PolarHBondContact OG-N 3.39Å; S306-T308 PolarHBondContact OG-OG1 3.45Å; S306-D309 WeakPolarHBondContact CB-OD2 3.31Å; S306-D309 PolarHBondContact O-N 3.23Å; S306-A310 PolarHBondContact O-N 3.2Å
307	V	82.4	Confident	85	Confident	59 Å²	59	38.7 Å²	38.7	36%	0.358	21%	0.211	S	C	.	.	H	α-helix	trans	-65.2	-34.5	171	174.6	0	0	0	0	111.5	I253 F254 D309 A311	I253-V307 HydrophobicContact CB-CG1 3.84Å; I253-V307 HydrophobicContact CB-CG2 4.01Å; I253-V307 HydrophobicContact CD1-CG1 4.41Å; I253-V307 HydrophobicContact CG2-CG1 3.55Å; F254-V307 HydrophobicContact CB-CG2 4.22Å; F254-V307 HydrophobicContact CD1-CG2 4.3Å; V307-D309 VanDerWaalsContact C-N 3.31Å; V307-D309 PolarHBondContact O-N 3.4Å; V307-A311 WeakPolarHBondContact O-CB 3.41Å; V307-A311 PolarHBondContact O-N 3.43Å
308	T	83.6	Confident	84.9	Confident	78 Å²	78	38.9 Å²	38.9	48%	0.479	22%	0.222	S	C	.	.	H	α-helix	trans	-58	-46.9	173.6	45	0	0	0	0	110.9	S306 A311 Q312	S306-T308 VanDerWaalsContact C-N 3.31Å; S306-T308 WeakPolarHBondContact CB-OG1 3.47Å; S306-T308 PolarHBondContact OG-N 3.39Å; S306-T308 PolarHBondContact OG-OG1 3.45Å; T308-A311 PolarHBondContact O-N 2.94Å; T308-Q312 WeakPolarHBondContact O-CB 3.37Å; T308-Q312 VanDerWaalsContact O-CG 3.32Å; T308-Q312 WeakPolarHBondContact O-CG 3.31Å; T308-Q312 PolarHBondContact O-N 3.31Å
309	D	86	Confident	84.5	Confident	43 Å²	43	42.6 Å²	42.6	23%	0.23	25%	0.252	C	S	.	.	H	α-helix	trans	-73.5	-34.9	-171.5	-42.4	-10	0	0	0	109.7	V280 S306 V307 L313	V280-D309 HydrophobicContact CG1-CB 3.9Å; S306-D309 WeakPolarHBondContact CB-OD2 3.31Å; S306-D309 PolarHBondContact O-N 3.23Å; V307-D309 VanDerWaalsContact C-N 3.31Å; V307-D309 PolarHBondContact O-N 3.4Å; D309-L313 WeakPolarHBondContact O-CB 3.46Å; D309-L313 PolarHBondContact O-N 2.92Å
310	A	85.5	Confident	83.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-41.8	170.8	0	0	0	0	0	113	L256 L304 S306 L314	L256-A310 HydrophobicContact CD1-CB 4.31Å; L256-A310 HydrophobicContact CD2-CB 4.36Å; L256-A310 HydrophobicContact CG-CB 4.19Å; L304-A310 HydrophobicContact CB-CB 4.49Å; L304-A310 HydrophobicContact CD1-CB 3.9Å; S306-A310 PolarHBondContact O-N 3.2Å; A310-L314 VanDerWaalsContact O-CB 3.3Å; A310-L314 WeakPolarHBondContact O-CB 3.43Å; A310-L314 PolarHBondContact O-N 3.46Å
311	A	84.1	Confident	83	Confident	32 Å²	32	50.2 Å²	50.2	26%	0.264	30%	0.3	S	S	.	.	H	α-helix	trans	-68.3	-42.4	176.3	0	0	0	0	0	112.2	V307 T308 T315 Y334	V307-A311 WeakPolarHBondContact O-CB 3.41Å; V307-A311 PolarHBondContact O-N 3.43Å; T308-A311 PolarHBondContact O-N 2.94Å; A311-T315 WeakPolarHBondContact O-CB 3.42Å; A311-T315 PolarHBondContact O-N 3.07Å; A311-T315 PolarHBondContact O-OG1 3.45Å; A311-Y334 WeakPolarHBondContact CA-OH 3.36Å
312	Q	83.7	Confident	82.6	Confident	119 Å²	119	56.3 Å²	56.3	56%	0.556	33%	0.326	S	S	*	.	H	α-helix	trans	-65.2	-47.6	175.6	-73.3	176.9	5.9	0	0	111.5	T308 T315 N316	T308-Q312 WeakPolarHBondContact O-CB 3.37Å; T308-Q312 VanDerWaalsContact O-CG 3.32Å; T308-Q312 WeakPolarHBondContact O-CG 3.31Å; T308-Q312 PolarHBondContact O-N 3.31Å; Q312-T315 PolarHBondContact O-N 3.31Å; Q312-T315 VanDerWaalsContact O-N 3.17Å; Q312-N316 WeakPolarHBondContact O-CB 3.35Å; Q312-N316 PolarHBondContact O-N 3.46Å; Q312-N316 PolarHBondContact O-ND2 3.06Å; Q312-N316 PolarHBondContact O-OD1 2.78Å
313	L	85.8	Confident	82.1	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-64	-43.6	179	-173.6	145.3	0	0	0	111.3	L256 F258 L274 C278 V280 L304 D309 T315 N316 L317	L256-L313 HydrophobicContact CD1-CD2 3.52Å; F258-L313 HydrophobicContact CE2-CD2 4.48Å; F258-L313 HydrophobicContact CZ-CD2 4.07Å; L274-L313 HydrophobicContact CD2-CD1 4.33Å; C278-L313 HydrophobicContact CB-CD1 4.03Å; V280-L313 HydrophobicContact CB-CD1 3.96Å; V280-L313 HydrophobicContact CG1-CD1 4.21Å; V280-L313 HydrophobicContact CG2-CD1 4Å; L304-L313 HydrophobicContact CD1-CB 4.33Å; L304-L313 HydrophobicContact CD1-CD1 4.28Å; D309-L313 WeakPolarHBondContact O-CB 3.46Å; D309-L313 PolarHBondContact O-N 2.92Å; L313-T315 VanDerWaalsContact C-N 3.31Å; L313-T315 PolarHBondContact O-N 3.2Å; L313-N316 PolarHBondContact O-N 3.47Å; L313-L317 HydrophobicContact CD2-CD1 3.47Å; L313-L317 VanDerWaalsContact CD2-CD1 3.47Å; L313-L317 HydrophobicContact CD2-CG 4.23Å; L313-L317 HydrophobicContact CG-CD1 3.95Å; L313-L317 HydrophobicContact CG-CG 4.3Å; L313-L317 VanDerWaalsContact O-CB 3.3Å; L313-L317 WeakPolarHBondContact O-CB 3.26Å; L313-L317 WeakPolarHBondContact O-CG 3.22Å; L313-L317 PolarHBondContact O-N 2.84Å
314	L	84.9	Confident	82	Confident	23 Å²	23	60.2 Å²	60.2	12%	0.12	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-41.6	172.8	179.7	67.5	0	0	0	111.9	L256 A310 T318 V332 Y334	L256-L314 HydrophobicContact CD2-CB 4.22Å; A310-L314 VanDerWaalsContact O-CB 3.3Å; A310-L314 WeakPolarHBondContact O-CB 3.43Å; A310-L314 PolarHBondContact O-N 3.46Å; L314-T318 HydrophobicContact CD1-CG2 3.93Å; L314-T318 HydrophobicContact CG-CG2 4.5Å; L314-T318 WeakPolarHBondContact O-CB 3.42Å; L314-T318 VanDerWaalsContact O-CG2 3.3Å; L314-T318 WeakPolarHBondContact O-CG2 3.38Å; L314-T318 PolarHBondContact O-N 3.46Å; L314-T318 PolarHBondContact O-OG1 2.96Å; L314-V332 HydrophobicContact CD1-CB 4Å; L314-V332 HydrophobicContact CD1-CG1 3.78Å; L314-Y334 HydrophobicContact CD2-CD2 3.53Å; L314-Y334 HydrophobicContact CD2-CE1 4.38Å; L314-Y334 HydrophobicContact CD2-CE2 3.15Å; L314-Y334 HydrophobicContact CD2-CG 4.28Å
315	T	83.3	Confident	81.8	Confident	79 Å²	79	60.4 Å²	60.4	49%	0.485	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-49.5	-180	-57.3	0	0	0	0	111	A311 Q312 L313 L317 T318 A319	A311-T315 WeakPolarHBondContact O-CB 3.42Å; A311-T315 PolarHBondContact O-N 3.07Å; A311-T315 PolarHBondContact O-OG1 3.45Å; Q312-T315 PolarHBondContact O-N 3.31Å; Q312-T315 VanDerWaalsContact O-N 3.17Å; L313-T315 VanDerWaalsContact C-N 3.31Å; L313-T315 PolarHBondContact O-N 3.2Å; T315-L317 VanDerWaalsContact C-N 3.34Å; T315-L317 PolarHBondContact O-N 2.71Å; T315-T318 PolarHBondContact O-N 2.85Å; T315-T318 PolarHBondContact O-OG1 3.19Å; T315-A319 VanDerWaalsContact O-CB 3.31Å; T315-A319 WeakPolarHBondContact O-CB 3.47Å; T315-A319 PolarHBondContact O-N 3.07Å
316	N	83.9	Confident	81.6	Confident	68 Å²	68	60.6 Å²	60.6	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-57.5	-46.8	177.2	-68	-13.4	0	0	0	111.1	Q312 L313 T318 V320 T321	Q312-N316 WeakPolarHBondContact O-CB 3.35Å; Q312-N316 PolarHBondContact O-N 3.46Å; Q312-N316 PolarHBondContact O-ND2 3.06Å; Q312-N316 PolarHBondContact O-OD1 2.78Å; L313-N316 PolarHBondContact O-N 3.47Å; N316-T318 VanDerWaalsContact C-N 3.31Å; N316-T318 PolarHBondContact O-N 2.92Å; N316-V320 WeakPolarHBondContact O-CA 3.27Å; N316-V320 WeakPolarHBondContact O-CB 3.36Å; N316-V320 PolarHBondContact O-N 2.94Å; N316-T321 PolarHBondContact O-N 3.41Å; N316-T321 PolarHBondContact O-OG1 2.77Å
317	L	83.1	Confident	81.4	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	37%	0.366	C	S	.	.	H	α-helix	trans	-76.6	-12.7	-177.1	-61.7	-173.7	0	0	0	114.9	F258 L313 T315 T321 L323 V332	F258-L317 HydrophobicContact CZ-CD1 4.32Å; L313-L317 HydrophobicContact CD2-CD1 3.47Å; L313-L317 VanDerWaalsContact CD2-CD1 3.47Å; L313-L317 HydrophobicContact CD2-CG 4.23Å; L313-L317 HydrophobicContact CG-CD1 3.95Å; L313-L317 HydrophobicContact CG-CG 4.3Å; L313-L317 VanDerWaalsContact O-CB 3.3Å; L313-L317 WeakPolarHBondContact O-CB 3.26Å; L313-L317 WeakPolarHBondContact O-CG 3.22Å; L313-L317 PolarHBondContact O-N 2.84Å; T315-L317 VanDerWaalsContact C-N 3.34Å; T315-L317 PolarHBondContact O-N 2.71Å; L317-T321 VanDerWaalsContact CA-O 3.3Å; L317-T321 WeakPolarHBondContact CA-O 3.43Å; L317-T321 WeakPolarHBondContact CD2-O 3.28Å; L317-L323 HydrophobicContact CD1-CD1 3.57Å; L317-L323 HydrophobicContact CD1-CD2 4.36Å; L317-L323 HydrophobicContact CD1-CG 3.79Å; L317-L323 HydrophobicContact CD2-CD1 4.34Å; L317-L323 HydrophobicContact CD2-CD2 3.57Å; L317-L323 HydrophobicContact CD2-CG 3.7Å; L317-L323 HydrophobicContact CG-CG 4.27Å; L317-V332 HydrophobicContact CB-CG2 4.37Å; L317-V332 HydrophobicContact CD1-CG2 3.92Å
318	T	79.4	Confident	81.3	Confident	95 Å²	95	63.2 Å²	63.2	58%	0.583	36%	0.364	S	S	*	.	H	α-helix	trans	-104.3	-23.3	175.7	55.7	0	0	0	0	114	L314 T315 N316	L314-T318 HydrophobicContact CD1-CG2 3.93Å; L314-T318 HydrophobicContact CG-CG2 4.5Å; L314-T318 WeakPolarHBondContact O-CB 3.42Å; L314-T318 VanDerWaalsContact O-CG2 3.3Å; L314-T318 WeakPolarHBondContact O-CG2 3.38Å; L314-T318 PolarHBondContact O-N 3.46Å; L314-T318 PolarHBondContact O-OG1 2.96Å; T315-T318 PolarHBondContact O-N 2.85Å; T315-T318 PolarHBondContact O-OG1 3.19Å; N316-T318 VanDerWaalsContact C-N 3.31Å; N316-T318 PolarHBondContact O-N 2.92Å
319	A	75.4	Confident	81.3	Confident	83 Å²	83	63.3 Å²	63.3	69%	0.686	36%	0.359	S	S	*	.	H	α-helix	trans	-112.4	-31.3	-177.6	0	0	0	0	0	114.7	T315	T315-A319 VanDerWaalsContact O-CB 3.31Å; T315-A319 WeakPolarHBondContact O-CB 3.47Å; T315-A319 PolarHBondContact O-N 3.07Å
320	V	72.6	Confident	81.3	Confident	112 Å²	112	61.8 Å²	61.8	68%	0.679	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-52.6	-168.7	-167.5	0	0	0	0	112.4	N316	N316-V320 WeakPolarHBondContact O-CA 3.27Å; N316-V320 WeakPolarHBondContact O-CB 3.36Å; N316-V320 PolarHBondContact O-N 2.94Å
321	T	73.8	Confident	81.2	Confident	60 Å²	60	63.1 Å²	63.1	37%	0.368	36%	0.359	S	S	.	.			trans	-128.6	108.5	-171.6	44.1	0	0	0	0	111.8	N316 L317 L323	N316-T321 PolarHBondContact O-N 3.41Å; N316-T321 PolarHBondContact O-OG1 2.77Å; L317-T321 VanDerWaalsContact CA-O 3.3Å; L317-T321 WeakPolarHBondContact CA-O 3.43Å; L317-T321 WeakPolarHBondContact CD2-O 3.28Å; T321-L323 PolarHBondContact O-N 3.08Å
322	K	79.3	Confident	81.3	Confident	133 Å²	133	62.1 Å²	62.1	58%	0.578	35%	0.349	S	S	*	.			trans	-68.7	123.4	170	-63.7	-165.6	-175.8	-170.6	0	110.3	I324 E329	K322-I324 PolarHBondContact O-N 3.39Å; K322-E329 VanDerWaalsContact CD-CD 3.48Å; K322-E329 HydrophobicContact CD-CG 4.29Å; K322-E329 VanDerWaalsContact CD-OE1 3.31Å; K322-E329 WeakPolarHBondContact CD-OE1 3.19Å; K322-E329 IonicContact NZ-OE1 2.68Å; K322-E329 PolarHBondContact NZ-OE1 3.32Å; K322-E329 IonicContact NZ-OE2 4Å; K322-E329 PolarHBondContact NZ-OE2 2.66Å
323	L	80.8	Confident	81.4	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.052	33%	0.326	C	S	.	.			trans	-71.1	127.1	165.4	-65.8	-166.9	0	0	0	110.1	F258 L274 S277 L317 T321 E329 V330	F258-L323 HydrophobicContact CD1-CD1 4.49Å; F258-L323 HydrophobicContact CE1-CD1 3.74Å; L274-L323 HydrophobicContact CD2-CD1 3.99Å; S277-L323 WeakPolarHBondContact OG-CD2 3.46Å; L317-L323 HydrophobicContact CD1-CD1 3.57Å; L317-L323 HydrophobicContact CD1-CD2 4.36Å; L317-L323 HydrophobicContact CD1-CG 3.79Å; L317-L323 HydrophobicContact CD2-CD1 4.34Å; L317-L323 HydrophobicContact CD2-CD2 3.57Å; L317-L323 HydrophobicContact CD2-CG 3.7Å; L317-L323 HydrophobicContact CG-CG 4.27Å; T321-L323 PolarHBondContact O-N 3.08Å; L323-E329 WeakPolarHBondContact O-CA 3.28Å; L323-V330 HydrophobicContact CB-CB 4.07Å; L323-V330 HydrophobicContact CB-CG2 4.3Å; L323-V330 PolarHBondContact O-N 3.38Å
324	I	83.4	Confident	81.3	Confident	105 Å²	105	58.2 Å²	58.2	54%	0.538	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.7	171.1	-56.2	178.6	0	0	0	107.6	K322 R328 E329	K322-I324 PolarHBondContact O-N 3.39Å; I324-R328 WeakPolarHBondContact CA-O 3.25Å; I324-E329 HydrophobicContact CG1-CG 4.49Å
325	I	82.6	Confident	81.2	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.5	176.3	-56.1	-177.5	0	0	0	108.3	L261 P262 I265 T273 G327 R328 V330	L261-I325 HydrophobicContact CD2-CD1 4.21Å; P262-I325 HydrophobicContact CG-CG2 4.4Å; I265-I325 HydrophobicContact CD1-CD1 4.33Å; I265-I325 HydrophobicContact CD1-CG2 3.85Å; T273-I325 HydrophobicContact CG2-CG1 4.29Å; T273-I325 WeakPolarHBondContact OG1-CD1 3.5Å; I325-G327 PolarHBondContact O-N 3Å; I325-G327 VanDerWaalsContact O-N 3.12Å; I325-R328 PolarHBondContact N-O 3.33Å; I325-R328 PolarHBondContact O-N 3.47Å; I325-V330 HydrophobicContact CB-CG2 4.07Å; I325-V330 HydrophobicContact CD1-CG2 3.9Å; I325-V330 HydrophobicContact CG1-CG2 3.78Å
326	E	78.9	Confident	80.9	Confident	110 Å²	110	59.2 Å²	59.2	51%	0.514	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	39.6	-176.9	-57.2	178.6	165.8	0	0	112.9	P262 K269	P262-E326 VanDerWaalsContact CB-OE2 3.28Å; P262-E326 WeakPolarHBondContact CB-OE2 3.42Å; P262-E326 HydrophobicContact CG-CB 4.11Å; P262-E326 HydrophobicContact CG-CG 4.29Å; P262-E326 WeakPolarHBondContact CG-OE2 3.47Å; K269-E326 WeakPolarHBondContact CD-OE1 3.43Å; K269-E326 WeakPolarHBondContact CE-OE1 3.39Å; K269-E326 IonicContact NZ-OE1 2.73Å; K269-E326 PolarHBondContact NZ-OE1 3.37Å
327	G	77.2	Confident	80.5	Confident	70 Å²	70	57 Å²	57	72%	0.722	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	1.7	179.5	0	0	0	0	0	116.1	I325	I325-G327 PolarHBondContact O-N 3Å; I325-G327 VanDerWaalsContact O-N 3.12Å
328	R	80.9	Confident	80.1	Confident	88 Å²	88	56.9 Å²	56.9	33%	0.332	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.4	177	-58.3	-174.9	-175.9	-163.6	-2.8	111.5	N260 L261 I324 I325 V330	N260-R328 WeakPolarHBondContact O-CD 3.41Å; L261-R328 PolarHBondContact O-NH1 3.26Å; I324-R328 WeakPolarHBondContact CA-O 3.25Å; I325-R328 PolarHBondContact N-O 3.33Å; I325-R328 PolarHBondContact O-N 3.47Å; R328-V330 PolarHBondContact O-N 2.94Å
329	E	82.6	Confident	80.1	Confident	79 Å²	79	52.4 Å²	52.4	37%	0.369	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	117.9	167.9	-64.1	-168.7	172.3	0	0	109.7	N260 K322 L323 I324	N260-E329 PolarHBondContact ND2-O 3.19Å; K322-E329 VanDerWaalsContact CD-CD 3.48Å; K322-E329 HydrophobicContact CD-CG 4.29Å; K322-E329 VanDerWaalsContact CD-OE1 3.31Å; K322-E329 WeakPolarHBondContact CD-OE1 3.19Å; K322-E329 IonicContact NZ-OE1 2.68Å; K322-E329 PolarHBondContact NZ-OE1 3.32Å; K322-E329 IonicContact NZ-OE2 4Å; K322-E329 PolarHBondContact NZ-OE2 2.66Å; L323-E329 WeakPolarHBondContact O-CA 3.28Å; I324-E329 HydrophobicContact CG1-CG 4.49Å
330	V	86.3	Confident	80	Confident	12 Å²	12	51.7 Å²	51.7	7%	0.073	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-84.2	128.3	-178.7	-176.2	0	0	0	0	109.9	F258 R259 L261 L323 I325 R328 V332	F258-V330 HydrophobicContact CB-CG1 4.08Å; F258-V330 HydrophobicContact CD1-CG1 3.84Å; F258-V330 HydrophobicContact CG-CG1 4.32Å; R259-V330 WeakPolarHBondContact O-CG1 3.15Å; L261-V330 HydrophobicContact CD2-CB 4.39Å; L261-V330 HydrophobicContact CD2-CG1 3.66Å; L261-V330 HydrophobicContact CD2-CG2 3.78Å; L323-V330 HydrophobicContact CB-CB 4.07Å; L323-V330 HydrophobicContact CB-CG2 4.3Å; L323-V330 PolarHBondContact O-N 3.38Å; I325-V330 HydrophobicContact CB-CG2 4.07Å; I325-V330 HydrophobicContact CD1-CG2 3.9Å; I325-V330 HydrophobicContact CG1-CG2 3.78Å; R328-V330 PolarHBondContact O-N 2.94Å; V330-V332 HydrophobicContact CG1-CG2 4.49Å
331	L	83.3	Confident	80.2	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.141	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	106.4	179.7	-63.5	178.1	0	0	0	110	K193 R259	K193-L331 HydrophobicContact CG-CD2 4.4Å; R259-L331 HydrophobicContact CB-CB 4.29Å; R259-L331 PolarHBondContact N-O 3.35Å; R259-L331 PolarHBondContact O-N 2.63Å
332	V	86.9	Confident	80.5	Confident	12 Å²	12	46.6 Å²	46.6	7%	0.073	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	142.9	177.5	-168.4	0	0	0	0	110.4	L256 L257 F258 L314 L317 V330	L256-V332 HydrophobicContact CB-CG1 4.32Å; L256-V332 HydrophobicContact CD1-CG1 4.22Å; L257-V332 CarbonylContact O-C 3.56Å; L257-V332 WeakPolarHBondContact O-CA 3.15Å; F258-V332 HydrophobicContact CD1-CG2 4.1Å; F258-V332 HydrophobicContact CD2-CG1 3.94Å; F258-V332 HydrophobicContact CD2-CG2 4.26Å; F258-V332 HydrophobicContact CE1-CG2 3.97Å; F258-V332 HydrophobicContact CE2-CG1 3.63Å; F258-V332 HydrophobicContact CE2-CG2 4.13Å; F258-V332 HydrophobicContact CG-CG2 4.22Å; F258-V332 HydrophobicContact CZ-CG1 4.14Å; F258-V332 HydrophobicContact CZ-CG2 3.97Å; L314-V332 HydrophobicContact CD1-CB 4Å; L314-V332 HydrophobicContact CD1-CG1 3.78Å; L317-V332 HydrophobicContact CB-CG2 4.37Å; L317-V332 HydrophobicContact CD1-CG2 3.92Å; V330-V332 HydrophobicContact CG1-CG2 4.49Å
333	S	84.7	Confident	80.5	Confident	9 Å²	9	42.6 Å²	42.6	6%	0.063	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	168.9	179.1	-54.5	0	0	0	0	109.3	L256 L257 R259	L256-S333 WeakPolarHBondContact CA-O 3.36Å; L257-S333 PolarHBondContact N-O 3.33Å; L257-S333 PolarHBondContact O-N 3.02Å; R259-S333 PolarHBondContact NH2-OG 3.3Å
334	Y	84.1	Confident	80.1	Confident	31 Å²	31	44.5 Å²	44.5	12%	0.122	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	151.7	167.4	-71.8	-75.7	0	0	0	110.7	G227 P230 I253 L256 A311 L314	G227-Y334 PolarHBondContact N-O 2.74Å; P230-Y334 VanDerWaalsContact CD-CE2 3.5Å; P230-Y334 HydrophobicContact CG-CE2 3.87Å; I253-Y334 HydrophobicContact CG2-CE1 4.14Å; I253-Y334 WeakPolarHBondContact O-CE1 3.47Å; L256-Y334 HydrophobicContact CD2-CD1 3.71Å; L256-Y334 HydrophobicContact CD2-CE1 3.92Å; L256-Y334 HydrophobicContact CD2-CG 4.35Å; A311-Y334 WeakPolarHBondContact CA-OH 3.36Å; L314-Y334 HydrophobicContact CD2-CD2 3.53Å; L314-Y334 HydrophobicContact CD2-CE1 4.38Å; L314-Y334 HydrophobicContact CD2-CE2 3.15Å; L314-Y334 HydrophobicContact CD2-CG 4.28Å
335	S	82.7	Confident	79.7	Confident	4 Å²	4	46 Å²	46	3%	0.028	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	141.1	170.3	-174.1	0	0	0	0	111.6	S255 Y301 I337	S255-S335 WeakPolarHBondContact O-CB 3.26Å; S255-S335 PolarHBondContact O-N 3.32Å; Y301-S335 WeakPolarHBondContact CD1-OG 3.4Å; Y301-S335 VanDerWaalsContact CE1-OG 3.29Å; Y301-S335 WeakPolarHBondContact CE1-OG 3.43Å; S335-I337 VanDerWaalsContact C-N 3.31Å; S335-I337 WeakPolarHBondContact CB-O 3.22Å; S335-I337 PolarHBondContact OG-N 3.33Å; S335-I337 PolarHBondContact OG-O 3.06Å
336	K	77.3	Confident	79.3	Confident	119 Å²	119	46.6 Å²	46.6	52%	0.517	25%	0.251	S	S	.	.	S	Bend	trans	-74.6	-22.2	171	-174.4	176	175.6	-177.8	0	112.9	S224 E225 Y252	S224-K336 WeakPolarHBondContact O-CD 3.31Å; E225-K336 WeakPolarHBondContact O-CB 3.49Å; E225-K336 PolarHBondContact O-N 3.38Å; Y252-K336 WeakPolarHBondContact CD1-O 3.48Å; Y252-K336 WeakPolarHBondContact CE1-O 3.3Å
337	I	74.5	Confident	78.9	Confident	21 Å²	21	43.9 Å²	43.9	11%	0.108	25%	0.247	C	C	.	.	S	Bend	trans	-131.2	129.3	-171.6	-67.7	137.3	0	0	0	108.1	E225 S335 T341 V342 R345	E225-I337 WeakPolarHBondContact OE2-CD1 3.45Å; S335-I337 VanDerWaalsContact C-N 3.31Å; S335-I337 WeakPolarHBondContact CB-O 3.22Å; S335-I337 PolarHBondContact OG-N 3.33Å; S335-I337 PolarHBondContact OG-O 3.06Å; I337-T341 HydrophobicContact CG2-CG2 3.69Å; I337-V342 HydrophobicContact CB-CG2 4.36Å; I337-V342 HydrophobicContact CG2-CG2 3.8Å; I337-R345 VanDerWaalsContact CD1-NH1 3.33Å
338	P	75.4	Confident	78.3	Confident	9 Å²	9	45 Å²	45	6%	0.058	24%	0.236	C	C	.	.			trans	-65.8	145.5	-180	29.3	-35.8	0	0	0	110.3	T340 T341 V342	P338-T340 PolarHBondContact O-N 2.96Å; P338-T340 VanDerWaalsContact O-N 3.08Å; P338-T341 PolarHBondContact O-N 3.23Å; P338-V342 PolarHBondContact O-N 3.44Å
339	L	79.7	Confident	77.4	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-53	-38.3	-172.9	173.8	58.3	0	0	0	113	S255 Q284 F286 Q303 T341 V342 I343	S255-L339 PolarHBondContact OG-N 3.26Å; Q284-L339 HydrophobicContact CB-CD2 3.83Å; Q284-L339 HydrophobicContact CG-CD2 3.84Å; F286-L339 HydrophobicContact CB-CD1 3.38Å; F286-L339 HydrophobicContact CG-CD1 4.14Å; Q303-L339 HydrophobicContact CB-CB 4.38Å; Q303-L339 HydrophobicContact CB-CD2 3.6Å; L339-T341 VanDerWaalsContact C-N 3.28Å; L339-T341 PolarHBondContact O-N 3.07Å; L339-V342 HydrophobicContact CD1-CB 4.42Å; L339-V342 WeakPolarHBondContact O-CB 3.46Å; L339-V342 PolarHBondContact O-N 3.5Å; L339-I343 HydrophobicContact CD1-CD1 3.87Å; L339-I343 HydrophobicContact CD1-CG1 3.89Å; L339-I343 HydrophobicContact CD2-CD1 4.25Å; L339-I343 HydrophobicContact CG-CD1 3.72Å; L339-I343 HydrophobicContact CG-CG1 4.25Å; L339-I343 WeakPolarHBondContact O-CG1 3.3Å; L339-I343 PolarHBondContact O-N 2.79Å
340	T	74	Confident	76.1	Confident	69 Å²	69	46.4 Å²	46.4	42%	0.423	25%	0.253	S	S	.	.	H	α-helix	trans	-55.3	-39.1	176.1	54.6	0	0	0	0	113.3	P338 A344	P338-T340 PolarHBondContact O-N 2.96Å; P338-T340 VanDerWaalsContact O-N 3.08Å; T340-A344 WeakPolarHBondContact O-CB 3.48Å; T340-A344 PolarHBondContact O-N 2.67Å
341	T	76.4	Confident	74.1	Confident	50 Å²	50	51.1 Å²	51.1	31%	0.307	28%	0.278	S	S	.	.	H	α-helix	trans	-75.5	-31.3	176.1	-61.1	0	0	0	0	112.2	I337 P338 L339 R345	I337-T341 HydrophobicContact CG2-CG2 3.69Å; P338-T341 PolarHBondContact O-N 3.23Å; L339-T341 VanDerWaalsContact C-N 3.28Å; L339-T341 PolarHBondContact O-N 3.07Å; T341-R345 WeakPolarHBondContact O-CB 3.41Å; T341-R345 VanDerWaalsContact O-CG 3.28Å; T341-R345 WeakPolarHBondContact O-CG 3.35Å; T341-R345 PolarHBondContact O-N 2.82Å
342	V	79.5	Confident	71.9	Confident	14 Å²	14	54.4 Å²	54.4	9%	0.085	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-49	172.3	-174.9	0	0	0	0	110.2	F286 Y301 I337 P338 L339 A344 R345 A346	F286-V342 HydrophobicContact CD1-CG1 3.7Å; F286-V342 HydrophobicContact CE1-CG1 3.72Å; Y301-V342 HydrophobicContact CD1-CG2 4.04Å; Y301-V342 HydrophobicContact CD2-CG1 3.83Å; Y301-V342 HydrophobicContact CD2-CG2 4.26Å; Y301-V342 HydrophobicContact CE1-CG2 3.71Å; Y301-V342 HydrophobicContact CE2-CB 4.32Å; Y301-V342 HydrophobicContact CE2-CG1 3.46Å; Y301-V342 VanDerWaalsContact CE2-CG1 3.46Å; Y301-V342 HydrophobicContact CE2-CG2 3.96Å; Y301-V342 HydrophobicContact CG-CG2 4.28Å; I337-V342 HydrophobicContact CB-CG2 4.36Å; I337-V342 HydrophobicContact CG2-CG2 3.8Å; P338-V342 PolarHBondContact O-N 3.44Å; L339-V342 HydrophobicContact CD1-CB 4.42Å; L339-V342 WeakPolarHBondContact O-CB 3.46Å; L339-V342 PolarHBondContact O-N 3.5Å; V342-A344 PolarHBondContact O-N 3.19Å; V342-R345 PolarHBondContact O-N 3.07Å; V342-A346 WeakPolarHBondContact O-CB 3.24Å; V342-A346 PolarHBondContact O-N 2.92Å
343	I	80.1	Confident	69.5	Low	50 Å²	50	59.2 Å²	59.2	26%	0.256	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-44.8	178.1	-65.5	166.1	0	0	0	110.5	F286 L339 R345 A346 A347	F286-I343 HydrophobicContact CD2-CG1 3.94Å; F286-I343 HydrophobicContact CE2-CG1 4.41Å; F286-I343 HydrophobicContact CG-CG1 4.3Å; L339-I343 HydrophobicContact CD1-CD1 3.87Å; L339-I343 HydrophobicContact CD1-CG1 3.89Å; L339-I343 HydrophobicContact CD2-CD1 4.25Å; L339-I343 HydrophobicContact CG-CD1 3.72Å; L339-I343 HydrophobicContact CG-CG1 4.25Å; L339-I343 WeakPolarHBondContact O-CG1 3.3Å; L339-I343 PolarHBondContact O-N 2.79Å; I343-R345 PolarHBondContact O-N 3.33Å; I343-A346 PolarHBondContact O-N 2.88Å; I343-A347 WeakPolarHBondContact O-CB 3.38Å; I343-A347 PolarHBondContact O-N 3.14Å
344	A	71.8	Confident	67.5	Low	49 Å²	49	64.4 Å²	64.4	41%	0.405	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-43.9	176.5	0	0	0	0	0	112.4	T340 V342 A347 L348	T340-A344 WeakPolarHBondContact O-CB 3.48Å; T340-A344 PolarHBondContact O-N 2.67Å; V342-A344 PolarHBondContact O-N 3.19Å; A344-A347 PolarHBondContact O-N 2.82Å; A344-L348 WeakPolarHBondContact O-CB 3.29Å; A344-L348 WeakPolarHBondContact O-CD1 2.9Å; A344-L348 VanDerWaalsContact O-CG 3.27Å; A344-L348 WeakPolarHBondContact O-CG 3.04Å; A344-L348 PolarHBondContact O-N 2.85Å
345	R	73.9	Confident	65.5	Low	137 Å²	137	67.4 Å²	67.4	52%	0.517	38%	0.376	S	S	.	.	H	α-helix	trans	-65.2	-39.2	175.4	-73.2	171.6	-178.4	170.6	2.7	112.5	I337 T341 V342 I343 S349	I337-R345 VanDerWaalsContact CD1-NH1 3.33Å; T341-R345 WeakPolarHBondContact O-CB 3.41Å; T341-R345 VanDerWaalsContact O-CG 3.28Å; T341-R345 WeakPolarHBondContact O-CG 3.35Å; T341-R345 PolarHBondContact O-N 2.82Å; V342-R345 PolarHBondContact O-N 3.07Å; I343-R345 PolarHBondContact O-N 3.33Å; R345-S349 WeakPolarHBondContact O-CB 2.94Å; R345-S349 PolarHBondContact O-N 3.49Å; R345-S349 PolarHBondContact O-OG 3.01Å
346	A	74.7	Confident	64	Low	18 Å²	18	68.8 Å²	68.8	15%	0.149	39%	0.387	C	S	.	.	H	α-helix	trans	-65.1	-45.7	176	0	0	0	0	0	111.6	F286 V342 I343 L348 S349 Q350	F286-A346 HydrophobicContact CE1-CB 4.25Å; F286-A346 HydrophobicContact CE2-CB 4.15Å; F286-A346 HydrophobicContact CZ-CB 3.45Å; F286-A346 VanDerWaalsContact CZ-CB 3.45Å; V342-A346 WeakPolarHBondContact O-CB 3.24Å; V342-A346 PolarHBondContact O-N 2.92Å; I343-A346 PolarHBondContact O-N 2.88Å; A346-L348 PolarHBondContact O-N 2.85Å; A346-S349 WeakPolarHBondContact CA-OG 3.13Å; A346-S349 PolarHBondContact O-N 2.98Å; A346-S349 VanDerWaalsContact O-N 3.12Å; A346-S349 PolarHBondContact O-OG 2.99Å; A346-Q350 PolarHBondContact O-N 3.33Å
347	A	70.7	Confident	63.3	Low	52 Å²	52	68.4 Å²	68.4	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-45.1	175.6	0	0	0	0	0	112.2	I343 A344 S349 Q350 N351	I343-A347 WeakPolarHBondContact O-CB 3.38Å; I343-A347 PolarHBondContact O-N 3.14Å; A344-A347 PolarHBondContact O-N 2.82Å; A347-S349 VanDerWaalsContact C-N 3.31Å; A347-S349 PolarHBondContact O-N 3.38Å; A347-Q350 PolarHBondContact O-N 3.26Å; A347-Q350 VanDerWaalsContact O-N 3.14Å; A347-N351 PolarHBondContact O-N 3.14Å; A347-N351 VanDerWaalsContact O-N 3.07Å
348	L	64.2	Low	63.4	Low	94 Å²	94	73.2 Å²	73.2	49%	0.492	40%	0.403	S	S	.	.	H	α-helix	trans	-60.1	-36.5	173	-75.3	165.3	0	0	0	112.7	A344 A346 Q350 I354	A344-L348 WeakPolarHBondContact O-CB 3.29Å; A344-L348 WeakPolarHBondContact O-CD1 2.9Å; A344-L348 VanDerWaalsContact O-CG 3.27Å; A344-L348 WeakPolarHBondContact O-CG 3.04Å; A344-L348 PolarHBondContact O-N 2.85Å; A346-L348 PolarHBondContact O-N 2.85Å; L348-Q350 VanDerWaalsContact C-N 3.26Å; L348-Q350 PolarHBondContact O-N 2.67Å; L348-I354 HydrophobicContact CB-CD1 3.99Å
349	S	62.7	Low	63.3	Low	63 Å²	63	77.7 Å²	77.7	44%	0.441	42%	0.42	S	S	.	.	H	α-helix	trans	-73.6	-13.3	176.6	70.3	0	0	0	0	114.6	R345 A346 A347	R345-S349 WeakPolarHBondContact O-CB 2.94Å; R345-S349 PolarHBondContact O-N 3.49Å; R345-S349 PolarHBondContact O-OG 3.01Å; A346-S349 WeakPolarHBondContact CA-OG 3.13Å; A346-S349 PolarHBondContact O-N 2.98Å; A346-S349 VanDerWaalsContact O-N 3.12Å; A346-S349 PolarHBondContact O-OG 2.99Å; A347-S349 VanDerWaalsContact C-N 3.31Å; A347-S349 PolarHBondContact O-N 3.38Å
350	Q	55.2	Low	63.3	Low	134 Å²	134	83.6 Å²	83.6	63%	0.626	44%	0.443	S	S	*	.	H	α-helix	trans	-109.4	-14.6	-177.7	-71.9	-178.3	-14	0	0	113.6	A346 A347 L348	A346-Q350 PolarHBondContact O-N 3.33Å; A347-Q350 PolarHBondContact O-N 3.26Å; A347-Q350 VanDerWaalsContact O-N 3.14Å; L348-Q350 VanDerWaalsContact C-N 3.26Å; L348-Q350 PolarHBondContact O-N 2.67Å
351	N	44.2	Very low	63.5	Low	110 Å²	110	83 Å²	83	59%	0.588	44%	0.437	S	S	*	.	S	Bend	trans	-144.4	130.9	179.4	-70.3	-88.2	0	0	0	112	A347	A347-N351 PolarHBondContact O-N 3.14Å; A347-N351 VanDerWaalsContact O-N 3.07Å
352	V	38	Very low	63.4	Low	96 Å²	96	85.2 Å²	85.2	58%	0.582	45%	0.452	S	S	*	.	S	Bend	trans	74.5	134.6	173.8	-169.6	0	0	0	0	115.5	I354	V352-I354 PolarHBondContact O-N 3.03Å
353	D	35.5	Very low	63.4	Low	114 Å²	114	92.4 Å²	92.4	61%	0.61	49%	0.489	S	S	*	.			trans	-65.7	113.5	173.1	-171.8	-34	0	0	0	110.7	S355 A356	D353-S355 PolarHBondContact O-N 2.98Å; D353-S355 VanDerWaalsContact O-N 3.08Å; D353-S355 WeakPolarHBondContact OD1-CB 3.05Å; D353-S355 PolarHBondContact OD1-N 3.04Å; D353-S355 PolarHBondContact OD1-OG 3.23Å; D353-A356 PolarHBondContact O-N 2.67Å; D353-A356 VanDerWaalsContact O-N 3.13Å
354	I	42.2	Very low	63.2	Low	117 Å²	117	92.4 Å²	92.4	60%	0.6	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	0.2	-173.8	-48	176.9	0	0	0	112.1	L348 V352 A356	L348-I354 HydrophobicContact CB-CD1 3.99Å; V352-I354 PolarHBondContact O-N 3.03Å; I354-A356 PolarHBondContact O-N 3.29Å
355	S	42.6	Very low	63.6	Low	95 Å²	95	97.2 Å²	97.2	66%	0.664	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.8	165	64.2	0	0	0	0	112.9	D353 K357	D353-S355 PolarHBondContact O-N 2.98Å; D353-S355 VanDerWaalsContact O-N 3.08Å; D353-S355 WeakPolarHBondContact OD1-CB 3.05Å; D353-S355 PolarHBondContact OD1-N 3.04Å; D353-S355 PolarHBondContact OD1-OG 3.23Å; S355-K357 PolarHBondContact O-N 3.2Å
356	A	50.8	Low	63.8	Low	32 Å²	32	95.5 Å²	95.5	26%	0.264	51%	0.506	S	S	.	.	S	Bend	trans	-74.1	89.4	175.8	0	0	0	0	0	111.7	D353 I354 Y358	D353-A356 PolarHBondContact O-N 2.67Å; D353-A356 VanDerWaalsContact O-N 3.13Å; I354-A356 PolarHBondContact O-N 3.29Å; A356-Y358 PolarHBondContact O-N 2.77Å
357	K	64.2	Low	64.1	Low	112 Å²	112	100.1 Å²	100.1	49%	0.487	52%	0.523	S	S	.	.			trans	-65	118.5	172.4	-70.9	-171.8	176.6	-172.9	0	110.5	S355 Y359	S355-K357 PolarHBondContact O-N 3.2Å; K357-Y359 HydrophobicContact CB-CD2 4.49Å; K357-Y359 HydrophobicContact CB-CE2 3.7Å; K357-Y359 WeakPolarHBondContact O-CD2 3.44Å; K357-Y359 WeakPolarHBondContact O-CE2 2.99Å
358	Y	76.4	Confident	64.8	Low	122 Å²	122	98.3 Å²	98.3	48%	0.478	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	135.2	167.6	-63.8	-74.1	0	0	0	110.8	A356 V368 Y369 A380	A356-Y358 PolarHBondContact O-N 2.77Å; Y358-V368 CarbonylContact C-O 3.55Å; Y358-V368 WeakPolarHBondContact CA-O 3.22Å; Y358-Y369 HydrophobicContact CE1-CD1 4.13Å; Y358-Y369 HydrophobicContact CE1-CG 4.28Å; Y358-A380 HydrophobicContact CD1-CB 3.67Å; Y358-A380 HydrophobicContact CE1-CB 3.58Å
359	Y	73.3	Confident	65.7	Low	103 Å²	103	96.9 Å²	96.9	40%	0.404	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.2	177.6	-58.7	-101.9	0	0	0	108.2	K357 F367 V368 W370 Y377	K357-Y359 HydrophobicContact CB-CD2 4.49Å; K357-Y359 HydrophobicContact CB-CE2 3.7Å; K357-Y359 WeakPolarHBondContact O-CD2 3.44Å; K357-Y359 WeakPolarHBondContact O-CE2 2.99Å; Y359-F367 CarbonylContact O-C 3.45Å; Y359-F367 WeakPolarHBondContact O-CA 3.49Å; Y359-V368 PolarHBondContact N-O 3.09Å; Y359-V368 WeakPolarHBondContact O-CG2 2.74Å; Y359-V368 PolarHBondContact O-N 3.43Å; Y359-W370 HydrophobicContact CE2-CB 4.33Å; Y359-Y377 HydrophobicContact CD2-CD1 4.34Å; Y359-Y377 AromaticContact CD2-CE1 3.71Å; Y359-Y377 HydrophobicContact CD2-CE1 3.71Å; Y359-Y377 AromaticContact CE2-CE1 3.99Å; Y359-Y377 HydrophobicContact CE2-CE1 3.99Å; Y359-Y377 HydrophobicContact CG-CE1 4.06Å
360	Y	79.4	Confident	66.6	Low	124 Å²	124	98.8 Å²	98.8	49%	0.486	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.1	174.9	180	-100.6	0	0	0	110.3	P362 F367	Y360-P362 HydrophobicContact CE1-CB 4.23Å; Y360-P362 WeakPolarHBondContact O-CD 3.13Å; Y360-F367 HydrophobicContact CD2-CD1 4.33Å; Y360-F367 HydrophobicContact CD2-CD2 4.32Å; Y360-F367 HydrophobicContact CD2-CE1 4.12Å; Y360-F367 HydrophobicContact CD2-CE2 4.1Å; Y360-F367 HydrophobicContact CD2-CG 4.43Å; Y360-F367 AromaticContact CD2-CZ 4Å; Y360-F367 HydrophobicContact CD2-CZ 4Å
361	N	77.6	Confident	67.8	Low	58 Å²	58	94.3 Å²	94.3	31%	0.31	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.2	175	-178.7	-16.9	0	0	0	109.8	L363 S364 Q365 Q366	N361-L363 VanDerWaalsContact C-N 3.26Å; N361-L363 PolarHBondContact O-N 2.79Å; N361-L363 WeakPolarHBondContact OD1-CB 3.41Å; N361-L363 PolarHBondContact OD1-N 3.23Å; N361-S364 WeakPolarHBondContact CB-OG 2.86Å; N361-S364 PolarHBondContact ND2-OG 2.83Å; N361-S364 PolarHBondContact OD1-N 2.93Å; N361-Q365 WeakPolarHBondContact O-CA 3.31Å; N361-Q365 PolarHBondContact O-N 3.03Å; N361-Q366 PolarHBondContact N-O 2.9Å
362	P	75.2	Confident	69.3	Low	95 Å²	95	93.3 Å²	93.3	62%	0.617	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-16.7	-177	30.2	-36	0	0	0	113.9	Y360	Y360-P362 HydrophobicContact CE1-CB 4.23Å; Y360-P362 WeakPolarHBondContact O-CD 3.13Å
363	L	78.4	Confident	71.2	Confident	165 Å²	165	93.3 Å²	93.3	86%	0.864	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-40.5	178.2	-61.6	175.9	0	0	0	112	N361	N361-L363 VanDerWaalsContact C-N 3.26Å; N361-L363 PolarHBondContact O-N 2.79Å; N361-L363 WeakPolarHBondContact OD1-CB 3.41Å; N361-L363 PolarHBondContact OD1-N 3.23Å
364	S	76.2	Confident	73.4	Confident	50 Å²	50	96.1 Å²	96.1	35%	0.35	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-11.2	176.5	62.8	0	0	0	0	114	N361 Q366	N361-S364 WeakPolarHBondContact CB-OG 2.86Å; N361-S364 PolarHBondContact ND2-OG 2.83Å; N361-S364 PolarHBondContact OD1-N 2.93Å; S364-Q366 PolarHBondContact O-N 2.83Å
365	Q	79.6	Confident	75.1	Confident	150 Å²	150	98 Å²	98	70%	0.701	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	30.4	-172.5	-55	-175.6	16.5	0	0	113.4	N361	N361-Q365 WeakPolarHBondContact O-CA 3.31Å; N361-Q365 PolarHBondContact O-N 3.03Å
366	Q	79.8	Confident	77.1	Confident	102 Å²	102	96.4 Å²	96.4	48%	0.477	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.8	-178.9	-69.7	169.9	6.4	0	0	110.5	N361 S364	N361-Q366 PolarHBondContact N-O 2.9Å; S364-Q366 PolarHBondContact O-N 2.83Å
367	F	79.3	Confident	78.6	Confident	115 Å²	115	100.4 Å²	100.4	50%	0.504	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	139.2	162	-69.4	-86.4	0	0	0	109.1	Y359 Y360 A380	Y359-F367 CarbonylContact O-C 3.45Å; Y359-F367 WeakPolarHBondContact O-CA 3.49Å; Y360-F367 HydrophobicContact CD2-CD1 4.33Å; Y360-F367 HydrophobicContact CD2-CD2 4.32Å; Y360-F367 HydrophobicContact CD2-CE1 4.12Å; Y360-F367 HydrophobicContact CD2-CE2 4.1Å; Y360-F367 HydrophobicContact CD2-CG 4.43Å; Y360-F367 AromaticContact CD2-CZ 4Å; Y360-F367 HydrophobicContact CD2-CZ 4Å; F367-A380 HydrophobicContact CB-CB 3.89Å; F367-A380 WeakPolarHBondContact O-CB 3.42Å; F367-A380 PolarHBondContact O-N 2.81Å
368	V	85.2	Confident	79.5	Confident	13 Å²	13	97.5 Å²	97.5	8%	0.079	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	155.1	172.5	-63.2	0	0	0	0	108.8	Y358 Y359 Y377 L378	Y358-V368 CarbonylContact C-O 3.55Å; Y358-V368 WeakPolarHBondContact CA-O 3.22Å; Y359-V368 PolarHBondContact N-O 3.09Å; Y359-V368 WeakPolarHBondContact O-CG2 2.74Å; Y359-V368 PolarHBondContact O-N 3.43Å; V368-Y377 HydrophobicContact CB-CD1 4.46Å; V368-Y377 HydrophobicContact CG2-CD1 3.76Å; V368-Y377 HydrophobicContact CG2-CG 4.15Å; V368-L378 CarbonylContact C-O 3.56Å; V368-L378 WeakPolarHBondContact CA-O 3.46Å; V368-L378 WeakPolarHBondContact CB-O 3.39Å
369	Y	84.2	Confident	79.8	Confident	65 Å²	65	95.2 Å²	95.2	26%	0.255	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	152.3	167.7	65.4	-77.3	0	0	0	109.6	Y358 E371 Y377 L378	Y358-Y369 HydrophobicContact CE1-CD1 4.13Å; Y358-Y369 HydrophobicContact CE1-CG 4.28Å; Y369-E371 HydrophobicContact CE2-CB 4.12Å; Y369-Y377 CarbonylContact O-C 3.57Å; Y369-Y377 WeakPolarHBondContact O-CA 3.31Å; Y369-L378 HydrophobicContact CD1-CB 4.31Å; Y369-L378 VanDerWaalsContact CD1-O 3.32Å; Y369-L378 WeakPolarHBondContact CD1-O 3.35Å; Y369-L378 HydrophobicContact CE1-CB 3.72Å; Y369-L378 HydrophobicContact CE2-CB 4.42Å; Y369-L378 HydrophobicContact CE2-CD1 4.48Å; Y369-L378 PolarHBondContact N-O 3.07Å; Y369-L378 PolarHBondContact O-N 3.4Å
370	W	82	Confident	79.8	Confident	103 Å²	103	91.3 Å²	91.3	39%	0.39	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.5	172	177.5	-100.5	0	0	0	109.4	Y359 P372 Q375 Y377	Y359-W370 HydrophobicContact CE2-CB 4.33Å; W370-P372 WeakPolarHBondContact O-CD 3.39Å; W370-Q375 HydrophobicContact CH2-CB 3.91Å; W370-Q375 WeakPolarHBondContact CH2-O 3.39Å; W370-Q375 HydrophobicContact CZ2-CB 3.91Å; W370-Q375 HydrophobicContact CZ2-CG 4.34Å; W370-Q375 WeakPolarHBondContact CZ3-O 3.45Å; W370-Y377 HydrophobicContact CB-CD1 4.3Å; W370-Y377 HydrophobicContact CB-CE1 4Å; W370-Y377 HydrophobicContact CE3-CD1 4.19Å; W370-Y377 AromaticContact CE3-CD2 3.89Å; W370-Y377 HydrophobicContact CE3-CD2 3.89Å; W370-Y377 AromaticContact CE3-CE1 3.95Å; W370-Y377 HydrophobicContact CE3-CE1 3.95Å; W370-Y377 AromaticContact CE3-CE2 3.62Å; W370-Y377 HydrophobicContact CE3-CE2 3.62Å; W370-Y377 HydrophobicContact CE3-CG 4.17Å; W370-Y377 AromaticContact CE3-CZ 3.66Å; W370-Y377 HydrophobicContact CZ3-CD2 4.08Å; W370-Y377 AromaticContact CZ3-CE2 3.79Å; W370-Y377 HydrophobicContact CZ3-CE2 3.79Å
371	E	79.7	Confident	79.2	Confident	39 Å²	39	90.6 Å²	90.6	18%	0.182	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	106.9	175.3	177.2	42.7	-119.2	0	0	109.8	Y369 S373 Y374 Q375 T376 L378	Y369-E371 HydrophobicContact CE2-CB 4.12Å; E371-S373 PolarHBondContact O-N 3.13Å; E371-S373 WeakPolarHBondContact OE1-CB 3.47Å; E371-S373 PolarHBondContact OE1-N 3.08Å; E371-S373 PolarHBondContact OE1-OG 3.44Å; E371-Y374 HydrophobicContact CG-CD2 3.58Å; E371-Y374 HydrophobicContact CG-CE2 4.2Å; E371-Y374 HydrophobicContact CG-CG 4.48Å; E371-Y374 PolarHBondContact O-N 2.97Å; E371-Q375 PolarHBondContact O-N 3.24Å; E371-Q375 VanDerWaalsContact O-N 3.08Å; E371-T376 PolarHBondContact N-O 2.84Å; E371-L378 HydrophobicContact CB-CD1 3.72Å; E371-L378 HydrophobicContact CB-CG 4.03Å; E371-L378 HydrophobicContact CG-CD1 3.87Å
372	P	75.3	Confident	78.2	Confident	90 Å²	90	92.3 Å²	92.3	58%	0.584	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-31.5	-176.1	-24.4	34.8	0	0	0	113.8	W370 Y374	W370-P372 WeakPolarHBondContact O-CD 3.39Å; P372-Y374 VanDerWaalsContact C-N 3.27Å; P372-Y374 PolarHBondContact O-N 3.12Å
373	S	79.5	Confident	77.1	Confident	95 Å²	95	95 Å²	95	66%	0.664	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.4	-176	-47.8	0	0	0	0	113.4	E371	E371-S373 PolarHBondContact O-N 3.13Å; E371-S373 WeakPolarHBondContact OE1-CB 3.47Å; E371-S373 PolarHBondContact OE1-N 3.08Å; E371-S373 PolarHBondContact OE1-OG 3.44Å
374	Y	80.7	Confident	75.6	Confident	174 Å²	174	92.5 Å²	92.5	68%	0.682	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-0.8	-177.8	-56.7	-61.6	0	0	0	113.4	E371 P372 T376 L378	E371-Y374 HydrophobicContact CG-CD2 3.58Å; E371-Y374 HydrophobicContact CG-CE2 4.2Å; E371-Y374 HydrophobicContact CG-CG 4.48Å; E371-Y374 PolarHBondContact O-N 2.97Å; P372-Y374 VanDerWaalsContact C-N 3.27Å; P372-Y374 PolarHBondContact O-N 3.12Å; Y374-T376 PolarHBondContact O-N 3.43Å; Y374-L378 HydrophobicContact CD2-CD1 4.44Å
375	Q	77.6	Confident	74.1	Confident	155 Å²	155	94.8 Å²	94.8	72%	0.724	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	43	-173.6	-59.6	-172.3	-6.6	0	0	113.1	W370 E371	W370-Q375 HydrophobicContact CH2-CB 3.91Å; W370-Q375 WeakPolarHBondContact CH2-O 3.39Å; W370-Q375 HydrophobicContact CZ2-CB 3.91Å; W370-Q375 HydrophobicContact CZ2-CG 4.34Å; W370-Q375 WeakPolarHBondContact CZ3-O 3.45Å; E371-Q375 PolarHBondContact O-N 3.24Å; E371-Q375 VanDerWaalsContact O-N 3.08Å
376	T	84.5	Confident	72.4	Confident	62 Å²	62	93.5 Å²	93.5	38%	0.38	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	163.9	-175.4	-160	0	0	0	0	112.2	E371 Y374 L378	E371-T376 PolarHBondContact N-O 2.84Å; Y374-T376 PolarHBondContact O-N 3.43Å; T376-L378 HydrophobicContact CG2-CD2 3.8Å; T376-L378 HydrophobicContact CG2-CG 4.11Å
377	Y	81.9	Confident	70.6	Confident	116 Å²	116	96.9 Å²	96.9	46%	0.455	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	113.2	175.2	-73.1	-78.6	0	0	0	110.4	Y359 V368 Y369 W370	Y359-Y377 HydrophobicContact CD2-CD1 4.34Å; Y359-Y377 AromaticContact CD2-CE1 3.71Å; Y359-Y377 HydrophobicContact CD2-CE1 3.71Å; Y359-Y377 AromaticContact CE2-CE1 3.99Å; Y359-Y377 HydrophobicContact CE2-CE1 3.99Å; Y359-Y377 HydrophobicContact CG-CE1 4.06Å; V368-Y377 HydrophobicContact CB-CD1 4.46Å; V368-Y377 HydrophobicContact CG2-CD1 3.76Å; V368-Y377 HydrophobicContact CG2-CG 4.15Å; Y369-Y377 CarbonylContact O-C 3.57Å; Y369-Y377 WeakPolarHBondContact O-CA 3.31Å; W370-Y377 HydrophobicContact CB-CD1 4.3Å; W370-Y377 HydrophobicContact CB-CE1 4Å; W370-Y377 HydrophobicContact CE3-CD1 4.19Å; W370-Y377 AromaticContact CE3-CD2 3.89Å; W370-Y377 HydrophobicContact CE3-CD2 3.89Å; W370-Y377 AromaticContact CE3-CE1 3.95Å; W370-Y377 HydrophobicContact CE3-CE1 3.95Å; W370-Y377 AromaticContact CE3-CE2 3.62Å; W370-Y377 HydrophobicContact CE3-CE2 3.62Å; W370-Y377 HydrophobicContact CE3-CG 4.17Å; W370-Y377 AromaticContact CE3-CZ 3.66Å; W370-Y377 HydrophobicContact CZ3-CD2 4.08Å; W370-Y377 AromaticContact CZ3-CE2 3.79Å; W370-Y377 HydrophobicContact CZ3-CE2 3.79Å
378	L	83.6	Confident	68.7	Low	52 Å²	52	97.2 Å²	97.2	27%	0.272	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	141.8	178	-64.8	-177.8	0	0	0	111.1	V368 Y369 E371 Y374 T376 A380	V368-L378 CarbonylContact C-O 3.56Å; V368-L378 WeakPolarHBondContact CA-O 3.46Å; V368-L378 WeakPolarHBondContact CB-O 3.39Å; Y369-L378 HydrophobicContact CD1-CB 4.31Å; Y369-L378 VanDerWaalsContact CD1-O 3.32Å; Y369-L378 WeakPolarHBondContact CD1-O 3.35Å; Y369-L378 HydrophobicContact CE1-CB 3.72Å; Y369-L378 HydrophobicContact CE2-CB 4.42Å; Y369-L378 HydrophobicContact CE2-CD1 4.48Å; Y369-L378 PolarHBondContact N-O 3.07Å; Y369-L378 PolarHBondContact O-N 3.4Å; E371-L378 HydrophobicContact CB-CD1 3.72Å; E371-L378 HydrophobicContact CB-CG 4.03Å; E371-L378 HydrophobicContact CG-CD1 3.87Å; Y374-L378 HydrophobicContact CD2-CD1 4.44Å; T376-L378 HydrophobicContact CG2-CD2 3.8Å; T376-L378 HydrophobicContact CG2-CG 4.11Å; L378-A380 PolarHBondContact O-N 3.14Å
379	P	82.6	Confident	66.6	Low	74 Å²	74	104.1 Å²	104.1	48%	0.481	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	134.8	175.2	-24.2	34.5	0	0	0	112.6
380	A	73.1	Confident	64.3	Low	20 Å²	20	105.4 Å²	105.4	17%	0.165	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-75.7	126.1	171.5	0	0	0	0	0	109.8	Y358 F367 L378 T382	Y358-A380 HydrophobicContact CD1-CB 3.67Å; Y358-A380 HydrophobicContact CE1-CB 3.58Å; F367-A380 HydrophobicContact CB-CB 3.89Å; F367-A380 WeakPolarHBondContact O-CB 3.42Å; F367-A380 PolarHBondContact O-N 2.81Å; L378-A380 PolarHBondContact O-N 3.14Å; A380-T382 PolarHBondContact O-N 3.19Å
381	L	68.2	Low	61.9	Low	110 Å²	110	104.9 Å²	104.9	58%	0.576	56%	0.56	S	S	*	*			trans	-71.1	96.1	177.6	-70	174	0	0	0	110.8	Q383	L381-Q383 PolarHBondContact O-N 3.12Å
382	T	56.1	Low	59.4	Low	93 Å²	93	109.4 Å²	109.4	57%	0.571	60%	0.595	S	S	*	*			trans	-57.9	130	168.9	-40.9	0	0	0	0	109.3	A380 V384 Q385	A380-T382 PolarHBondContact O-N 3.19Å; T382-V384 HydrophobicContact CG2-CG2 4.32Å; T382-V384 PolarHBondContact O-N 3.25Å; T382-Q385 PolarHBondContact O-N 3.45Å
383	Q	52.1	Low	57.2	Low	152 Å²	152	110.4 Å²	110.4	71%	0.71	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	-18.9	-170.6	-70.3	176.6	-21.7	0	0	115.2	L381 Q385 Q386	L381-Q383 PolarHBondContact O-N 3.12Å; Q383-Q385 PolarHBondContact O-N 3Å; Q383-Q386 PolarHBondContact O-N 3.46Å
384	V	47.3	Very low	55.1	Low	112 Å²	112	112.2 Å²	112.2	68%	0.679	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-27.3	172.8	-172.3	0	0	0	0	113.3	T382 N388	T382-V384 HydrophobicContact CG2-CG2 4.32Å; T382-V384 PolarHBondContact O-N 3.25Å; V384-N388 PolarHBondContact O-ND2 2.82Å; V384-N388 VanDerWaalsContact O-ND2 3.1Å
385	Q	44.2	Very low	52.7	Low	99 Å²	99	108 Å²	108	46%	0.463	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.8	-30.3	-179.3	-73.7	-177.1	-23.1	0	0	113.8	T382 Q383 Q387 N388 Q389	T382-Q385 PolarHBondContact O-N 3.45Å; Q383-Q385 PolarHBondContact O-N 3Å; Q385-Q387 PolarHBondContact O-N 3.15Å; Q385-N388 PolarHBondContact O-N 3.27Å; Q385-Q389 PolarHBondContact O-N 3.14Å
386	Q	44.4	Very low	50.5	Low	123 Å²	123	104.4 Å²	104.4	58%	0.575	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-20.7	-177	-74.4	-178.9	-21.3	0	0	113.7	Q383	Q383-Q386 PolarHBondContact O-N 3.46Å
387	Q	40.4	Very low	48	Very low	172 Å²	172	113 Å²	113	80%	0.804	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-6.3	173.5	-68.4	-173.3	-13.1	0	0	114.5	Q385	Q385-Q387 PolarHBondContact O-N 3.15Å
388	N	40.3	Very low	45.8	Very low	123 Å²	123	114 Å²	114	66%	0.658	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	2.6	-172	-76.3	-57.6	0	0	0	115	V384 Q385	V384-N388 PolarHBondContact O-ND2 2.82Å; V384-N388 VanDerWaalsContact O-ND2 3.1Å; Q385-N388 PolarHBondContact O-N 3.27Å
389	Q	41.2	Very low	43.3	Very low	157 Å²	157	114.6 Å²	114.6	73%	0.734	69%	0.69	S	S	*	*	S	Bend	trans	-122	2.8	177.8	-68.5	-174.7	-13.1	0	0	114.2	Q385	Q385-Q389 PolarHBondContact O-N 3.14Å
390	A	36.1	Very low	41.1	Very low	92 Å²	92	120.6 Å²	120.6	76%	0.76	71%	0.712	S	S	*	*	S	Bend	trans	-93.1	11.6	-178.9	0	0	0	0	0	114.6
391	S	30.9	Very low	39.1	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	74%	0.743	S	S	*	*			trans	-143	52.7	-167.3	67.6	0	0	0	0	115
392	C	28.3	Very low	37.7	Very low	134 Å²	134	129.1 Å²	129.1	91%	0.905	75%	0.754	S	S	*	*			trans	-121.8	87.6	164.8	-78.4	0	0	0	0	111
393	S	29.3	Very low	36.7	Very low	112 Å²	112	131.3 Å²	131.3	78%	0.783	76%	0.758	S	S	*	*			trans	-37.7	164	163.6	-59.6	0	0	0	0	115.4
394	P	33.7	Very low	35.7	Very low	132 Å²	132	132.2 Å²	132.2	86%	0.857	76%	0.76	S	S	*	*			cis	-147.4	162.8	31.9	41.4	-21.4	0	0	0	119.9
395	G	31.7	Very low	35.2	Very low	85 Å²	85	132.3 Å²	132.3	88%	0.876	76%	0.763	S	S	*	*			trans	143.2	86.1	158.5	0	0	0	0	0	115.7
396	G	30.9	Very low	34.6	Very low	81 Å²	81	137.1 Å²	137.1	84%	0.835	78%	0.782	S	S	*	*			trans	176	151.3	176.4	0	0	0	0	0	111.4
397	R	32.5	Very low	34.3	Very low	241 Å²	241	140.8 Å²	140.8	91%	0.909	80%	0.796	S	S	*	*			trans	-146.5	143.3	-165	-158.3	-170.9	-170.2	-168.7	4	112.5
398	V	34.7	Very low	34.1	Very low	138 Å²	138	140.9 Å²	140.9	84%	0.836	80%	0.797	S	S	*	*			trans	70.3	137	176.4	-162.4	0	0	0	0	113.4
399	G	31.8	Very low	34.2	Very low	65 Å²	65	140.2 Å²	140.2	67%	0.67	80%	0.799	S	S	*	*			cis	178.8	-174.3	-7	0	0	0	0	0	112.8
400	E	36.4	Very low	34.4	Very low	200 Å²	200	140.8 Å²	140.8	94%	0.935	80%	0.799	S	S	*	*			trans	82.3	129.4	165.3	-54.1	-169.6	157.3	0	0	120.8
401	T	31.2	Very low	35.2	Very low	135 Å²	135	142.2 Å²	142.2	83%	0.828	79%	0.794	S	S	*	*			trans	-90.9	-178.6	-176	16.8	0	0	0	0	113
402	E	37.2	Very low	36.4	Very low	173 Å²	173	146 Å²	146	81%	0.808	80%	0.799	S	S	*	*			cis	-115.1	-147.3	-3.7	-78.8	-151.7	88.6	0	0	109.5
403	E	36.9	Very low	38	Very low	139 Å²	139	145.4 Å²	145.4	65%	0.65	78%	0.782	S	S	*	*			cis	-149.9	162.5	-5.5	-156	-73.3	108.2	0	0	107.9	P405	E403-P405 WeakPolarHBondContact OE2-CD 3.43Å
404	K	31	Very low	39.8	Very low	171 Å²	171	144 Å²	144	74%	0.743	77%	0.766	S	S	*	*			trans	-158.3	110.8	173.8	-160.4	171.3	-164.3	159.4	0	114.3
405	P	35.5	Very low	41.5	Very low	114 Å²	114	145.1 Å²	145.1	74%	0.74	76%	0.757	S	S	*	*			trans	-72.5	138.4	173.3	29.6	-33.2	0	0	0	111.8	E403	E403-P405 WeakPolarHBondContact OE2-CD 3.43Å
406	K	33.2	Very low	43.8	Very low	200 Å²	200	145.1 Å²	145.1	87%	0.87	74%	0.74	S	S	*	*			trans	-101.3	140.1	-176	-62	165.1	-175.8	162.1	0	111.6
407	K	36.2	Very low	46.2	Very low	200 Å²	200	146.2 Å²	146.2	87%	0.87	72%	0.722	S	S	*	*			trans	-140.9	114.3	157.6	-109	178.9	-177.7	175.7	0	113.6
408	Q	37.3	Very low	48.2	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	71%	0.711	S	S	*	*			trans	56.4	149.8	158.4	-54.5	-163	7.5	0	0	121.2
409	P	41.9	Very low	50.1	Low	109 Å²	109	137.3 Å²	137.3	71%	0.708	69%	0.693	S	S	*	*	S	Bend	trans	-111.4	-5.4	-167.3	10.8	13.8	0	0	0	115.6
410	K	45	Very low	52.7	Low	168 Å²	168	141.1 Å²	141.1	73%	0.73	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-44.3	-159	-145.6	171.6	-175.7	179.7	0	113.7	K412 H413	K410-K412 PolarHBondContact O-N 2.7Å; K410-K412 VanDerWaalsContact O-N 3.1Å; K410-H413 PolarHBondContact O-N 3.2Å
411	D	53.9	Low	55	Low	123 Å²	123	138.5 Å²	138.5	66%	0.658	68%	0.676	S	S	*	*	H	α-helix	trans	-65.5	-19.3	-170.9	-49.7	-24.3	0	0	0	114.7	H413 K415	D411-H413 VanDerWaalsContact C-N 3.28Å; D411-H413 PolarHBondContact O-N 3.42Å; D411-K415 PolarHBondContact O-N 3.06Å
412	K	55.5	Low	57.4	Low	170 Å²	170	137.1 Å²	137.1	74%	0.739	66%	0.663	S	S	*	*	H	α-helix	trans	-63.7	-35.2	179	-73.5	-171.4	175.4	-175.6	0	111.9	K410 V416	K410-K412 PolarHBondContact O-N 2.7Å; K410-K412 VanDerWaalsContact O-N 3.1Å; K412-V416 WeakPolarHBondContact O-CG2 3.38Å; K412-V416 PolarHBondContact O-N 2.92Å; K412-V416 VanDerWaalsContact O-N 3.16Å
413	H	61.5	Low	59.6	Low	122 Å²	122	135.5 Å²	135.5	57%	0.565	66%	0.656	S	S	*	*	H	α-helix	trans	-69.2	-42.8	-175.7	-174.1	-143.2	0	0	0	112.1	K410 D411 V416 K417	K410-H413 PolarHBondContact O-N 3.2Å; D411-H413 VanDerWaalsContact C-N 3.28Å; D411-H413 PolarHBondContact O-N 3.42Å; H413-V416 PolarHBondContact O-N 3.24Å; H413-K417 WeakPolarHBondContact CE1-CE 3.45Å; H413-K417 PolarHBondContact O-N 2.89Å
414	D	67.9	Low	62	Low	82 Å²	82	136.2 Å²	136.2	44%	0.439	66%	0.656	S	S	.	*	H	α-helix	trans	-77.3	-29.8	-178.1	-63.3	-49.3	0	0	0	112.6	V416 K417 M418	D414-V416 VanDerWaalsContact C-N 3.34Å; D414-V416 PolarHBondContact O-N 3.24Å; D414-K417 PolarHBondContact O-N 3.43Å; D414-K417 WeakPolarHBondContact OD1-CD 3.29Å; D414-K417 WeakPolarHBondContact OD1-CE 3.12Å; D414-K417 IonicContact OD1-NZ 2.68Å; D414-K417 PolarHBondContact OD1-NZ 3.15Å; D414-M418 PolarHBondContact O-N 2.99Å
415	K	69.9	Low	64.5	Low	156 Å²	156	132.4 Å²	132.4	68%	0.678	64%	0.644	S	S	*	*	H	α-helix	trans	-60.3	-41.1	166	-75.5	-179.8	176.1	178.6	0	112.1	D411 M418 A419	D411-K415 PolarHBondContact O-N 3.06Å; K415-M418 PolarHBondContact O-N 3.5Å; K415-A419 PolarHBondContact O-N 3.09Å
416	V	78.9	Confident	66.8	Low	85 Å²	85	132.9 Å²	132.9	52%	0.515	64%	0.638	S	S	.	*	H	α-helix	trans	-66.6	-37.3	174.7	169.9	0	0	0	0	112.1	K412 H413 D414 K420	K412-V416 WeakPolarHBondContact O-CG2 3.38Å; K412-V416 PolarHBondContact O-N 2.92Å; K412-V416 VanDerWaalsContact O-N 3.16Å; H413-V416 PolarHBondContact O-N 3.24Å; D414-V416 VanDerWaalsContact C-N 3.34Å; D414-V416 PolarHBondContact O-N 3.24Å; V416-K420 PolarHBondContact O-N 3.47Å; V416-K420 VanDerWaalsContact O-N 3.08Å
417	K	80.8	Confident	69.3	Low	105 Å²	105	128 Å²	128	46%	0.457	62%	0.618	S	S	.	*	H	α-helix	trans	-63.4	-45.4	172.5	-68.4	176.9	-165.3	159.2	0	112.1	H413 D414 K420 K421	H413-K417 WeakPolarHBondContact CE1-CE 3.45Å; H413-K417 PolarHBondContact O-N 2.89Å; D414-K417 PolarHBondContact O-N 3.43Å; D414-K417 WeakPolarHBondContact OD1-CD 3.29Å; D414-K417 WeakPolarHBondContact OD1-CE 3.12Å; D414-K417 IonicContact OD1-NZ 2.68Å; D414-K417 PolarHBondContact OD1-NZ 3.15Å; K417-K420 PolarHBondContact O-N 3.4Å; K417-K421 PolarHBondContact O-N 2.74Å
418	M	74.8	Confident	71.7	Confident	136 Å²	136	125.3 Å²	125.3	67%	0.67	61%	0.606	S	S	*	*	H	α-helix	trans	-62.7	-43.9	177.7	-81.4	-173.6	169.2	0	0	111.8	D414 K415 K420 K421 I422	D414-M418 PolarHBondContact O-N 2.99Å; K415-M418 PolarHBondContact O-N 3.5Å; M418-K420 PolarHBondContact O-N 3.4Å; M418-K421 PolarHBondContact O-N 3.11Å; M418-K421 VanDerWaalsContact O-N 3.09Å; M418-I422 WeakPolarHBondContact O-CG1 3.18Å; M418-I422 PolarHBondContact O-N 2.98Å
419	A	75.8	Confident	73.5	Confident	56 Å²	56	125 Å²	125	46%	0.463	60%	0.598	S	S	.	*	H	α-helix	trans	-56.6	-47.7	174	0	0	0	0	0	112.1	K415 K421 I422 Q423	K415-A419 PolarHBondContact O-N 3.09Å; A419-K421 VanDerWaalsContact C-N 3.3Å; A419-K421 PolarHBondContact O-N 3.5Å; A419-I422 PolarHBondContact O-N 3.33Å; A419-Q423 WeakPolarHBondContact O-CB 2.96Å; A419-Q423 PolarHBondContact O-N 3.17Å
420	K	85.4	Confident	75.4	Confident	144 Å²	144	122.1 Å²	122.1	63%	0.626	58%	0.584	S	S	*	*	H	α-helix	trans	-63.9	-29.8	175.1	-85.2	-176	171.6	178.8	0	113.9	V416 K417 M418 K424	V416-K420 PolarHBondContact O-N 3.47Å; V416-K420 VanDerWaalsContact O-N 3.08Å; K417-K420 PolarHBondContact O-N 3.4Å; M418-K420 PolarHBondContact O-N 3.4Å; K420-K424 PolarHBondContact O-N 3.18Å
421	K	86.3	Confident	77.2	Confident	145 Å²	145	121.7 Å²	121.7	63%	0.63	58%	0.577	S	S	*	*	H	α-helix	trans	-71.4	-48.6	174.4	-170.3	-179.4	177.4	-173.7	0	111.2	K417 M418 A419 Q423 K424 D425	K417-K421 PolarHBondContact O-N 2.74Å; M418-K421 PolarHBondContact O-N 3.11Å; M418-K421 VanDerWaalsContact O-N 3.09Å; A419-K421 VanDerWaalsContact C-N 3.3Å; A419-K421 PolarHBondContact O-N 3.5Å; K421-Q423 VanDerWaalsContact C-N 3.33Å; K421-Q423 PolarHBondContact O-N 3.06Å; K421-K424 PolarHBondContact O-N 3.09Å; K421-K424 VanDerWaalsContact O-N 3.17Å; K421-D425 PolarHBondContact O-N 3.5Å
422	I	80.8	Confident	78.6	Confident	107 Å²	107	121.9 Å²	121.9	55%	0.549	57%	0.574	S	S	.	*	H	α-helix	trans	-58.9	-45	178	-66	163	0	0	0	110.5	M418 A419 K424 D425 M426	M418-I422 WeakPolarHBondContact O-CG1 3.18Å; M418-I422 PolarHBondContact O-N 2.98Å; A419-I422 PolarHBondContact O-N 3.33Å; I422-K424 VanDerWaalsContact C-N 3.32Å; I422-K424 PolarHBondContact O-N 3.28Å; I422-D425 PolarHBondContact O-N 3.47Å; I422-M426 HydrophobicContact CG2-SD 4.41Å; I422-M426 WeakPolarHBondContact O-CG 3.37Å; I422-M426 PolarHBondContact O-N 3.23Å
423	Q	82.1	Confident	79.7	Confident	139 Å²	139	118.2 Å²	118.2	65%	0.65	56%	0.562	S	S	*	*	H	α-helix	trans	-59.7	-40.4	177.4	-171.9	177.4	-5.3	0	0	112.4	A419 K421 E427	A419-Q423 WeakPolarHBondContact O-CB 2.96Å; A419-Q423 PolarHBondContact O-N 3.17Å; K421-Q423 VanDerWaalsContact C-N 3.33Å; K421-Q423 PolarHBondContact O-N 3.06Å; Q423-E427 PolarHBondContact O-N 3.46Å; Q423-E427 VanDerWaalsContact O-N 3.09Å
424	K	88	Confident	80.5	Confident	154 Å²	154	116.7 Å²	116.7	67%	0.67	56%	0.558	S	S	*	*	H	α-helix	trans	-68.9	-38.9	175.2	-83.2	-167.9	170.5	-170.1	0	113.4	K420 K421 I422 E427 K428	K420-K424 PolarHBondContact O-N 3.18Å; K421-K424 PolarHBondContact O-N 3.09Å; K421-K424 VanDerWaalsContact O-N 3.17Å; I422-K424 VanDerWaalsContact C-N 3.32Å; I422-K424 PolarHBondContact O-N 3.28Å; K424-E427 PolarHBondContact O-N 3.32Å; K424-K428 WeakPolarHBondContact O-CB 3.45Å; K424-K428 PolarHBondContact O-N 3.22Å
425	D	84.8	Confident	80.9	Confident	91 Å²	91	119.2 Å²	119.2	49%	0.487	57%	0.567	S	S	.	*	H	α-helix	trans	-68.7	-37.5	176.5	-84.9	-23.5	0	0	0	111.6	K421 I422 K428 W429	K421-D425 PolarHBondContact O-N 3.5Å; I422-D425 PolarHBondContact O-N 3.47Å; D425-K428 PolarHBondContact O-N 2.91Å; D425-W429 WeakPolarHBondContact O-CB 3.27Å; D425-W429 PolarHBondContact O-N 2.68Å
426	M	82.5	Confident	81.1	Confident	124 Å²	124	121.2 Å²	121.2	61%	0.611	57%	0.571	S	S	*	*	H	α-helix	trans	-61	-44.9	171.5	-73.1	-173.1	73	0	0	112.2	I422 K428 W429 A430	I422-M426 HydrophobicContact CG2-SD 4.41Å; I422-M426 WeakPolarHBondContact O-CG 3.37Å; I422-M426 PolarHBondContact O-N 3.23Å; M426-K428 VanDerWaalsContact C-N 3.34Å; M426-K428 PolarHBondContact O-N 2.85Å; M426-W429 PolarHBondContact O-N 3.08Å; M426-A430 WeakPolarHBondContact O-CB 3.41Å; M426-A430 PolarHBondContact O-N 3.19Å
427	E	85.3	Confident	80.8	Confident	96 Å²	96	124.3 Å²	124.3	45%	0.449	58%	0.577	S	S	.	*	H	α-helix	trans	-63.9	-40.5	177.6	-159.3	-157.4	139.1	0	0	111.7	Q423 K424 A430 R431	Q423-E427 PolarHBondContact O-N 3.46Å; Q423-E427 VanDerWaalsContact O-N 3.09Å; K424-E427 PolarHBondContact O-N 3.32Å; E427-A430 PolarHBondContact O-N 3.26Å; E427-R431 VanDerWaalsContact O-CG 3.3Å; E427-R431 WeakPolarHBondContact O-CG 3.45Å; E427-R431 PolarHBondContact O-N 3.37Å; E427-R431 IonicContact OE1-CZ 2.75Å; E427-R431 IonicContact OE1-NE 3.19Å; E427-R431 PolarHBondContact OE1-NE 3.14Å; E427-R431 IonicContact OE1-NH2 2.63Å; E427-R431 PolarHBondContact OE1-NH2 2.95Å
428	K	87.3	Confident	79.9	Confident	144 Å²	144	125.4 Å²	125.4	63%	0.626	58%	0.584	S	S	*	*	H	α-helix	trans	-65.8	-40.5	176.5	-167.5	178.9	-178.1	-174.4	0	111.9	K424 D425 M426 Q432	K424-K428 WeakPolarHBondContact O-CB 3.45Å; K424-K428 PolarHBondContact O-N 3.22Å; D425-K428 PolarHBondContact O-N 2.91Å; M426-K428 VanDerWaalsContact C-N 3.34Å; M426-K428 PolarHBondContact O-N 2.85Å; K428-Q432 WeakPolarHBondContact O-CB 3.38Å; K428-Q432 PolarHBondContact O-N 3.18Å
429	W	76.2	Confident	79	Confident	169 Å²	169	120.6 Å²	120.6	64%	0.64	57%	0.569	S	S	*	*	H	α-helix	trans	-64.9	-44.6	175.6	-174.2	58.9	0	0	0	111.8	D425 M426 R431 Q432 L433	D425-W429 WeakPolarHBondContact O-CB 3.27Å; D425-W429 PolarHBondContact O-N 2.68Å; M426-W429 PolarHBondContact O-N 3.08Å; W429-R431 PolarHBondContact O-N 3.39Å; W429-Q432 PolarHBondContact O-N 3.16Å; W429-L433 HydrophobicContact CZ2-CD1 4.46Å; W429-L433 WeakPolarHBondContact O-CB 3.39Å; W429-L433 PolarHBondContact O-N 2.75Å
430	A	80.4	Confident	78	Confident	49 Å²	49	123.5 Å²	123.5	41%	0.405	58%	0.576	S	S	.	*	H	α-helix	trans	-60	-45	175.8	0	0	0	0	0	112.4	M426 E427 Q432 L433 N434	M426-A430 WeakPolarHBondContact O-CB 3.41Å; M426-A430 PolarHBondContact O-N 3.19Å; E427-A430 PolarHBondContact O-N 3.26Å; A430-Q432 VanDerWaalsContact C-N 3.34Å; A430-Q432 PolarHBondContact O-N 3.37Å; A430-L433 PolarHBondContact O-N 3.35Å; A430-N434 PolarHBondContact O-N 3.43Å
431	R	83.9	Confident	76.2	Confident	158 Å²	158	120.2 Å²	120.2	60%	0.596	57%	0.571	S	S	*	*	H	α-helix	trans	-58.3	-44.5	173.8	-71.6	167.6	179.8	-103.2	6.6	111.8	E427 W429 L433 N434 Q435	E427-R431 VanDerWaalsContact O-CG 3.3Å; E427-R431 WeakPolarHBondContact O-CG 3.45Å; E427-R431 PolarHBondContact O-N 3.37Å; E427-R431 IonicContact OE1-CZ 2.75Å; E427-R431 IonicContact OE1-NE 3.19Å; E427-R431 PolarHBondContact OE1-NE 3.14Å; E427-R431 IonicContact OE1-NH2 2.63Å; E427-R431 PolarHBondContact OE1-NH2 2.95Å; W429-R431 PolarHBondContact O-N 3.39Å; R431-L433 PolarHBondContact O-N 3.35Å; R431-N434 PolarHBondContact O-N 3.4Å; R431-Q435 WeakPolarHBondContact O-CG 3.46Å; R431-Q435 PolarHBondContact O-N 2.76Å; R431-Q435 VanDerWaalsContact O-N 3.07Å
432	Q	82.6	Confident	74.4	Confident	128 Å²	128	117.9 Å²	117.9	60%	0.598	57%	0.569	S	S	*	*	H	α-helix	trans	-68.3	-33	-179.9	-162.8	175	31.2	0	0	112.7	K428 W429 A430 R436	K428-Q432 WeakPolarHBondContact O-CB 3.38Å; K428-Q432 PolarHBondContact O-N 3.18Å; W429-Q432 PolarHBondContact O-N 3.16Å; A430-Q432 VanDerWaalsContact C-N 3.34Å; A430-Q432 PolarHBondContact O-N 3.37Å; Q432-R436 WeakPolarHBondContact O-CB 3.49Å; Q432-R436 PolarHBondContact O-N 3.39Å
433	L	78.5	Confident	72.8	Confident	92 Å²	92	123.4 Å²	123.4	48%	0.482	58%	0.583	S	S	.	*	H	α-helix	trans	-69.3	-43.8	176	-154	163.9	0	0	0	111.1	W429 A430 R431 R436 K437	W429-L433 HydrophobicContact CZ2-CD1 4.46Å; W429-L433 WeakPolarHBondContact O-CB 3.39Å; W429-L433 PolarHBondContact O-N 2.75Å; A430-L433 PolarHBondContact O-N 3.35Å; R431-L433 PolarHBondContact O-N 3.35Å; L433-R436 PolarHBondContact O-N 2.85Å; L433-K437 PolarHBondContact O-N 3.17Å
434	N	78.4	Confident	70.9	Confident	91 Å²	91	124.7 Å²	124.7	49%	0.487	59%	0.589	S	S	.	*	H	α-helix	trans	-63.5	-46.5	175.8	-75.7	-7.7	0	0	0	112.5	A430 R431 R436 K437 E438	A430-N434 PolarHBondContact O-N 3.43Å; R431-N434 PolarHBondContact O-N 3.4Å; N434-R436 PolarHBondContact O-N 3.25Å; N434-K437 WeakPolarHBondContact O-CA 3.4Å; N434-K437 WeakPolarHBondContact O-CB 3.45Å; N434-K437 PolarHBondContact O-N 3.05Å; N434-E438 PolarHBondContact O-N 2.94Å
435	Q	75.5	Confident	68.7	Low	134 Å²	134	122.1 Å²	122.1	63%	0.626	59%	0.586	S	S	*	*	H	α-helix	trans	-55.7	-38.7	174.4	-75.3	178.6	-16.9	0	0	112.3	R431 K437 G439	R431-Q435 WeakPolarHBondContact O-CG 3.46Å; R431-Q435 PolarHBondContact O-N 2.76Å; R431-Q435 VanDerWaalsContact O-N 3.07Å; Q435-K437 VanDerWaalsContact C-N 3.34Å; Q435-G439 PolarHBondContact O-N 2.98Å
436	R	75	Confident	66.5	Low	198 Å²	198	125.8 Å²	125.8	75%	0.747	60%	0.604	S	S	*	*	H	α-helix	trans	-69.3	-31.8	177.2	-151.3	175.7	-162.5	175.1	5	112.5	Q432 L433 N434 I440	Q432-R436 WeakPolarHBondContact O-CB 3.49Å; Q432-R436 PolarHBondContact O-N 3.39Å; L433-R436 PolarHBondContact O-N 2.85Å; N434-R436 PolarHBondContact O-N 3.25Å; R436-I440 WeakPolarHBondContact O-CD1 3.43Å; R436-I440 VanDerWaalsContact O-CG1 3.26Å; R436-I440 WeakPolarHBondContact O-CG1 3.42Å; R436-I440 PolarHBondContact O-N 3.03Å
437	K	73.1	Confident	64.3	Low	151 Å²	151	131 Å²	131	66%	0.657	62%	0.617	S	S	*	*	H	α-helix	trans	-70.9	-43.8	175.2	-166.8	178.9	179.9	-175.5	0	111.5	L433 N434 Q435 I440 S441	L433-K437 PolarHBondContact O-N 3.17Å; N434-K437 WeakPolarHBondContact O-CA 3.4Å; N434-K437 WeakPolarHBondContact O-CB 3.45Å; N434-K437 PolarHBondContact O-N 3.05Å; Q435-K437 VanDerWaalsContact C-N 3.34Å; K437-I440 PolarHBondContact O-N 3.42Å; K437-S441 PolarHBondContact O-N 3.46Å
438	E	61.4	Low	62	Low	128 Å²	128	135 Å²	135	60%	0.598	64%	0.636	S	S	*	*	H	α-helix	trans	-66.1	-42.6	177.3	-71.3	168.6	-170.7	0	0	112.4	N434 I440 S441 T442	N434-E438 PolarHBondContact O-N 2.94Å; E438-I440 PolarHBondContact O-N 2.79Å; E438-S441 PolarHBondContact O-N 2.86Å; E438-T442 PolarHBondContact O-N 3.22Å; E438-T442 PolarHBondContact O-OG1 3.33Å
439	G	55.7	Low	59.5	Low	35 Å²	35	137.2 Å²	137.2	36%	0.361	65%	0.648	S	S	.	*	H	α-helix	trans	-68.3	-14.6	176	0	0	0	0	0	115.1	Q435	Q435-G439 PolarHBondContact O-N 2.98Å
440	I	55.5	Low	57.5	Low	116 Å²	116	135 Å²	135	60%	0.595	66%	0.659	S	S	*	*	H	α-helix	trans	-90.8	-43	170	-69.3	168.4	0	0	0	110.1	R436 K437 E438 T442 R443 H444	R436-I440 WeakPolarHBondContact O-CD1 3.43Å; R436-I440 VanDerWaalsContact O-CG1 3.26Å; R436-I440 WeakPolarHBondContact O-CG1 3.42Å; R436-I440 PolarHBondContact O-N 3.03Å; K437-I440 PolarHBondContact O-N 3.42Å; E438-I440 PolarHBondContact O-N 2.79Å; I440-T442 PolarHBondContact O-N 2.94Å; I440-R443 PolarHBondContact O-N 3.06Å; I440-R443 VanDerWaalsContact O-N 3.15Å; I440-H444 PolarHBondContact O-N 2.85Å
441	S	47.6	Very low	55.3	Low	75 Å²	75	139.1 Å²	139.1	52%	0.524	68%	0.679	S	S	.	*	H	α-helix	trans	-57.6	-47.9	178.3	-163.8	0	0	0	0	112.2	K437 E438 R443 H444	K437-S441 PolarHBondContact O-N 3.46Å; E438-S441 PolarHBondContact O-N 2.86Å; S441-R443 PolarHBondContact O-N 3.15Å; S441-H444 PolarHBondContact O-N 3.03Å; S441-H444 VanDerWaalsContact O-N 3.12Å
442	T	48.7	Very low	52.9	Low	97 Å²	97	138 Å²	138	60%	0.595	69%	0.689	S	S	*	*	H	α-helix	trans	-63.4	-21.8	178.3	44.7	0	0	0	0	114.4	E438 I440	E438-T442 PolarHBondContact O-N 3.22Å; E438-T442 PolarHBondContact O-OG1 3.33Å; I440-T442 PolarHBondContact O-N 2.94Å
443	R	47.5	Very low	50.8	Low	222 Å²	222	140.8 Å²	140.8	84%	0.838	70%	0.702	S	S	*	*	H	α-helix	trans	-86.5	-12.4	176.4	-76.2	-177.7	168.8	-178.4	-3.1	114.4	I440 S441	I440-R443 PolarHBondContact O-N 3.06Å; I440-R443 VanDerWaalsContact O-N 3.15Å; S441-R443 PolarHBondContact O-N 3.15Å
444	H	42.1	Very low	48.6	Very low	167 Å²	167	144.3 Å²	144.3	77%	0.773	72%	0.716	S	S	*	*	H	α-helix	trans	-100.9	-3.2	-178.5	-151.7	-70.5	0	0	0	113.9	I440 S441	I440-H444 PolarHBondContact O-N 2.85Å; S441-H444 PolarHBondContact O-N 3.03Å; S441-H444 VanDerWaalsContact O-N 3.12Å
445	V	40.6	Very low	46.7	Very low	100 Å²	100	149.3 Å²	149.3	61%	0.606	74%	0.737	S	S	*	*	S	Bend	trans	-97.3	-25.4	-177.4	176.8	0	0	0	0	112.8	R447	V445-R447 VanDerWaalsContact C-N 3.26Å; V445-R447 PolarHBondContact O-N 2.98Å
446	L	37.8	Very low	44.7	Very low	167 Å²	167	148.2 Å²	148.2	87%	0.874	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	37.4	-176	-105.9	75.1	0	0	0	115.2
447	R	36.8	Very low	43.1	Very low	235 Å²	235	143.8 Å²	143.8	89%	0.887	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	4.2	177.9	-154.6	172.8	175	-176	-1.8	115.9	V445	V445-R447 VanDerWaalsContact C-N 3.26Å; V445-R447 PolarHBondContact O-N 2.98Å
448	Q	37.3	Very low	41.6	Very low	178 Å²	178	141.5 Å²	141.5	83%	0.832	74%	0.744	S	S	*	*	S	Bend	trans	-143.1	63.3	-179.1	-70.4	-173.4	-25.9	0	0	112.9
449	Q	34.9	Very low	40.6	Very low	192 Å²	192	141.7 Å²	141.7	90%	0.897	75%	0.754	S	S	*	*			trans	-171.9	107	164.9	-111.8	154	77	0	0	111.8
450	S	33.8	Very low	40	Very low	123 Å²	123	145.7 Å²	145.7	86%	0.86	78%	0.776	S	S	*	*			trans	-177.2	77.8	161.5	45	0	0	0	0	112.5
451	T	34.5	Very low	39.3	Very low	134 Å²	134	143.2 Å²	143.2	82%	0.822	78%	0.779	S	S	*	*			trans	-111.3	113.4	167.5	47.4	0	0	0	0	110.7
452	V	34.5	Very low	39.2	Very low	134 Å²	134	145.5 Å²	145.5	81%	0.812	80%	0.796	S	S	*	*			trans	47.9	103.3	152.7	-165	0	0	0	0	118
453	Q	37.9	Very low	38.7	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.874	80%	0.803	S	S	*	*				-169.2	168.2	120.9	-107.1	173.7	-13.8	0	0	111.7
454	E	31.6	Very low	38.6	Very low	166 Å²	166	142.4 Å²	142.4	78%	0.776	81%	0.805	S	S	*	*			trans	-100.2	147	-162.2	-57.6	150.7	100.5	0	0	113.8
455	Q	38.1	Very low	38.4	Very low	196 Å²	196	138.9 Å²	138.9	92%	0.916	81%	0.805	S	S	*	*				171.3	170.8	118.8	-88.6	167.3	28.9	0	0	110.8
456	S	35.3	Very low	38.3	Very low	111 Å²	111	139.1 Å²	139.1	78%	0.776	82%	0.817	S	S	*	*			trans	-139.2	-172.5	-160.3	69.6	0	0	0	0	111.4
457	P	40.7	Very low	38.2	Very low	105 Å²	105	140.4 Å²	140.4	68%	0.682	82%	0.816	S	S	*	*			cis	-134.9	-162.1	-6.7	39.6	-20.2	0	0	0	114.3
458	S	41.2	Very low	38.5	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	81%	0.805	S	S	*	*			trans	73.7	140.7	167.9	77.2	0	0	0	0	117.2
459	T	40.2	Very low	38.7	Very low	132 Å²	132	131.4 Å²	131.4	81%	0.81	80%	0.799	S	S	*	*			cis	-168.5	164.4	-12.7	17.4	0	0	0	0	106.4
460	S	44.1	Very low	39	Very low	118 Å²	118	130 Å²	130	83%	0.825	80%	0.797	S	S	*	*			cis	-171.8	165.2	-8.3	44.7	0	0	0	0	106.4
461	G	40.3	Very low	38.9	Very low	64 Å²	64	127.3 Å²	127.3	66%	0.66	79%	0.788	S	S	*	*			cis	-178.1	-176.1	2.3	0	0	0	0	0	110.3
462	S	45.2	Very low	39.1	Very low	124 Å²	124	133.3 Å²	133.3	87%	0.867	80%	0.795	S	S	*	*			trans	57.4	107.7	179.1	-64.5	0	0	0	0	116.5
463	A	39.4	Very low	39.2	Very low	91 Å²	91	132 Å²	132	75%	0.752	79%	0.792	S	S	*	*			cis	76.8	114.7	10	0	0	0	0	0	118.1
464	D	43.8	Very low	39.2	Very low	162 Å²	162	129.3 Å²	129.3	87%	0.866	79%	0.788	S	S	*	*			trans	-163.4	118.4	139.8	-90.3	-32.3	0	0	0	105.2
465	A	38.4	Very low	39.4	Very low	94 Å²	94	127.1 Å²	127.1	78%	0.777	79%	0.786	S	S	*	*				80.3	131.9	53.2	0	0	0	0	0	112.6
466	A	38.6	Very low	39.2	Very low	105 Å²	105	124.8 Å²	124.8	87%	0.868	78%	0.779	S	S	*	*			cis	-146	-177	7.1	0	0	0	0	0	113.5
467	F	35.6	Very low	39.8	Very low	194 Å²	194	124.5 Å²	124.5	85%	0.851	78%	0.775	S	S	*	*			trans	-125.6	-171	-177.8	164.6	-107	0	0	0	110.2
468	V	43.2	Very low	39.3	Very low	109 Å²	109	126.6 Å²	126.6	66%	0.661	78%	0.781	S	S	*	*			trans	95.5	150.9	166.2	-164.3	0	0	0	0	115.9
469	V	42.2	Very low	38.9	Very low	114 Å²	114	128.8 Å²	128.8	69%	0.691	78%	0.783	S	S	*	*			trans	114.9	90.3	155.1	-172	0	0	0	0	116.6
470	L	40	Very low	38.6	Very low	164 Å²	164	128 Å²	128	86%	0.859	78%	0.782	S	S	*	*			trans	60.4	151.5	145.2	-53.4	173.1	0	0	0	119.9
471	G	32.7	Very low	38.2	Very low	65 Å²	65	126.8 Å²	126.8	67%	0.67	78%	0.779	S	S	*	*			cis	112	82.4	-11.1	0	0	0	0	0	116.2
472	R	38.5	Very low	38.1	Very low	261 Å²	261	129.7 Å²	129.7	99%	0.985	79%	0.787	S	S	*	*			trans	-160.2	159.9	159.1	-126.2	170.7	-179.9	164.7	-0.6	113.6
473	S	35.5	Very low	37.4	Very low	106 Å²	106	128.7 Å²	128.7	74%	0.741	78%	0.78	S	S	*	*			trans	-125.4	150.6	178.8	168.1	0	0	0	0	109.8
474	V	38.3	Very low	37.1	Very low	131 Å²	131	131.2 Å²	131.2	79%	0.794	78%	0.78	S	S	*	*			trans	-163.3	111.8	155.5	151.1	0	0	0	0	107.1
475	V	36.5	Very low	36.6	Very low	119 Å²	119	129.1 Å²	129.1	72%	0.721	77%	0.772	S	S	*	*				73.6	129.8	90.8	-158.1	0	0	0	0	116.1
476	D	34.8	Very low	36.2	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	77%	0.769	S	S	*	*			trans	-74.2	-163.8	172.6	-37.8	-102	0	0	0	112.4
477	P	45.9	Very low	36.1	Very low	106 Å²	106	136.2 Å²	136.2	69%	0.688	77%	0.772	S	S	*	*			cis	-138.4	-169.5	-8.6	38.6	-17.1	0	0	0	116
478	D	30.2	Very low	35.8	Very low	149 Å²	149	135 Å²	135	80%	0.797	77%	0.769	S	S	*	*			trans	78.8	165.3	142.2	-92.8	-41.2	0	0	0	124
479	I	34.4	Very low	35.6	Very low	150 Å²	150	137 Å²	137	77%	0.769	78%	0.776	S	S	*	*			trans	93.3	95.4	164.6	-64	152	0	0	0	119.5
480	S	34	Very low	35.4	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	77%	0.772	S	S	*	*			trans	67.6	123.4	131.4	-56.3	0	0	0	0	124.3
481	A	35.9	Very low	35.2	Very low	92 Å²	92	135.4 Å²	135.4	76%	0.76	77%	0.771	S	S	*	*			trans	-84.2	170.4	145.4	0	0	0	0	0	110.3
482	P	37.1	Very low	35.5	Very low	125 Å²	125	140 Å²	140	81%	0.812	78%	0.775	S	S	*	*				-161.1	165	83.8	43.7	-23.8	0	0	0	119.7
483	S	31.1	Very low	35.3	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	77%	0.765	S	S	*	*			trans	74.4	156.5	141.1	-140	0	0	0	0	124.5
484	L	31.6	Very low	35.3	Very low	145 Å²	145	141.6 Å²	141.6	76%	0.759	77%	0.772	S	S	*	*			trans	67.5	140.7	159.9	-73.4	149.7	0	0	0	117.3
485	V	35.1	Very low	35.1	Very low	117 Å²	117	140.4 Å²	140.4	71%	0.709	77%	0.767	S	S	*	*			cis	-140.2	120.1	4.2	-172.8	0	0	0	0	105.6
486	E	29	Very low	35	Very low	152 Å²	152	143 Å²	143	71%	0.71	77%	0.768	S	S	*	*				64.8	103.6	77	-172.3	174	-136.8	0	0	116.3
487	Q	36.2	Very low	34.9	Very low	197 Å²	197	139 Å²	139	92%	0.921	76%	0.756	S	S	*	*			trans	-160.4	151.1	148.2	-118	173.3	-6.6	0	0	110.1
488	Q	30.7	Very low	34.7	Very low	169 Å²	169	138 Å²	138	79%	0.79	75%	0.752	S	S	*	*			trans	-131.2	146	-165.5	-56.1	171.4	-82.1	0	0	112.2
489	D	37.1	Very low	35.2	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	74%	0.742	S	S	*	*			trans	-165.5	123.9	145.3	-95.1	-39.1	0	0	0	105.8
490	S	38.4	Very low	35.7	Very low	88 Å²	88	134 Å²	134	62%	0.615	72%	0.724	S	S	*	*				72.8	126	61.5	89.9	0	0	0	0	112.5
491	D	35.5	Very low	36.4	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	71%	0.71	S	S	*	*			cis	-159.2	-164.4	-15.4	-123.3	-49.6	0	0	0	110.5
492	E	39.4	Very low	37.2	Very low	163 Å²	163	131.7 Å²	131.7	76%	0.762	69%	0.692	S	S	*	*			trans	86.6	105.3	163.5	-65.3	-74.2	84.2	0	0	121.4
493	E	35	Very low	38.2	Very low	163 Å²	163	128.9 Å²	128.9	76%	0.762	68%	0.676	S	S	*	*			trans	58.6	99.3	132.6	-67.1	-90.5	98.3	0	0	121.6
494	R	34.7	Very low	39.6	Very low	236 Å²	236	128.6 Å²	128.6	89%	0.891	67%	0.665	S	S	*	*			trans	-139.8	136.4	149.7	-159.7	166.9	-171.8	-124.8	-1.6	110.5
495	P	33.9	Very low	41	Very low	107 Å²	107	125 Å²	125	70%	0.695	65%	0.647	S	S	*	*			trans	-74.7	139.3	-153.1	25.2	-35.6	0	0	0	115.7	A497	P495-A497 PolarHBondContact O-N 3.4Å
496	K	34.2	Very low	42.4	Very low	173 Å²	173	122.3 Å²	122.3	75%	0.752	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	33.8	-176.8	-59.8	165.7	-177.9	162.2	0	114	Y499	K496-Y499 HydrophobicContact CB-CE1 4.17Å; K496-Y499 WeakPolarHBondContact O-CD1 3.5Å; K496-Y499 WeakPolarHBondContact O-CE1 3.33Å
497	A	34.6	Very low	44.2	Very low	63 Å²	63	121.3 Å²	121.3	52%	0.521	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-18	-171.5	0	0	0	0	0	115	P495 T501	P495-A497 PolarHBondContact O-N 3.4Å; A497-T501 PolarHBondContact O-OG1 3.46Å
498	S	41.1	Very low	46	Very low	86 Å²	86	118.4 Å²	118.4	60%	0.601	61%	0.608	S	S	*	*	H	α-helix	trans	-75.9	-38.6	-175.2	50.9	0	0	0	0	113.8	I502	S498-I502 WeakPolarHBondContact O-CG1 3.43Å; S498-I502 PolarHBondContact O-N 3.15Å
499	Y	41.1	Very low	48.4	Very low	152 Å²	152	111.2 Å²	111.2	60%	0.596	58%	0.575	S	S	*	*	H	α-helix	trans	-66.7	-46.5	-172.6	82.8	-85.2	0	0	0	112.5	K496 T501 I502 S503	K496-Y499 HydrophobicContact CB-CE1 4.17Å; K496-Y499 WeakPolarHBondContact O-CD1 3.5Å; K496-Y499 WeakPolarHBondContact O-CE1 3.33Å; Y499-T501 VanDerWaalsContact C-N 3.28Å; Y499-T501 PolarHBondContact O-N 2.82Å; Y499-I502 PolarHBondContact O-N 3.24Å; Y499-I502 VanDerWaalsContact O-N 3.09Å; Y499-S503 PolarHBondContact O-N 3.3Å
500	T	43.7	Very low	50.8	Low	62 Å²	62	104.5 Å²	104.5	38%	0.38	54%	0.539	S	S	.	.	H	α-helix	trans	-59.9	-39	-177.2	-26.2	0	0	0	0	112.2	I502 L504	T500-I502 VanDerWaalsContact C-N 3.3Å; T500-I502 PolarHBondContact O-N 3.38Å; T500-L504 WeakPolarHBondContact O-CG 3.47Å; T500-L504 PolarHBondContact O-N 2.95Å
501	T	48.9	Very low	53.2	Low	86 Å²	86	102.6 Å²	102.6	53%	0.528	52%	0.522	S	S	.	.	H	α-helix	trans	-69.1	-29.6	-179.4	-48.4	0	0	0	0	111.9	A497 Y499 L505	A497-T501 PolarHBondContact O-OG1 3.46Å; Y499-T501 VanDerWaalsContact C-N 3.28Å; Y499-T501 PolarHBondContact O-N 2.82Å; T501-L505 WeakPolarHBondContact O-CD1 3.38Å; T501-L505 VanDerWaalsContact O-CG 3.32Å; T501-L505 WeakPolarHBondContact O-CG 3.35Å; T501-L505 PolarHBondContact O-N 2.97Å
502	I	53.7	Low	55.6	Low	72 Å²	72	100.9 Å²	100.9	37%	0.369	50%	0.504	S	S	.	.	H	α-helix	trans	-78.6	-46.5	179.7	-65.4	168.8	0	0	0	110.7	S498 Y499 T500 L504 L505 E506	S498-I502 WeakPolarHBondContact O-CG1 3.43Å; S498-I502 PolarHBondContact O-N 3.15Å; Y499-I502 PolarHBondContact O-N 3.24Å; Y499-I502 VanDerWaalsContact O-N 3.09Å; T500-I502 VanDerWaalsContact C-N 3.3Å; T500-I502 PolarHBondContact O-N 3.38Å; I502-L504 VanDerWaalsContact C-N 3.35Å; I502-L504 PolarHBondContact O-N 3.22Å; I502-L505 WeakPolarHBondContact O-CA 3.4Å; I502-L505 WeakPolarHBondContact O-CB 3.24Å; I502-L505 PolarHBondContact O-N 3.33Å; I502-E506 PolarHBondContact O-N 3.36Å
503	S	57	Low	57.9	Low	67 Å²	67	101.6 Å²	101.6	47%	0.469	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-39.6	178	-60	0	0	0	0	112.8	Y499 L505 E506 E507	Y499-S503 PolarHBondContact O-N 3.3Å; S503-L505 PolarHBondContact O-N 3.3Å; S503-E506 PolarHBondContact O-N 3.41Å; S503-E506 VanDerWaalsContact O-N 3.07Å; S503-E507 PolarHBondContact O-N 3.34Å
504	L	59.9	Low	60.3	Low	96 Å²	96	98.5 Å²	98.5	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-63.2	-25.7	173.8	-78.4	167.8	0	0	0	113.4	T500 I502 Q508	T500-L504 WeakPolarHBondContact O-CG 3.47Å; T500-L504 PolarHBondContact O-N 2.95Å; I502-L504 VanDerWaalsContact C-N 3.35Å; I502-L504 PolarHBondContact O-N 3.22Å; L504-Q508 WeakPolarHBondContact O-CG 3.4Å
505	L	60.9	Low	62.9	Low	71 Å²	71	89.4 Å²	89.4	37%	0.372	46%	0.46	S	S	.	.	H	α-helix	trans	-81.6	-28.2	172.5	-73	169.8	0	0	0	112.4	T501 I502 S503 L509	T501-L505 WeakPolarHBondContact O-CD1 3.38Å; T501-L505 VanDerWaalsContact O-CG 3.32Å; T501-L505 WeakPolarHBondContact O-CG 3.35Å; T501-L505 PolarHBondContact O-N 2.97Å; I502-L505 WeakPolarHBondContact O-CA 3.4Å; I502-L505 WeakPolarHBondContact O-CB 3.24Å; I502-L505 PolarHBondContact O-N 3.33Å; S503-L505 PolarHBondContact O-N 3.3Å; L505-L509 WeakPolarHBondContact O-CD1 3.35Å; L505-L509 WeakPolarHBondContact O-CD2 3.46Å
506	E	65.4	Low	65.5	Low	59 Å²	59	85.5 Å²	85.5	28%	0.276	44%	0.435	S	S	.	.	H	α-helix	trans	-69	-39	176.6	-71.5	-177.4	-171.5	0	0	112.2	I502 S503 Q508 L509 L544	I502-E506 PolarHBondContact O-N 3.36Å; S503-E506 PolarHBondContact O-N 3.41Å; S503-E506 VanDerWaalsContact O-N 3.07Å; E506-Q508 VanDerWaalsContact C-N 3.33Å; E506-Q508 PolarHBondContact O-N 3.17Å; E506-L509 PolarHBondContact O-N 3.24Å; E506-L544 HydrophobicContact CG-CD1 4.11Å
507	E	67.8	Low	68.3	Low	132 Å²	132	77.3 Å²	77.3	62%	0.617	40%	0.399	S	S	*	.	H	α-helix	trans	-63.3	-36.2	175.9	-66.1	-173	155.6	0	0	112.8	S503 L509	S503-E507 PolarHBondContact O-N 3.34Å; E507-L509 PolarHBondContact O-N 3.18Å
508	Q	73.5	Confident	70.9	Confident	135 Å²	135	78.4 Å²	78.4	63%	0.631	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-4.6	177.7	-68.5	178.9	10.6	0	0	114	L504 E506	L504-Q508 WeakPolarHBondContact O-CG 3.4Å; E506-Q508 VanDerWaalsContact C-N 3.33Å; E506-Q508 PolarHBondContact O-N 3.17Å
509	L	80.9	Confident	73.1	Confident	19 Å²	19	75.5 Å²	75.5	10%	0.099	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	12.8	-173.5	-84.3	38.1	0	0	0	111.9	L505 E506 E507 L518 L519 K547	L505-L509 WeakPolarHBondContact O-CD1 3.35Å; L505-L509 WeakPolarHBondContact O-CD2 3.46Å; E506-L509 PolarHBondContact O-N 3.24Å; E507-L509 PolarHBondContact O-N 3.18Å; L509-L518 WeakPolarHBondContact O-CB 3.26Å; L509-L518 PolarHBondContact O-N 3.17Å; L509-L519 HydrophobicContact CB-CD1 4.22Å; L509-L519 HydrophobicContact CB-CG 4.15Å; L509-L519 HydrophobicContact CD2-CD1 3.83Å; L509-L519 HydrophobicContact CD2-CD2 4.22Å; L509-L519 HydrophobicContact CD2-CG 3.86Å; L509-L519 HydrophobicContact CG-CD1 4.42Å; L509-L519 HydrophobicContact CG-CG 4.11Å; L509-K547 HydrophobicContact CD2-CD 3.97Å
510	V	86.9	Confident	75.5	Confident	10 Å²	10	69 Å²	69	6%	0.061	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	120.8	179.5	-178.5	0	0	0	0	110.6	W512 L530	V510-W512 HydrophobicContact CG1-CD2 4.09Å; V510-W512 HydrophobicContact CG1-CE3 4.29Å; V510-W512 HydrophobicContact CG1-CH2 4.37Å; V510-W512 HydrophobicContact CG1-CZ2 4.18Å; V510-W512 HydrophobicContact CG1-CZ3 4.41Å; V510-W512 PolarHBondContact O-N 3.35Å; V510-L530 HydrophobicContact CG1-CD1 4.28Å; V510-L530 HydrophobicContact CG1-CD2 3.69Å; V510-L530 HydrophobicContact CG1-CG 4.19Å
511	D	89	Confident	77.6	Confident	48 Å²	48	77.2 Å²	77.2	26%	0.257	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	95.1	176.8	-129.7	29.4	0	0	0	108.8	E513 K514 L515 T516 L518	D511-E513 PolarHBondContact O-N 2.56Å; D511-K514 PolarHBondContact O-N 2.79Å; D511-K514 WeakPolarHBondContact OD2-CD 3.13Å; D511-K514 WeakPolarHBondContact OD2-CE 3.48Å; D511-K514 IonicContact OD2-NZ 3.17Å; D511-K514 PolarHBondContact OD2-NZ 2.89Å; D511-L515 PolarHBondContact O-N 2.93Å; D511-L515 VanDerWaalsContact O-N 3.09Å; D511-T516 WeakPolarHBondContact CB-OG1 3.37Å; D511-T516 PolarHBondContact N-O 3.28Å; D511-T516 PolarHBondContact O-N 3.06Å; D511-T516 VanDerWaalsContact O-N 3.09Å; D511-L518 HydrophobicContact CB-CD1 4.34Å; D511-L518 HydrophobicContact CB-CD2 3.95Å; D511-L518 HydrophobicContact CB-CG 4.13Å
512	W	86.9	Confident	79.5	Confident	118 Å²	118	79.4 Å²	79.4	45%	0.447	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-64.5	-38.8	-173	-65.4	103	0	0	0	113.6	V510 K514 L515 K527 L530 L531	V510-W512 HydrophobicContact CG1-CD2 4.09Å; V510-W512 HydrophobicContact CG1-CE3 4.29Å; V510-W512 HydrophobicContact CG1-CH2 4.37Å; V510-W512 HydrophobicContact CG1-CZ2 4.18Å; V510-W512 HydrophobicContact CG1-CZ3 4.41Å; V510-W512 PolarHBondContact O-N 3.35Å; W512-K514 PolarHBondContact O-N 2.84Å; W512-L515 PolarHBondContact O-N 2.82Å; W512-K527 HydrophobicContact CZ3-CD 4.42Å; W512-K527 HydrophobicContact CZ3-CG 4.01Å; W512-L530 HydrophobicContact CE3-CD2 4.4Å; W512-L530 HydrophobicContact CZ3-CD2 4.34Å; W512-L531 HydrophobicContact CH2-CD2 4.33Å
513	E	85.9	Confident	81.2	Confident	178 Å²	178	82.9 Å²	82.9	83%	0.832	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-58.9	-34.4	179.3	-61.7	-178.8	154.9	0	0	113.3	D511	D511-E513 PolarHBondContact O-N 2.56Å
514	K	85.3	Confident	82.9	Confident	99 Å²	99	81.7 Å²	81.7	43%	0.43	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-102.9	-5	-174.8	-55.1	-177.9	-165.8	68.1	0	112.2	D511 W512 T516 Q523	D511-K514 PolarHBondContact O-N 2.79Å; D511-K514 WeakPolarHBondContact OD2-CD 3.13Å; D511-K514 WeakPolarHBondContact OD2-CE 3.48Å; D511-K514 IonicContact OD2-NZ 3.17Å; D511-K514 PolarHBondContact OD2-NZ 2.89Å; W512-K514 PolarHBondContact O-N 2.84Å; K514-T516 HydrophobicContact CB-CG2 4.01Å; K514-T516 PolarHBondContact O-N 3.15Å; K514-Q523 WeakPolarHBondContact O-CG 3.41Å; K514-Q523 PolarHBondContact O-NE2 2.76Å
515	L	89.7	Confident	84.3	Confident	44 Å²	44	86.4 Å²	86.4	23%	0.23	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	42.5	-166.4	-61.6	175.5	0	0	0	112.4	D511 W512 F524 L530	D511-L515 PolarHBondContact O-N 2.93Å; D511-L515 VanDerWaalsContact O-N 3.09Å; W512-L515 PolarHBondContact O-N 2.82Å; L515-F524 WeakPolarHBondContact CB-O 3.4Å; L515-F524 PolarHBondContact O-N 2.92Å; L515-L530 HydrophobicContact CB-CD2 4.34Å; L515-L530 HydrophobicContact CD2-CD2 4.05Å
516	T	89.9	Confident	85.7	Confident	26 Å²	26	84.9 Å²	84.9	16%	0.16	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.8	-178.2	49.7	0	0	0	0	113.2	D511 K514 L518 R522 Q523	D511-T516 WeakPolarHBondContact CB-OG1 3.37Å; D511-T516 PolarHBondContact N-O 3.28Å; D511-T516 PolarHBondContact O-N 3.06Å; D511-T516 VanDerWaalsContact O-N 3.09Å; K514-T516 HydrophobicContact CB-CG2 4.01Å; K514-T516 PolarHBondContact O-N 3.15Å; T516-L518 PolarHBondContact O-N 3.22Å; T516-R522 VanDerWaalsContact CA-O 3.28Å; T516-R522 WeakPolarHBondContact CA-O 3.36Å; T516-Q523 HydrophobicContact CG2-CB 3.67Å; T516-Q523 HydrophobicContact CG2-CG 3.88Å
517	C	92.9	Very high	87	Confident	1 Å²	1	87.9 Å²	87.9	1%	0.007	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113.4	169	-179	0	0	0	0	109.7	L519 C520 R521 R522 F524 L530 H540	C517-L519 VanDerWaalsContact C-N 3.34Å; C517-L519 PolarHBondContact O-N 3.04Å; C517-C520 HydrophobicContact CB-CB 4.19Å; C517-C520 PolarHBondContact O-N 2.74Å; C517-C520 VanDerWaalsContact O-N 3.16Å; C517-R521 WeakPolarHBondContact O-CA 3.47Å; C517-R521 PolarHBondContact O-N 3.46Å; C517-R522 PolarHBondContact N-O 2.93Å; C517-F524 HydrophobicContact CB-CE2 4.19Å; C517-L530 HydrophobicContact CB-CD1 3.93Å; C517-H540 PolarHBondContact SG-ND1 3.07Å; C517-H540 VanDerWaalsContact SG-ND1 3.35Å
518	L	87.5	Confident	88.1	Confident	85 Å²	85	86.4 Å²	86.4	45%	0.445	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-29.2	-175.1	-60.5	176.3	0	0	0	112.4	L509 D511 T516 C520	L509-L518 WeakPolarHBondContact O-CB 3.26Å; L509-L518 PolarHBondContact O-N 3.17Å; D511-L518 HydrophobicContact CB-CD1 4.34Å; D511-L518 HydrophobicContact CB-CD2 3.95Å; D511-L518 HydrophobicContact CB-CG 4.13Å; T516-L518 PolarHBondContact O-N 3.22Å; L518-C520 VanDerWaalsContact C-N 3.28Å; L518-C520 PolarHBondContact O-N 3.43Å
519	L	89	Confident	88.9	Confident	26 Å²	26	82.7 Å²	82.7	14%	0.136	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-36.1	169.2	-89.8	169.3	0	0	0	112.9	L509 C517 H540 N543 L544 K547	L509-L519 HydrophobicContact CB-CD1 4.22Å; L509-L519 HydrophobicContact CB-CG 4.15Å; L509-L519 HydrophobicContact CD2-CD1 3.83Å; L509-L519 HydrophobicContact CD2-CD2 4.22Å; L509-L519 HydrophobicContact CD2-CG 3.86Å; L509-L519 HydrophobicContact CG-CD1 4.42Å; L509-L519 HydrophobicContact CG-CG 4.11Å; C517-L519 VanDerWaalsContact C-N 3.34Å; C517-L519 PolarHBondContact O-N 3.04Å; L519-H540 VanDerWaalsContact CD1-CE1 3.46Å; L519-H540 WeakPolarHBondContact CD1-CE1 3.46Å; L519-N543 HydrophobicContact CD2-CB 4.17Å; L519-N543 PolarHBondContact O-ND2 2.87Å; L519-L544 HydrophobicContact CD1-CB 4.08Å; L519-L544 HydrophobicContact CD1-CD1 4.13Å; L519-L544 HydrophobicContact CD1-CG 4.4Å; L519-K547 HydrophobicContact CD2-CB 4.28Å; L519-K547 HydrophobicContact CD2-CD 4.01Å
520	C	90.2	Very high	89.4	Confident	14 Å²	14	81.9 Å²	81.9	10%	0.095	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-12.1	-169	-63.7	0	0	0	0	113.8	C517 L518 R522 H533 L539 H540	C517-C520 HydrophobicContact CB-CB 4.19Å; C517-C520 PolarHBondContact O-N 2.74Å; C517-C520 VanDerWaalsContact O-N 3.16Å; L518-C520 VanDerWaalsContact C-N 3.28Å; L518-C520 PolarHBondContact O-N 3.43Å; C520-R522 PolarHBondContact O-N 2.86Å; C520-H533 VanDerWaalsContact CB-NE2 3.32Å; C520-H533 WeakPolarHBondContact CB-NE2 3.35Å; C520-H533 VanDerWaalsContact SG-CE1 3.54Å; C520-H533 PolarHBondContact SG-NE2 2.83Å; C520-L539 HydrophobicContact CB-CD2 3.76Å; C520-L539 VanDerWaalsContact SG-CD2 3.52Å; C520-H540 VanDerWaalsContact SG-CA 3.54Å
521	R	88	Confident	89.7	Confident	235 Å²	235	84.1 Å²	84.1	89%	0.887	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	41.2	-174	-57	-176.2	-177.2	172.6	2.5	112.8	C517	C517-R521 WeakPolarHBondContact O-CA 3.47Å; C517-R521 PolarHBondContact O-N 3.46Å
522	R	88.6	Confident	89.8	Confident	132 Å²	132	88.2 Å²	88.2	50%	0.498	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	137.2	177.8	-71.1	-178.7	-178.7	-138.1	-1.8	110.2	T516 C517 C520 F524	T516-R522 VanDerWaalsContact CA-O 3.28Å; T516-R522 WeakPolarHBondContact CA-O 3.36Å; C517-R522 PolarHBondContact N-O 2.93Å; C520-R522 PolarHBondContact O-N 2.86Å; R522-F524 HydrophobicContact CB-CE2 3.62Å; R522-F524 HydrophobicContact CB-CZ 3.82Å; R522-F524 WeakPolarHBondContact O-CD2 3.23Å; R522-F524 WeakPolarHBondContact O-CE2 3.47Å
523	Q	90.9	Very high	90.1	Very high	145 Å²	145	83.2 Å²	83.2	68%	0.678	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	147.1	170.9	-170.5	164.5	33.3	0	0	110.3	K514 T516	K514-Q523 WeakPolarHBondContact O-CG 3.41Å; K514-Q523 PolarHBondContact O-NE2 2.76Å; T516-Q523 HydrophobicContact CG2-CB 3.67Å; T516-Q523 HydrophobicContact CG2-CG 3.88Å
524	F	91.7	Very high	90.3	Very high	42 Å²	42	77 Å²	77	18%	0.184	36%	0.359	C	S	.	.			trans	-126.2	150.9	-176.9	-67.8	-88	0	0	0	111	L515 C517 R522 L530 H533	L515-F524 WeakPolarHBondContact CB-O 3.4Å; L515-F524 PolarHBondContact O-N 2.92Å; C517-F524 HydrophobicContact CB-CE2 4.19Å; R522-F524 HydrophobicContact CB-CE2 3.62Å; R522-F524 HydrophobicContact CB-CZ 3.82Å; R522-F524 WeakPolarHBondContact O-CD2 3.23Å; R522-F524 WeakPolarHBondContact O-CE2 3.47Å; F524-L530 HydrophobicContact CB-CB 3.97Å; F524-L530 HydrophobicContact CD2-CB 4.3Å; F524-L530 HydrophobicContact CD2-CD1 3.58Å; F524-L530 HydrophobicContact CE2-CD1 4.04Å; F524-L530 HydrophobicContact CG-CB 4.13Å; F524-L530 HydrophobicContact CG-CD1 4.27Å; F524-H533 HydrophobicContact CD1-CB 4.33Å; F524-H533 HydrophobicContact CE1-CB 3.55Å; F524-H533 AromaticContact CE1-CG 3.77Å; F524-H533 HydrophobicContact CE2-CB 4.2Å; F524-H533 AromaticContact CE2-CD2 3.52Å; F524-H533 AromaticContact CE2-CG 3.83Å; F524-H533 HydrophobicContact CZ-CB 3.49Å; F524-H533 VanDerWaalsContact CZ-CB 3.49Å; F524-H533 AromaticContact CZ-CD2 3.35Å; F524-H533 WeakPolarHBondContact CZ-CD2 3.41Å; F524-H533 AromaticContact CZ-CG 3.18Å; F524-H533 AromaticContact CZ-ND1 3.63Å; F524-H533 AromaticContact CZ-NE2 3.88Å
525	Q	88.8	Confident	90.5	Very high	195 Å²	195	78.1 Å²	78.1	91%	0.911	37%	0.365	S	S	*	.	S	Bend	trans	-81.2	-23.4	-174.5	-65.7	176.6	-4.6	0	0	113
526	S	91.1	Very high	90.4	Very high	40 Å²	40	83 Å²	83	28%	0.28	39%	0.385	S	S	.	.	S	Bend	trans	-144.9	159.1	178.6	76.7	0	0	0	0	111.8	D528 T529 L530	S526-D528 PolarHBondContact O-N 3.4Å; S526-D528 PolarHBondContact OG-N 2.94Å; S526-T529 PolarHBondContact N-OG1 3.27Å; S526-T529 VanDerWaalsContact N-OG1 3.13Å; S526-T529 PolarHBondContact O-N 3.07Å; S526-T529 PolarHBondContact O-OG1 3.03Å; S526-T529 PolarHBondContact OG-N 3.02Å; S526-T529 PolarHBondContact OG-OG1 3.34Å; S526-L530 PolarHBondContact O-N 2.82Å
527	K	91.7	Very high	90.5	Very high	122 Å²	122	83.2 Å²	83.2	53%	0.53	39%	0.388	S	S	.	.	H	α-helix	trans	-54.3	-39.3	173.7	-167	-179.4	-179.4	-179.3	0	112	W512 L530 L531	W512-K527 HydrophobicContact CZ3-CD 4.42Å; W512-K527 HydrophobicContact CZ3-CG 4.01Å; K527-L530 WeakPolarHBondContact O-CB 3.49Å; K527-L530 PolarHBondContact O-N 3.29Å; K527-L531 HydrophobicContact CG-CD1 4.21Å; K527-L531 WeakPolarHBondContact O-CG 3.44Å; K527-L531 PolarHBondContact O-N 2.95Å
528	D	91.1	Very high	90.4	Very high	100 Å²	100	88 Å²	88	54%	0.535	41%	0.41	S	S	.	.	H	α-helix	trans	-71.9	-33.4	-177.5	-43.5	-54.4	0	0	0	112.6	S526 K532	S526-D528 PolarHBondContact O-N 3.4Å; S526-D528 PolarHBondContact OG-N 2.94Å; D528-K532 WeakPolarHBondContact O-CB 3.37Å; D528-K532 VanDerWaalsContact O-CG 3.23Å; D528-K532 WeakPolarHBondContact O-CG 3.42Å; D528-K532 PolarHBondContact O-N 3.31Å
529	T	91.6	Very high	90.5	Very high	58 Å²	58	87.1 Å²	87.1	36%	0.356	41%	0.405	S	S	.	.	H	α-helix	trans	-71.1	-32.8	174.4	53.4	0	0	0	0	111.9	S526 H533	S526-T529 PolarHBondContact N-OG1 3.27Å; S526-T529 VanDerWaalsContact N-OG1 3.13Å; S526-T529 PolarHBondContact O-N 3.07Å; S526-T529 PolarHBondContact O-OG1 3.03Å; S526-T529 PolarHBondContact OG-N 3.02Å; S526-T529 PolarHBondContact OG-OG1 3.34Å; T529-H533 WeakPolarHBondContact O-CB 3.25Å; T529-H533 PolarHBondContact O-N 3.43Å
530	L	91.8	Very high	90.7	Very high	2 Å²	2	86.1 Å²	86.1	1%	0.01	40%	0.4	C	S	.	.	H	α-helix	trans	-68.2	-44.4	172	178.4	59.9	0	0	0	112.3	V510 W512 L515 C517 F524 S526 K527 H533 Q534	V510-L530 HydrophobicContact CG1-CD1 4.28Å; V510-L530 HydrophobicContact CG1-CD2 3.69Å; V510-L530 HydrophobicContact CG1-CG 4.19Å; W512-L530 HydrophobicContact CE3-CD2 4.4Å; W512-L530 HydrophobicContact CZ3-CD2 4.34Å; L515-L530 HydrophobicContact CB-CD2 4.34Å; L515-L530 HydrophobicContact CD2-CD2 4.05Å; C517-L530 HydrophobicContact CB-CD1 3.93Å; F524-L530 HydrophobicContact CB-CB 3.97Å; F524-L530 HydrophobicContact CD2-CB 4.3Å; F524-L530 HydrophobicContact CD2-CD1 3.58Å; F524-L530 HydrophobicContact CE2-CD1 4.04Å; F524-L530 HydrophobicContact CG-CB 4.13Å; F524-L530 HydrophobicContact CG-CD1 4.27Å; S526-L530 PolarHBondContact O-N 2.82Å; K527-L530 WeakPolarHBondContact O-CB 3.49Å; K527-L530 PolarHBondContact O-N 3.29Å; L530-H533 WeakPolarHBondContact O-CB 3.44Å; L530-H533 PolarHBondContact O-N 3.49Å; L530-Q534 PolarHBondContact O-N 2.93Å
531	L	91.3	Very high	90.7	Very high	56 Å²	56	89.5 Å²	89.5	29%	0.293	41%	0.413	S	S	.	.	H	α-helix	trans	-64	-45.1	175.4	-72.5	168.4	0	0	0	111.9	W512 K527 H533 Q534 Q535	W512-L531 HydrophobicContact CH2-CD2 4.33Å; K527-L531 HydrophobicContact CG-CD1 4.21Å; K527-L531 WeakPolarHBondContact O-CG 3.44Å; K527-L531 PolarHBondContact O-N 2.95Å; L531-H533 PolarHBondContact O-N 2.98Å; L531-Q534 PolarHBondContact O-N 3.12Å; L531-Q535 WeakPolarHBondContact O-CG 3.43Å; L531-Q535 PolarHBondContact O-N 3.39Å
532	K	92.4	Very high	90.7	Very high	134 Å²	134	84.7 Å²	84.7	58%	0.583	40%	0.398	S	S	*	.	H	α-helix	trans	-60.9	-33.4	173.3	-73.6	171.5	-178.6	178.9	0	112	D528 F536	D528-K532 WeakPolarHBondContact O-CB 3.37Å; D528-K532 VanDerWaalsContact O-CG 3.23Å; D528-K532 WeakPolarHBondContact O-CG 3.42Å; D528-K532 PolarHBondContact O-N 3.31Å; K532-F536 HydrophobicContact CB-CD2 4.31Å; K532-F536 WeakPolarHBondContact O-CB 3.49Å; K532-F536 WeakPolarHBondContact O-CD2 3.1Å; K532-F536 PolarHBondContact O-N 3.43Å
533	H	93.2	Very high	90.8	Very high	13 Å²	13	79.9 Å²	79.9	6%	0.06	38%	0.382	C	S	.	.	H	α-helix	trans	-66.9	-44.1	173.5	168.8	66.4	0	0	0	112.8	C520 F524 T529 L530 L531 S537 H540	C520-H533 VanDerWaalsContact CB-NE2 3.32Å; C520-H533 WeakPolarHBondContact CB-NE2 3.35Å; C520-H533 VanDerWaalsContact SG-CE1 3.54Å; C520-H533 PolarHBondContact SG-NE2 2.83Å; F524-H533 HydrophobicContact CD1-CB 4.33Å; F524-H533 HydrophobicContact CE1-CB 3.55Å; F524-H533 AromaticContact CE1-CG 3.77Å; F524-H533 HydrophobicContact CE2-CB 4.2Å; F524-H533 AromaticContact CE2-CD2 3.52Å; F524-H533 AromaticContact CE2-CG 3.83Å; F524-H533 HydrophobicContact CZ-CB 3.49Å; F524-H533 VanDerWaalsContact CZ-CB 3.49Å; F524-H533 AromaticContact CZ-CD2 3.35Å; F524-H533 WeakPolarHBondContact CZ-CD2 3.41Å; F524-H533 AromaticContact CZ-CG 3.18Å; F524-H533 AromaticContact CZ-ND1 3.63Å; F524-H533 AromaticContact CZ-NE2 3.88Å; T529-H533 WeakPolarHBondContact O-CB 3.25Å; T529-H533 PolarHBondContact O-N 3.43Å; L530-H533 WeakPolarHBondContact O-CB 3.44Å; L530-H533 PolarHBondContact O-N 3.49Å; L531-H533 PolarHBondContact O-N 2.98Å; H533-S537 WeakPolarHBondContact ND1-CB 3.46Å; H533-S537 PolarHBondContact ND1-OG 2.84Å; H533-S537 WeakPolarHBondContact O-CB 3.23Å; H533-S537 PolarHBondContact O-N 3.03Å; H533-S537 VanDerWaalsContact O-N 3.08Å; H533-H540 AromaticContact NE2-ND1 3.93Å
534	Q	90.5	Very high	90.7	Very high	48 Å²	48	74.2 Å²	74.2	22%	0.224	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-45.7	176	-178.7	173.2	-1.3	0	0	111.5	L530 L531	L530-Q534 PolarHBondContact O-N 2.93Å; L531-Q534 PolarHBondContact O-N 3.12Å
535	Q	89.4	Confident	90.3	Very high	122 Å²	122	78.2 Å²	78.2	57%	0.57	38%	0.376	S	S	*	.	H	α-helix	trans	-72.8	-45.4	-176.9	-68.7	171.9	-15.2	0	0	113.6	L531	L531-Q535 WeakPolarHBondContact O-CG 3.43Å; L531-Q535 PolarHBondContact O-N 3.39Å
536	F	87.8	Confident	90.1	Very high	148 Å²	148	76 Å²	76	65%	0.649	36%	0.36	S	S	*	.	H	α-helix	trans	-111.4	-8.4	-165.5	-57.9	-73	0	0	0	115.2	K532 E538	K532-F536 HydrophobicContact CB-CD2 4.31Å; K532-F536 WeakPolarHBondContact O-CB 3.49Å; K532-F536 WeakPolarHBondContact O-CD2 3.1Å; K532-F536 PolarHBondContact O-N 3.43Å; F536-E538 PolarHBondContact O-N 3.16Å
537	S	91.8	Very high	89.6	Confident	30 Å²	30	77.8 Å²	77.8	21%	0.21	36%	0.362	C	S	.	.			trans	-84.8	116.4	-174.4	-163	0	0	0	0	113.4	H533 L539 H540 K541	H533-S537 WeakPolarHBondContact ND1-CB 3.46Å; H533-S537 PolarHBondContact ND1-OG 2.84Å; H533-S537 WeakPolarHBondContact O-CB 3.23Å; H533-S537 PolarHBondContact O-N 3.03Å; H533-S537 VanDerWaalsContact O-N 3.08Å; S537-L539 PolarHBondContact O-N 3.22Å; S537-L539 VanDerWaalsContact O-N 3.13Å; S537-H540 WeakPolarHBondContact O-CA 3.4Å; S537-H540 WeakPolarHBondContact O-CB 3.45Å; S537-H540 PolarHBondContact O-N 3.3Å; S537-K541 PolarHBondContact O-N 2.96Å; S537-K541 VanDerWaalsContact O-N 3.07Å
538	E	90	Very high	89	Confident	102 Å²	102	75.7 Å²	75.7	48%	0.477	35%	0.354	S	S	.	.	H	α-helix	trans	-54.3	-30.1	172.4	-69.2	-55.5	118.8	0	0	114	F536 K541 K542	F536-E538 PolarHBondContact O-N 3.16Å; E538-K541 WeakPolarHBondContact OE1-CD 3.22Å; E538-K541 WeakPolarHBondContact OE1-CE 3.41Å; E538-K541 IonicContact OE1-NZ 2.7Å; E538-K541 PolarHBondContact OE1-NZ 3.47Å; E538-K542 WeakPolarHBondContact O-CB 3.33Å; E538-K542 VanDerWaalsContact O-CG 3.3Å; E538-K542 WeakPolarHBondContact O-CG 3.46Å; E538-K542 PolarHBondContact O-N 3.04Å; E538-K542 VanDerWaalsContact O-N 3.12Å
539	L	89.6	Confident	88	Confident	65 Å²	65	72.9 Å²	72.9	34%	0.34	35%	0.348	S	S	.	.	H	α-helix	trans	-69.7	-37.3	175.1	-169	154.8	0	0	0	111.4	C520 S537 N543	C520-L539 HydrophobicContact CB-CD2 3.76Å; C520-L539 VanDerWaalsContact SG-CD2 3.52Å; S537-L539 PolarHBondContact O-N 3.22Å; S537-L539 VanDerWaalsContact O-N 3.13Å; L539-N543 WeakPolarHBondContact O-CB 3.23Å; L539-N543 PolarHBondContact O-N 3.21Å; L539-N543 VanDerWaalsContact O-N 3.14Å
540	H	92.5	Very high	86.7	Confident	6 Å²	6	75.5 Å²	75.5	3%	0.028	36%	0.357	C	S	.	.	H	α-helix	trans	-66.4	-51.9	175	-171.8	97.9	0	0	0	110.7	C517 L519 C520 H533 S537 K542 N543 L544	C517-H540 PolarHBondContact SG-ND1 3.07Å; C517-H540 VanDerWaalsContact SG-ND1 3.35Å; L519-H540 VanDerWaalsContact CD1-CE1 3.46Å; L519-H540 WeakPolarHBondContact CD1-CE1 3.46Å; C520-H540 VanDerWaalsContact SG-CA 3.54Å; H533-H540 AromaticContact NE2-ND1 3.93Å; S537-H540 WeakPolarHBondContact O-CA 3.4Å; S537-H540 WeakPolarHBondContact O-CB 3.45Å; S537-H540 PolarHBondContact O-N 3.3Å; H540-K542 VanDerWaalsContact C-N 3.35Å; H540-K542 PolarHBondContact O-N 3.05Å; H540-N543 PolarHBondContact O-N 2.85Å; H540-L544 VanDerWaalsContact O-CB 3.31Å; H540-L544 WeakPolarHBondContact O-CB 3.37Å; H540-L544 PolarHBondContact O-N 2.77Å
541	K	90	Very high	85.1	Confident	85 Å²	85	78.2 Å²	78.2	37%	0.37	37%	0.374	S	S	.	.	H	α-helix	trans	-53	-48.7	178.1	-61.9	177.2	-169.8	169.1	0	112.3	S537 E538 L544 Q545	S537-K541 PolarHBondContact O-N 2.96Å; S537-K541 VanDerWaalsContact O-N 3.07Å; E538-K541 WeakPolarHBondContact OE1-CD 3.22Å; E538-K541 WeakPolarHBondContact OE1-CE 3.41Å; E538-K541 IonicContact OE1-NZ 2.7Å; E538-K541 PolarHBondContact OE1-NZ 3.47Å; K541-L544 PolarHBondContact O-N 2.97Å; K541-Q545 WeakPolarHBondContact O-CG 3.26Å; K541-Q545 PolarHBondContact O-N 3.13Å
542	K	89	Confident	83.3	Confident	133 Å²	133	79.6 Å²	79.6	58%	0.578	38%	0.384	S	S	*	.	H	α-helix	trans	-66.6	-38.6	-179.9	-71.4	174.4	-177.7	-179.9	0	113.1	E538 H540 R546	E538-K542 WeakPolarHBondContact O-CB 3.33Å; E538-K542 VanDerWaalsContact O-CG 3.3Å; E538-K542 WeakPolarHBondContact O-CG 3.46Å; E538-K542 PolarHBondContact O-N 3.04Å; E538-K542 VanDerWaalsContact O-N 3.12Å; H540-K542 VanDerWaalsContact C-N 3.35Å; H540-K542 PolarHBondContact O-N 3.05Å; K542-R546 PolarHBondContact O-N 2.83Å; K542-R546 VanDerWaalsContact O-N 3.16Å
543	N	90.1	Very high	81.3	Confident	31 Å²	31	79.1 Å²	79.1	17%	0.166	39%	0.388	C	S	.	.	H	α-helix	trans	-69.7	-36.1	175.1	-80	-14.9	0	0	0	112.2	L519 L539 H540 R546 K547	L519-N543 HydrophobicContact CD2-CB 4.17Å; L519-N543 PolarHBondContact O-ND2 2.87Å; L539-N543 WeakPolarHBondContact O-CB 3.23Å; L539-N543 PolarHBondContact O-N 3.21Å; L539-N543 VanDerWaalsContact O-N 3.14Å; H540-N543 PolarHBondContact O-N 2.85Å; N543-R546 PolarHBondContact O-N 3.46Å; N543-R546 PolarHBondContact OD1-NH2 3.27Å; N543-K547 WeakPolarHBondContact O-CB 3.49Å; N543-K547 PolarHBondContact O-N 3Å
544	L	88.8	Confident	79.3	Confident	27 Å²	27	82.1 Å²	82.1	14%	0.141	41%	0.411	C	S	.	.	H	α-helix	trans	-67.1	-45.5	177.3	-173.4	148.2	0	0	0	111.2	E506 L519 H540 K541 R546 K547 Q548	E506-L544 HydrophobicContact CG-CD1 4.11Å; L519-L544 HydrophobicContact CD1-CB 4.08Å; L519-L544 HydrophobicContact CD1-CD1 4.13Å; L519-L544 HydrophobicContact CD1-CG 4.4Å; H540-L544 VanDerWaalsContact O-CB 3.31Å; H540-L544 WeakPolarHBondContact O-CB 3.37Å; H540-L544 PolarHBondContact O-N 2.77Å; K541-L544 PolarHBondContact O-N 2.97Å; L544-R546 PolarHBondContact O-N 2.9Å; L544-K547 PolarHBondContact O-N 3.22Å; L544-Q548 HydrophobicContact CD2-CG 4.32Å; L544-Q548 WeakPolarHBondContact O-CG 3.42Å; L544-Q548 PolarHBondContact O-N 3.21Å
545	Q	83.9	Confident	77.1	Confident	126 Å²	126	83.1 Å²	83.1	59%	0.589	42%	0.423	S	S	*	.	H	α-helix	trans	-57.4	-46.1	172.3	-75	173.7	-18.7	0	0	112.6	K541 K547 Q548 G549	K541-Q545 WeakPolarHBondContact O-CG 3.26Å; K541-Q545 PolarHBondContact O-N 3.13Å; Q545-K547 VanDerWaalsContact C-N 3.34Å; Q545-K547 PolarHBondContact O-N 3.32Å; Q545-Q548 PolarHBondContact O-N 2.68Å; Q545-G549 PolarHBondContact O-N 2.78Å; Q545-G549 VanDerWaalsContact O-N 3.15Å
546	R	84.3	Confident	75.1	Confident	149 Å²	149	80.3 Å²	80.3	56%	0.562	41%	0.414	S	S	*	.	H	α-helix	trans	-60.6	-44.2	176	-176.2	179	63.4	-137.4	-18.5	111.5	K542 N543 L544 G549 E550	K542-R546 PolarHBondContact O-N 2.83Å; K542-R546 VanDerWaalsContact O-N 3.16Å; N543-R546 PolarHBondContact O-N 3.46Å; N543-R546 PolarHBondContact OD1-NH2 3.27Å; L544-R546 PolarHBondContact O-N 2.9Å; R546-G549 PolarHBondContact O-N 3.45Å; R546-E550 IonicContact NE-OE1 3.14Å; R546-E550 PolarHBondContact O-N 2.9Å
547	K	81.7	Confident	72.9	Confident	76 Å²	76	76 Å²	76	33%	0.33	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-35.7	-179.9	-165.9	-179.9	178.8	-174.2	0	112.2	L509 L519 N543 L544 Q545 G549 E550 T551	L509-K547 HydrophobicContact CD2-CD 3.97Å; L519-K547 HydrophobicContact CD2-CB 4.28Å; L519-K547 HydrophobicContact CD2-CD 4.01Å; N543-K547 WeakPolarHBondContact O-CB 3.49Å; N543-K547 PolarHBondContact O-N 3Å; L544-K547 PolarHBondContact O-N 3.22Å; Q545-K547 VanDerWaalsContact C-N 3.34Å; Q545-K547 PolarHBondContact O-N 3.32Å; K547-G549 VanDerWaalsContact C-N 3.32Å; K547-G549 PolarHBondContact O-N 3.11Å; K547-E550 PolarHBondContact O-N 3.26Å; K547-T551 WeakPolarHBondContact O-CG2 3.29Å; K547-T551 PolarHBondContact O-N 3.31Å; K547-T551 PolarHBondContact O-OG1 3.22Å
548	Q	77.9	Confident	70.6	Confident	79 Å²	79	79 Å²	79	37%	0.369	43%	0.427	S	S	.	.	H	α-helix	trans	-57.3	-47	171	-76.8	175.5	-16.6	0	0	110.7	L544 Q545 E550 T551 V552	L544-Q548 HydrophobicContact CD2-CG 4.32Å; L544-Q548 WeakPolarHBondContact O-CG 3.42Å; L544-Q548 PolarHBondContact O-N 3.21Å; Q545-Q548 PolarHBondContact O-N 2.68Å; Q548-E550 PolarHBondContact O-N 2.83Å; Q548-T551 WeakPolarHBondContact CA-OG1 3.26Å; Q548-T551 PolarHBondContact O-N 3.29Å; Q548-T551 VanDerWaalsContact O-N 3.12Å; Q548-T551 PolarHBondContact O-OG1 2.87Å; Q548-V552 VanDerWaalsContact O-CG2 3.25Å; Q548-V552 WeakPolarHBondContact O-CG2 3.5Å; Q548-V552 PolarHBondContact O-N 3.46Å
549	G	70.4	Confident	68.4	Low	40 Å²	40	77.2 Å²	77.2	41%	0.412	43%	0.429	S	S	.	.	H	α-helix	trans	-54.2	-50.4	172.2	0	0	0	0	0	113.5	Q545 R546 K547 T551 V552	Q545-G549 PolarHBondContact O-N 2.78Å; Q545-G549 VanDerWaalsContact O-N 3.15Å; R546-G549 PolarHBondContact O-N 3.45Å; K547-G549 VanDerWaalsContact C-N 3.32Å; K547-G549 PolarHBondContact O-N 3.11Å; G549-T551 VanDerWaalsContact C-N 3.25Å; G549-T551 PolarHBondContact O-N 2.93Å; G549-V552 PolarHBondContact O-N 2.9Å; G549-V552 VanDerWaalsContact O-N 3.14Å
550	E	65.1	Low	66.1	Low	114 Å²	114	79.2 Å²	79.2	53%	0.533	44%	0.438	S	S	.	.	H	α-helix	trans	-59	-33.2	176.5	-67.4	167.4	171.8	0	0	112.7	R546 K547 Q548 S554	R546-E550 IonicContact NE-OE1 3.14Å; R546-E550 PolarHBondContact O-N 2.9Å; K547-E550 PolarHBondContact O-N 3.26Å; Q548-E550 PolarHBondContact O-N 2.83Å; E550-S554 PolarHBondContact O-N 3.1Å
551	T	58.1	Low	63.9	Low	59 Å²	59	84.7 Å²	84.7	36%	0.362	47%	0.472	S	S	.	.	H	α-helix	trans	-75.4	-24.5	177.1	55	0	0	0	0	114.5	K547 Q548 G549 S555	K547-T551 WeakPolarHBondContact O-CG2 3.29Å; K547-T551 PolarHBondContact O-N 3.31Å; K547-T551 PolarHBondContact O-OG1 3.22Å; Q548-T551 WeakPolarHBondContact CA-OG1 3.26Å; Q548-T551 PolarHBondContact O-N 3.29Å; Q548-T551 VanDerWaalsContact O-N 3.12Å; Q548-T551 PolarHBondContact O-OG1 2.87Å; G549-T551 VanDerWaalsContact C-N 3.25Å; G549-T551 PolarHBondContact O-N 2.93Å; T551-S555 VanDerWaalsContact O-CB 3.29Å; T551-S555 WeakPolarHBondContact O-CB 3.29Å; T551-S555 PolarHBondContact O-N 2.88Å; T551-S555 PolarHBondContact O-OG 2.96Å
552	V	53.8	Low	61.7	Low	84 Å²	84	85.8 Å²	85.8	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-68.7	-48	175.1	-155.6	0	0	0	0	110.1	Q548 G549 S554 S555 V556	Q548-V552 VanDerWaalsContact O-CG2 3.25Å; Q548-V552 WeakPolarHBondContact O-CG2 3.5Å; Q548-V552 PolarHBondContact O-N 3.46Å; G549-V552 PolarHBondContact O-N 2.9Å; G549-V552 VanDerWaalsContact O-N 3.14Å; V552-S554 VanDerWaalsContact C-N 3.28Å; V552-S554 PolarHBondContact O-N 3.31Å; V552-S555 PolarHBondContact O-N 3.01Å; V552-S555 PolarHBondContact O-OG 2.9Å; V552-V556 HydrophobicContact CG1-CG2 4.21Å; V552-V556 VanDerWaalsContact O-CB 3.31Å; V552-V556 WeakPolarHBondContact O-CB 3.22Å; V552-V556 WeakPolarHBondContact O-CG2 3.46Å; V552-V556 PolarHBondContact O-N 3.35Å
553	D	49.5	Very low	59.4	Low	124 Å²	124	83.6 Å²	83.6	66%	0.663	49%	0.492	S	S	*	.	H	α-helix	trans	-56.7	-40.2	176.5	-85.7	-3.5	0	0	0	112.5	A557	D553-A557 WeakPolarHBondContact O-CB 3.25Å; D553-A557 PolarHBondContact O-N 3.4Å
554	S	50.2	Low	56.7	Low	77 Å²	77	93.4 Å²	93.4	54%	0.538	53%	0.528	S	S	.	.	H	α-helix	trans	-80.2	-36.1	-176.9	-166.5	0	0	0	0	114.1	E550 V552 S558	E550-S554 PolarHBondContact O-N 3.1Å; V552-S554 VanDerWaalsContact C-N 3.28Å; V552-S554 PolarHBondContact O-N 3.31Å; S554-S558 PolarHBondContact O-N 2.71Å; S554-S558 PolarHBondContact O-OG 2.95Å
555	S	44.9	Very low	54.4	Low	69 Å²	69	97.1 Å²	97.1	48%	0.483	56%	0.556	S	S	.	*	H	α-helix	trans	-73.1	-40.6	177.1	56.3	0	0	0	0	111.9	T551 V552 A557 S558 A559	T551-S555 VanDerWaalsContact O-CB 3.29Å; T551-S555 WeakPolarHBondContact O-CB 3.29Å; T551-S555 PolarHBondContact O-N 2.88Å; T551-S555 PolarHBondContact O-OG 2.96Å; V552-S555 PolarHBondContact O-N 3.01Å; V552-S555 PolarHBondContact O-OG 2.9Å; S555-A557 VanDerWaalsContact C-N 3.31Å; S555-A557 PolarHBondContact O-N 3.49Å; S555-S558 PolarHBondContact O-N 2.72Å; S555-A559 WeakPolarHBondContact O-CB 3.46Å; S555-A559 PolarHBondContact O-N 3.08Å
556	V	47.9	Very low	52.5	Low	62 Å²	62	95 Å²	95	38%	0.376	57%	0.568	S	S	.	*	H	α-helix	trans	-62.1	-39	173.9	173	0	0	0	0	111.1	V552 S558 A559 M560	V552-V556 HydrophobicContact CG1-CG2 4.21Å; V552-V556 VanDerWaalsContact O-CB 3.31Å; V552-V556 WeakPolarHBondContact O-CB 3.22Å; V552-V556 WeakPolarHBondContact O-CG2 3.46Å; V552-V556 PolarHBondContact O-N 3.35Å; V556-S558 VanDerWaalsContact C-N 3.33Å; V556-S558 PolarHBondContact O-N 3Å; V556-A559 PolarHBondContact O-N 3.02Å; V556-M560 HydrophobicContact CG1-CE 3.58Å; V556-M560 HydrophobicContact CG1-CG 4.06Å; V556-M560 HydrophobicContact CG1-SD 3.74Å; V556-M560 VanDerWaalsContact O-CB 3.29Å; V556-M560 WeakPolarHBondContact O-CB 3.49Å; V556-M560 VanDerWaalsContact O-CG 3.26Å; V556-M560 WeakPolarHBondContact O-CG 3.31Å; V556-M560 PolarHBondContact O-N 2.84Å
557	A	42.2	Very low	50.9	Low	59 Å²	59	99.1 Å²	99.1	49%	0.488	58%	0.584	S	S	.	*	H	α-helix	trans	-60.8	-38.4	174.8	0	0	0	0	0	113.2	D553 S555 T561	D553-A557 WeakPolarHBondContact O-CB 3.25Å; D553-A557 PolarHBondContact O-N 3.4Å; S555-A557 VanDerWaalsContact C-N 3.31Å; S555-A557 PolarHBondContact O-N 3.49Å; A557-T561 PolarHBondContact O-OG1 3.33Å
558	S	42.2	Very low	49.9	Very low	92 Å²	92	105.2 Å²	105.2	64%	0.643	61%	0.606	S	S	*	*	H	α-helix	trans	-76.2	-40.9	179	-60.2	0	0	0	0	112.1	S554 S555 V556	S554-S558 PolarHBondContact O-N 2.71Å; S554-S558 PolarHBondContact O-OG 2.95Å; S555-S558 PolarHBondContact O-N 2.72Å; V556-S558 VanDerWaalsContact C-N 3.33Å; V556-S558 PolarHBondContact O-N 3Å
559	A	44	Very low	49.6	Very low	64 Å²	64	108.6 Å²	108.6	53%	0.529	62%	0.616	S	S	.	*	H	α-helix	trans	-68.9	-35.5	178.7	0	0	0	0	0	113.4	S555 V556 T561 S562	S555-A559 WeakPolarHBondContact O-CB 3.46Å; S555-A559 PolarHBondContact O-N 3.08Å; V556-A559 PolarHBondContact O-N 3.02Å; A559-T561 PolarHBondContact O-N 2.56Å; A559-T561 VanDerWaalsContact O-N 3.07Å; A559-S562 PolarHBondContact O-OG 3.17Å
560	M	42.1	Very low	49.5	Very low	108 Å²	108	109.5 Å²	109.5	53%	0.532	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	-5.6	179.7	-79.7	-174.1	169.9	0	0	114.8	V556	V556-M560 HydrophobicContact CG1-CE 3.58Å; V556-M560 HydrophobicContact CG1-CG 4.06Å; V556-M560 HydrophobicContact CG1-SD 3.74Å; V556-M560 VanDerWaalsContact O-CB 3.29Å; V556-M560 WeakPolarHBondContact O-CB 3.49Å; V556-M560 VanDerWaalsContact O-CG 3.26Å; V556-M560 WeakPolarHBondContact O-CG 3.31Å; V556-M560 PolarHBondContact O-N 2.84Å
561	T	45.1	Very low	50	Low	121 Å²	121	113.3 Å²	113.3	74%	0.742	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-10.7	-175.1	-57	0	0	0	0	113.4	A557 A559	A557-T561 PolarHBondContact O-OG1 3.33Å; A559-T561 PolarHBondContact O-N 2.56Å; A559-T561 VanDerWaalsContact O-N 3.07Å
562	S	43.8	Very low	50.1	Low	107 Å²	107	112.9 Å²	112.9	75%	0.748	62%	0.623	S	S	*	*	S	Bend	trans	-102.7	-13.1	-175.7	63.2	0	0	0	0	116.2	A559	A559-S562 PolarHBondContact O-OG 3.17Å
563	S	42.1	Very low	51.2	Low	87 Å²	87	113.7 Å²	113.7	61%	0.608	62%	0.62	S	S	*	*			trans	-128	63.8	-164.8	32	0	0	0	0	112.8	S565	S563-S565 PolarHBondContact O-N 3.04Å; S563-S565 VanDerWaalsContact O-N 3.14Å
564	Y	33.8	Very low	52.5	Low	237 Å²	237	110.9 Å²	110.9	93%	0.929	60%	0.603	S	S	*	*			trans	-80.3	91.3	-175.1	-160.1	-91.4	0	0	0	112.6
565	S	39.6	Very low	53.7	Low	105 Å²	105	116 Å²	116	73%	0.734	61%	0.611	S	S	*	*			trans	-127.8	101.3	179.4	-174.3	0	0	0	0	114	S563 R567	S563-S565 PolarHBondContact O-N 3.04Å; S563-S565 VanDerWaalsContact O-N 3.14Å; S565-R567 VanDerWaalsContact C-N 3.32Å; S565-R567 PolarHBondContact O-N 2.83Å
566	G	43.5	Very low	55.3	Low	82 Å²	82	121.3 Å²	121.3	85%	0.845	62%	0.62	S	S	*	*	S	Bend	trans	69.1	-23.3	144.9	0	0	0	0	0	121.3
567	R	51	Low	56.2	Low	235 Å²	235	124.5 Å²	124.5	89%	0.887	63%	0.631	S	S	*	*			trans	-90.8	128.3	-170.3	-58.6	-169.1	-169.4	-158.8	3.6	113.4	S565 R569	S565-R567 VanDerWaalsContact C-N 3.32Å; S565-R567 PolarHBondContact O-N 2.83Å; R567-R569 PolarHBondContact O-N 2.77Å
568	Y	60.5	Low	57.6	Low	205 Å²	205	129 Å²	129	80%	0.804	64%	0.639	S	S	*	*			trans	-62.1	126.4	172	176.1	-95.2	0	0	0	110.9	D570	Y568-D570 HydrophobicContact CD1-CB 4.44Å; Y568-D570 HydrophobicContact CE1-CB 3.91Å
569	R	71.5	Confident	58.7	Low	150 Å²	150	132.6 Å²	132.6	57%	0.566	64%	0.643	S	S	*	*			trans	-104.4	106.1	-178.2	-170.5	171.2	179.6	152	9.6	110.5	R567 R571 E574	R567-R569 PolarHBondContact O-N 2.77Å; R569-R571 PolarHBondContact O-N 3.37Å; R569-E574 IonicContact CZ-OE1 2.72Å; R569-E574 IonicContact NE-OE1 2.56Å; R569-E574 PolarHBondContact NE-OE1 3.19Å; R569-E574 IonicContact NE-OE2 2.71Å; R569-E574 PolarHBondContact NE-OE2 3.44Å; R569-E574 IonicContact NH2-OE1 3.08Å; R569-E574 PolarHBondContact NH2-OE1 3.41Å
570	D	68.2	Low	59.4	Low	59 Å²	59	131.8 Å²	131.8	32%	0.316	64%	0.641	S	S	.	*			trans	-75.9	87.7	-175.3	-173.3	-3.7	0	0	0	112.6	Y568 A572 K573 E574	Y568-D570 HydrophobicContact CD1-CB 4.44Å; Y568-D570 HydrophobicContact CE1-CB 3.91Å; D570-A572 PolarHBondContact O-N 2.85Å; D570-A572 VanDerWaalsContact O-N 3.16Å; D570-A572 WeakPolarHBondContact OD1-CA 3.5Å; D570-A572 VanDerWaalsContact OD1-CB 3.26Å; D570-A572 WeakPolarHBondContact OD1-CB 3.39Å; D570-A572 PolarHBondContact OD1-N 3.24Å; D570-K573 HydrophobicContact CB-CB 3.92Å; D570-K573 PolarHBondContact O-N 3.35Å; D570-K573 VanDerWaalsContact O-N 3.12Å; D570-K573 PolarHBondContact OD1-N 3.41Å; D570-K573 WeakPolarHBondContact OD2-CB 3.38Å; D570-E574 WeakPolarHBondContact O-CG 3.45Å; D570-E574 PolarHBondContact O-N 3.18Å
571	R	75.4	Confident	60.1	Low	193 Å²	193	134.1 Å²	134.1	73%	0.728	66%	0.655	S	S	*	*	H	α-helix	trans	-61.6	-16.4	173.4	-65.7	-174.3	-177.6	121.1	-2.8	114.3	R569 R575	R569-R571 PolarHBondContact O-N 3.37Å; R571-R575 WeakPolarHBondContact O-CB 3.28Å; R571-R575 WeakPolarHBondContact O-CG 3.46Å; R571-R575 PolarHBondContact O-N 3.27Å
572	A	62.1	Low	60.3	Low	51 Å²	51	134.5 Å²	134.5	42%	0.421	65%	0.653	S	S	.	*	H	α-helix	trans	-79.4	-42.4	173.3	0	0	0	0	0	110.3	D570 R575 R576	D570-A572 PolarHBondContact O-N 2.85Å; D570-A572 VanDerWaalsContact O-N 3.16Å; D570-A572 WeakPolarHBondContact OD1-CA 3.5Å; D570-A572 VanDerWaalsContact OD1-CB 3.26Å; D570-A572 WeakPolarHBondContact OD1-CB 3.39Å; D570-A572 PolarHBondContact OD1-N 3.24Å; A572-R575 PolarHBondContact O-N 2.96Å; A572-R576 WeakPolarHBondContact O-CG 3.13Å; A572-R576 PolarHBondContact O-N 3.43Å
573	K	75.6	Confident	60.6	Low	100 Å²	100	136.5 Å²	136.5	44%	0.435	66%	0.655	S	S	.	*	H	α-helix	trans	-61.7	-46.1	169.7	-174.2	173.1	177.8	-73.8	0	111.7	D570 R575 R576 E577	D570-K573 HydrophobicContact CB-CB 3.92Å; D570-K573 PolarHBondContact O-N 3.35Å; D570-K573 VanDerWaalsContact O-N 3.12Å; D570-K573 PolarHBondContact OD1-N 3.41Å; D570-K573 WeakPolarHBondContact OD2-CB 3.38Å; K573-R575 PolarHBondContact O-N 3.46Å; K573-R576 CarbonylContact O-C 3.37Å; K573-R576 WeakPolarHBondContact O-CA 3.37Å; K573-R576 WeakPolarHBondContact O-CB 3.13Å; K573-R576 PolarHBondContact O-N 3.2Å; K573-E577 HydrophobicContact CG-CG 4.42Å; K573-E577 IonicContact NZ-OE1 3.15Å; K573-E577 PolarHBondContact NZ-OE1 3.14Å; K573-E577 IonicContact NZ-OE2 3.95Å; K573-E577 PolarHBondContact NZ-OE2 2.73Å; K573-E577 VanDerWaalsContact NZ-OE2 3.08Å; K573-E577 WeakPolarHBondContact O-CG 3.44Å; K573-E577 PolarHBondContact O-N 3.07Å
574	E	77.5	Confident	60.9	Low	65 Å²	65	139.7 Å²	139.7	30%	0.304	66%	0.66	S	S	.	*	H	α-helix	trans	-60.9	-30.3	176.1	-65.8	-179.9	129.3	0	0	113	R569 D570 K578	R569-E574 IonicContact CZ-OE1 2.72Å; R569-E574 IonicContact NE-OE1 2.56Å; R569-E574 PolarHBondContact NE-OE1 3.19Å; R569-E574 IonicContact NE-OE2 2.71Å; R569-E574 PolarHBondContact NE-OE2 3.44Å; R569-E574 IonicContact NH2-OE1 3.08Å; R569-E574 PolarHBondContact NH2-OE1 3.41Å; D570-E574 WeakPolarHBondContact O-CG 3.45Å; D570-E574 PolarHBondContact O-N 3.18Å; E574-K578 VanDerWaalsContact O-CB 3.23Å; E574-K578 WeakPolarHBondContact O-CB 3.44Å; E574-K578 PolarHBondContact O-N 3.32Å
575	R	75	Confident	61.5	Low	186 Å²	186	135.7 Å²	135.7	70%	0.702	65%	0.653	S	S	*	*	H	α-helix	trans	-73.2	-35.8	171.3	-82.6	-179.7	174.9	-171.6	-1.3	112.9	R571 A572 K573 F579 G580	R571-R575 WeakPolarHBondContact O-CB 3.28Å; R571-R575 WeakPolarHBondContact O-CG 3.46Å; R571-R575 PolarHBondContact O-N 3.27Å; A572-R575 PolarHBondContact O-N 2.96Å; K573-R575 PolarHBondContact O-N 3.46Å; R575-F579 WeakPolarHBondContact O-CA 3.37Å; R575-F579 WeakPolarHBondContact O-CB 3.5Å; R575-F579 PolarHBondContact O-N 2.76Å; R575-G580 PolarHBondContact O-N 3.09Å
576	R	77.6	Confident	62	Low	179 Å²	179	138.2 Å²	138.2	68%	0.675	65%	0.654	S	S	*	*	H	α-helix	trans	-65.1	-42.2	171.4	-64.6	172.6	-159.5	171.6	6.2	110.7	A572 K573 K578 G580	A572-R576 WeakPolarHBondContact O-CG 3.13Å; A572-R576 PolarHBondContact O-N 3.43Å; K573-R576 CarbonylContact O-C 3.37Å; K573-R576 WeakPolarHBondContact O-CA 3.37Å; K573-R576 WeakPolarHBondContact O-CB 3.13Å; K573-R576 PolarHBondContact O-N 3.2Å; R576-K578 VanDerWaalsContact C-N 3.35Å; R576-K578 PolarHBondContact O-N 2.7Å; R576-G580 WeakPolarHBondContact O-CA 3.31Å; R576-G580 PolarHBondContact O-N 3.3Å
577	E	68	Low	62.1	Low	130 Å²	130	140.2 Å²	140.2	61%	0.607	65%	0.652	S	S	*	*	H	α-helix	trans	-72.7	-24.6	-179.6	-67.8	174.7	138.8	0	0	113.4	K573	K573-E577 HydrophobicContact CG-CG 4.42Å; K573-E577 IonicContact NZ-OE1 3.15Å; K573-E577 PolarHBondContact NZ-OE1 3.14Å; K573-E577 IonicContact NZ-OE2 3.95Å; K573-E577 PolarHBondContact NZ-OE2 2.73Å; K573-E577 VanDerWaalsContact NZ-OE2 3.08Å; K573-E577 WeakPolarHBondContact O-CG 3.44Å; K573-E577 PolarHBondContact O-N 3.07Å
578	K	70.8	Confident	61.7	Low	154 Å²	154	134.6 Å²	134.6	67%	0.67	64%	0.639	S	S	*	*	H	α-helix	trans	-101.1	-22.6	-179.9	-169.2	158.9	-172.4	152.4	0	115.4	E574 R576	E574-K578 VanDerWaalsContact O-CB 3.23Å; E574-K578 WeakPolarHBondContact O-CB 3.44Å; E574-K578 PolarHBondContact O-N 3.32Å; R576-K578 VanDerWaalsContact C-N 3.35Å; R576-K578 PolarHBondContact O-N 2.7Å
579	F	65.9	Low	61.2	Low	166 Å²	166	128.5 Å²	128.5	73%	0.728	63%	0.631	S	S	*	*	H	α-helix	trans	-136	-8.6	-176.5	-60.4	-78.7	0	0	0	114.3	R575 L581	R575-F579 WeakPolarHBondContact O-CA 3.37Å; R575-F579 WeakPolarHBondContact O-CB 3.5Å; R575-F579 PolarHBondContact O-N 2.76Å; F579-L581 PolarHBondContact O-N 3.39Å
580	G	58	Low	60.1	Low	47 Å²	47	128 Å²	128	49%	0.485	64%	0.639	S	S	.	*			trans	-74.7	106.1	163.9	0	0	0	0	0	108.5	R575 R576	R575-G580 PolarHBondContact O-N 3.09Å; R576-G580 WeakPolarHBondContact O-CA 3.31Å; R576-G580 PolarHBondContact O-N 3.3Å
581	L	57.9	Low	59.1	Low	158 Å²	158	134.2 Å²	134.2	83%	0.827	66%	0.663	S	S	*	*			trans	-59.8	146.3	151.6	-68.9	167.1	0	0	0	107.4	F579 D583	F579-L581 PolarHBondContact O-N 3.39Å; L581-D583 PolarHBondContact O-N 3.3Å; L581-D583 VanDerWaalsContact O-N 3.11Å
582	D	48.9	Very low	57.9	Low	128 Å²	128	133.2 Å²	133.2	68%	0.684	67%	0.667	S	S	*	*			trans	-60.9	115.5	172.6	-170.2	27	0	0	0	108	Q584	D582-Q584 HydrophobicContact CB-CG 4.41Å; D582-Q584 PolarHBondContact O-N 2.71Å; D582-Q584 VanDerWaalsContact OD2-CG 3.23Å; D582-Q584 WeakPolarHBondContact OD2-CG 3.32Å; D582-Q584 PolarHBondContact OD2-NE2 3.32Å
583	D	50.6	Low	57.4	Low	149 Å²	149	137.7 Å²	137.7	80%	0.797	68%	0.677	S	S	*	*			trans	-74.5	59.9	-179	-95.6	-31.4	0	0	0	109.5	L581 I585	L581-D583 PolarHBondContact O-N 3.3Å; L581-D583 VanDerWaalsContact O-N 3.11Å; D583-I585 VanDerWaalsContact C-N 3.26Å; D583-I585 PolarHBondContact O-N 2.96Å
584	Q	47	Very low	55.6	Low	154 Å²	154	142 Å²	142	72%	0.72	70%	0.696	S	S	*	*			trans	-69.7	90.4	165.3	-60.6	-149.4	7.6	0	0	108	D582 E586	D582-Q584 HydrophobicContact CB-CG 4.41Å; D582-Q584 PolarHBondContact O-N 2.71Å; D582-Q584 VanDerWaalsContact OD2-CG 3.23Å; D582-Q584 WeakPolarHBondContact OD2-CG 3.32Å; D582-Q584 PolarHBondContact OD2-NE2 3.32Å; Q584-E586 PolarHBondContact O-N 3.23Å
585	I	46.8	Very low	54.1	Low	153 Å²	153	147.2 Å²	147.2	79%	0.785	73%	0.725	S	S	*	*			trans	-61.3	97	176.1	-58.4	168.8	0	0	0	107.9	D583	D583-I585 VanDerWaalsContact C-N 3.26Å; D583-I585 PolarHBondContact O-N 2.96Å
586	E	50.6	Low	52.4	Low	158 Å²	158	144.9 Å²	144.9	74%	0.738	73%	0.731	S	S	*	*			trans	-56.9	127.1	173.1	-77.1	-154.3	139.1	0	0	109.6	Q584 N588	Q584-E586 PolarHBondContact O-N 3.23Å; E586-N588 PolarHBondContact O-N 2.97Å; E586-N588 PolarHBondContact O-ND2 3.39Å; E586-N588 VanDerWaalsContact O-ND2 3.07Å
587	P	46.3	Very low	50.8	Low	124 Å²	124	144.2 Å²	144.2	81%	0.805	74%	0.736	S	S	*	*			trans	-69.9	92.5	-171.9	27	-34.4	0	0	0	110.7	A589	P587-A589 PolarHBondContact O-N 3.29Å
588	N	40.7	Very low	49.4	Very low	118 Å²	118	143.2 Å²	143.2	63%	0.631	74%	0.743	S	S	*	*			trans	-67.4	96.9	-179.2	-93.3	-97.4	0	0	0	111.1	E586 L590 K591	E586-N588 PolarHBondContact O-N 2.97Å; E586-N588 PolarHBondContact O-ND2 3.39Å; E586-N588 VanDerWaalsContact O-ND2 3.07Å; N588-L590 PolarHBondContact O-N 3.02Å; N588-K591 PolarHBondContact O-N 3.44Å
589	A	50.3	Low	48.1	Very low	76 Å²	76	142.4 Å²	142.4	63%	0.628	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	18.9	-178	0	0	0	0	0	116.3	P587	P587-A589 PolarHBondContact O-N 3.29Å
590	L	49.9	Very low	46.5	Very low	140 Å²	140	139.7 Å²	139.7	73%	0.733	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	-10.4	172.8	-69.8	170	0	0	0	112.6	N588	N588-L590 PolarHBondContact O-N 3.02Å
591	K	46.8	Very low	45.8	Very low	190 Å²	190	146.5 Å²	146.5	83%	0.826	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-79.7	-14.4	-174.6	-153.3	178.4	-179.9	-170.6	0	114.2	N588 K593	N588-K591 PolarHBondContact O-N 3.44Å; K591-K593 VanDerWaalsContact C-N 3.27Å; K591-K593 PolarHBondContact O-N 3.33Å
592	E	49.3	Very low	45.1	Very low	171 Å²	171	147.8 Å²	147.8	80%	0.799	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-74.6	-1.3	-175.9	-59.6	178.3	128.1	0	0	115.4
593	K	51.9	Low	44.9	Very low	146 Å²	146	146 Å²	146	64%	0.635	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-117.1	-5.8	-159.3	-70	179.8	-179.6	168.1	0	117.3	K591	K591-K593 VanDerWaalsContact C-N 3.27Å; K591-K593 PolarHBondContact O-N 3.33Å
594	F	38.2	Very low	44.6	Very low	190 Å²	190	145.1 Å²	145.1	83%	0.833	77%	0.768	S	S	*	*	S	Bend	trans	-148	45.3	-163.7	-75.8	-73.3	0	0	0	115.8
595	L	45	Very low	44.8	Very low	175 Å²	175	143.5 Å²	143.5	92%	0.916	77%	0.774	S	S	*	*			trans	-149.3	103.2	165.9	-148.9	83.6	0	0	0	114
596	V	40.5	Very low	45.1	Very low	137 Å²	137	140.2 Å²	140.2	83%	0.83	77%	0.765	S	S	*	*			trans	-147.6	128.1	163	173.9	0	0	0	0	106.1
597	E	43.4	Very low	45.4	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	77%	0.765	S	S	*	*			trans	166.3	114.6	138.4	-159.3	70.7	-96.2	0	0	111
598	S	38.6	Very low	45.8	Very low	109 Å²	109	137 Å²	137	76%	0.762	75%	0.75	S	S	*	*			trans	59.9	155.9	170.9	75.4	0	0	0	0	118.1
599	V	42.5	Very low	47	Very low	136 Å²	136	137.5 Å²	137.5	82%	0.824	75%	0.748	S	S	*	*			cis	-125.2	151.7	5.5	175.3	0	0	0	0	109.2
600	S	33	Very low	47.7	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	74%	0.742	S	S	*	*			trans	-97.4	124.7	-179.9	53.8	0	0	0	0	113.7
601	E	42.8	Very low	49	Very low	189 Å²	189	137 Å²	137	88%	0.883	74%	0.739	S	S	*	*			trans	-118.6	138.7	156.6	-66.8	-172.2	162.8	0	0	108.1
602	E	44.2	Very low	50.4	Low	185 Å²	185	130.9 Å²	130.9	86%	0.864	72%	0.716	S	S	*	*			trans	-87.4	135.4	-173.4	-64.1	-171	146.3	0	0	112.5	V604	E602-V604 PolarHBondContact O-N 3.48Å
603	P	43.9	Very low	52	Low	91 Å²	91	132.2 Å²	132.2	59%	0.591	72%	0.719	S	S	*	*			trans	-73	124.8	176.1	29.3	-33.2	0	0	0	111	S605	P603-S605 PolarHBondContact O-N 2.95Å
604	V	45.1	Very low	53.2	Low	130 Å²	130	127.1 Å²	127.1	79%	0.788	71%	0.708	S	S	*	*			trans	-73.1	95	-175.8	-174.6	0	0	0	0	110.9	E602 S606	E602-V604 PolarHBondContact O-N 3.48Å; V604-S606 PolarHBondContact O-N 3.26Å
605	S	51.9	Low	55	Low	121 Å²	121	118.2 Å²	118.2	85%	0.846	67%	0.669	S	S	*	*			trans	-77.6	8.8	-179.9	59.1	0	0	0	0	115.2	P603	P603-S605 PolarHBondContact O-N 2.95Å
606	S	52.9	Low	56.8	Low	83 Å²	83	117.7 Å²	117.7	58%	0.58	66%	0.659	S	S	*	*	S	Bend	trans	-89.5	142.5	-175.7	-63.8	0	0	0	0	112.5	V604	V604-S606 PolarHBondContact O-N 3.26Å
607	P	56.4	Low	58.9	Low	115 Å²	115	116.4 Å²	116.4	75%	0.747	65%	0.647	S	S	*	*			trans	-61.3	156.1	172.4	27.4	-34.8	0	0	0	111.3	Q609	P607-Q609 PolarHBondContact O-N 3.2Å; P607-Q609 VanDerWaalsContact O-N 3.08Å
608	M	54.5	Low	60.7	Low	101 Å²	101	110.4 Å²	110.4	50%	0.498	62%	0.62	S	S	.	*			trans	-54.1	116	-174.6	-95.2	-167.7	61.9	0	0	112.5	T610 A615 M618	M608-T610 PolarHBondContact O-N 3.14Å; M608-A615 HydrophobicContact CE-CB 4.01Å; M608-M618 HydrophobicContact CE-CE 3.63Å; M608-M618 HydrophobicContact SD-CE 3.8Å
609	Q	65	Low	62.7	Low	127 Å²	127	110.1 Å²	110.1	59%	0.593	60%	0.602	S	S	*	*			trans	-50.6	123.7	173.7	-82.5	176.1	-40.7	0	0	110.8	P607 D611 N612	P607-Q609 PolarHBondContact O-N 3.2Å; P607-Q609 VanDerWaalsContact O-N 3.08Å; Q609-D611 WeakPolarHBondContact CB-OD1 3.43Å; Q609-D611 PolarHBondContact O-N 3.28Å; Q609-N612 WeakPolarHBondContact CB-ND2 3.3Å; Q609-N612 VanDerWaalsContact O-CB 3.3Å; Q609-N612 WeakPolarHBondContact O-CB 3.44Å; Q609-N612 VanDerWaalsContact O-CG 3.31Å; Q609-N612 PolarHBondContact O-N 3.12Å; Q609-N612 PolarHBondContact O-ND2 2.88Å
610	T	66.1	Low	64.7	Low	79 Å²	79	108 Å²	108	49%	0.485	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.4	-19.5	-164.2	62.5	0	0	0	0	113.1	M608 R619	M608-T610 PolarHBondContact O-N 3.14Å; T610-R619 PolarHBondContact O-NH1 3.07Å
611	D	76.3	Confident	66.6	Low	126 Å²	126	109.9 Å²	109.9	67%	0.674	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-9.5	-178.5	47.1	-56.6	0	0	0	113.6	Q609	Q609-D611 WeakPolarHBondContact CB-OD1 3.43Å; Q609-D611 PolarHBondContact O-N 3.28Å
612	N	77.9	Confident	68.4	Low	63 Å²	63	103.6 Å²	103.6	34%	0.337	58%	0.577	S	S	.	*	S	Bend	trans	-61.6	140.5	175.5	-75	-35.8	0	0	0	112.9	Q609 G614 A615 K616	Q609-N612 WeakPolarHBondContact CB-ND2 3.3Å; Q609-N612 VanDerWaalsContact O-CB 3.3Å; Q609-N612 WeakPolarHBondContact O-CB 3.44Å; Q609-N612 VanDerWaalsContact O-CG 3.31Å; Q609-N612 PolarHBondContact O-N 3.12Å; Q609-N612 PolarHBondContact O-ND2 2.88Å; N612-G614 PolarHBondContact O-N 3.43Å; N612-G614 VanDerWaalsContact O-N 3.14Å; N612-A615 HydrophobicContact CB-CB 4.16Å; N612-A615 WeakPolarHBondContact O-CB 3.39Å; N612-A615 PolarHBondContact O-N 3.46Å; N612-K616 PolarHBondContact O-N 3.04Å
613	K	81.5	Confident	70	Confident	199 Å²	199	97.3 Å²	97.3	87%	0.865	55%	0.546	S	S	*	.	H	α-helix	trans	-53.2	-37.3	173.9	-70.7	-176.7	179.9	177.5	0	112.5	L617	K613-L617 WeakPolarHBondContact O-CB 3.49Å; K613-L617 PolarHBondContact O-N 3.15Å
614	G	77.1	Confident	71.8	Confident	39 Å²	39	99.2 Å²	99.2	40%	0.402	55%	0.547	S	S	.	.	H	α-helix	trans	-65.8	-43.5	174.7	0	0	0	0	0	113.4	N612 K616 L617 M618	N612-G614 PolarHBondContact O-N 3.43Å; N612-G614 VanDerWaalsContact O-N 3.14Å; G614-K616 VanDerWaalsContact C-N 3.34Å; G614-K616 PolarHBondContact O-N 3.21Å; G614-L617 PolarHBondContact O-N 3.33Å; G614-M618 WeakPolarHBondContact O-CG 3.44Å; G614-M618 PolarHBondContact O-N 3.22Å
615	A	77.2	Confident	73.1	Confident	3 Å²	3	99.1 Å²	99.1	3%	0.025	54%	0.538	C	S	.	.	H	α-helix	trans	-61.8	-42.8	176.4	0	0	0	0	0	111.4	M608 N612 L617 M618 R619	M608-A615 HydrophobicContact CE-CB 4.01Å; N612-A615 HydrophobicContact CB-CB 4.16Å; N612-A615 WeakPolarHBondContact O-CB 3.39Å; N612-A615 PolarHBondContact O-N 3.46Å; A615-L617 VanDerWaalsContact C-N 3.34Å; A615-L617 PolarHBondContact O-N 2.91Å; A615-M618 PolarHBondContact O-N 3.03Å; A615-R619 WeakPolarHBondContact O-CG 3.41Å; A615-R619 PolarHBondContact O-N 3.45Å; A615-R619 VanDerWaalsContact O-N 3.09Å
616	K	81.8	Confident	74.1	Confident	163 Å²	163	95.9 Å²	95.9	71%	0.709	52%	0.524	S	S	*	.	H	α-helix	trans	-63.1	-38.9	175.7	-165.6	166.7	-174.1	170.3	0	112.4	N612 G614 S620	N612-K616 PolarHBondContact O-N 3.04Å; G614-K616 VanDerWaalsContact C-N 3.34Å; G614-K616 PolarHBondContact O-N 3.21Å; K616-S620 PolarHBondContact O-N 2.69Å; K616-S620 PolarHBondContact O-OG 2.88Å
617	L	84.7	Confident	75.2	Confident	110 Å²	110	94.7 Å²	94.7	58%	0.576	51%	0.509	S	S	*	.	H	α-helix	trans	-72.1	-40.1	179.7	-161	152.9	0	0	0	112.2	K613 G614 A615 S620 M621	K613-L617 WeakPolarHBondContact O-CB 3.49Å; K613-L617 PolarHBondContact O-N 3.15Å; G614-L617 PolarHBondContact O-N 3.33Å; A615-L617 VanDerWaalsContact C-N 3.34Å; A615-L617 PolarHBondContact O-N 2.91Å; L617-S620 WeakPolarHBondContact CA-OG 3.44Å; L617-S620 PolarHBondContact O-N 2.9Å; L617-S620 PolarHBondContact O-OG 3Å; L617-M621 HydrophobicContact CD2-CG 4.32Å; L617-M621 WeakPolarHBondContact O-CG 3.33Å; L617-M621 PolarHBondContact O-N 3.39Å
618	M	80.6	Confident	76.1	Confident	40 Å²	40	89.3 Å²	89.3	20%	0.197	47%	0.474	C	S	.	.	H	α-helix	trans	-64.4	-43.9	174.9	-70.7	-169.9	-60.7	0	0	111.9	M608 G614 A615 S620 M621 G622 W623 L629	M608-M618 HydrophobicContact CE-CE 3.63Å; M608-M618 HydrophobicContact SD-CE 3.8Å; G614-M618 WeakPolarHBondContact O-CG 3.44Å; G614-M618 PolarHBondContact O-N 3.22Å; A615-M618 PolarHBondContact O-N 3.03Å; M618-S620 VanDerWaalsContact C-N 3.3Å; M618-S620 PolarHBondContact O-N 2.7Å; M618-M621 CarbonylContact O-C 3.52Å; M618-M621 WeakPolarHBondContact O-CA 3.44Å; M618-M621 PolarHBondContact O-N 3.16Å; M618-G622 PolarHBondContact O-N 2.81Å; M618-W623 HydrophobicContact CB-CB 4.06Å; M618-W623 HydrophobicContact CB-CD2 4.21Å; M618-W623 HydrophobicContact CB-CE3 3.95Å; M618-W623 HydrophobicContact CB-CG 4.29Å; M618-W623 HydrophobicContact CE-CE3 4.41Å; M618-W623 HydrophobicContact CE-CZ3 4.35Å; M618-W623 WeakPolarHBondContact O-CB 3.32Å; M618-W623 PolarHBondContact O-N 3.21Å; M618-L629 HydrophobicContact SD-CD1 4.48Å
619	R	81.9	Confident	76.8	Confident	102 Å²	102	90.4 Å²	90.4	39%	0.385	48%	0.482	S	S	.	.	H	α-helix	trans	-60.8	-36.7	174.3	-68.8	-174.9	-168.9	115	-2.8	112.6	T610 A615 M621 G622 E625	T610-R619 PolarHBondContact O-NH1 3.07Å; A615-R619 WeakPolarHBondContact O-CG 3.41Å; A615-R619 PolarHBondContact O-N 3.45Å; A615-R619 VanDerWaalsContact O-N 3.09Å; R619-M621 PolarHBondContact O-N 3.48Å; R619-G622 PolarHBondContact O-N 3.38Å; R619-E625 IonicContact CZ-OE2 2.66Å; R619-E625 IonicContact NE-OE2 3.15Å; R619-E625 IonicContact NH2-OE2 3.38Å; R619-E625 PolarHBondContact NH2-OE2 3.2Å
620	S	84.5	Confident	77.2	Confident	92 Å²	92	86.3 Å²	86.3	64%	0.643	47%	0.474	S	S	*	.	H	α-helix	trans	-70	-14.1	173.2	55.1	0	0	0	0	114.9	K616 L617 M618	K616-S620 PolarHBondContact O-N 2.69Å; K616-S620 PolarHBondContact O-OG 2.88Å; L617-S620 WeakPolarHBondContact CA-OG 3.44Å; L617-S620 PolarHBondContact O-N 2.9Å; L617-S620 PolarHBondContact O-OG 3Å; M618-S620 VanDerWaalsContact C-N 3.3Å; M618-S620 PolarHBondContact O-N 2.7Å
621	M	73.6	Confident	77.6	Confident	150 Å²	150	95 Å²	95	74%	0.739	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	13.3	174.4	-66.6	-63	-62	0	0	112.7	L617 M618 R619 W623	L617-M621 HydrophobicContact CD2-CG 4.32Å; L617-M621 WeakPolarHBondContact O-CG 3.33Å; L617-M621 PolarHBondContact O-N 3.39Å; M618-M621 CarbonylContact O-C 3.52Å; M618-M621 WeakPolarHBondContact O-CA 3.44Å; M618-M621 PolarHBondContact O-N 3.16Å; R619-M621 PolarHBondContact O-N 3.48Å; M621-W623 PolarHBondContact O-N 3.35Å
622	G	80.2	Confident	77.7	Confident	56 Å²	56	95.6 Å²	95.6	58%	0.577	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	4	176.9	0	0	0	0	0	115.6	M618 R619 Q624	M618-G622 PolarHBondContact O-N 2.81Å; R619-G622 PolarHBondContact O-N 3.38Å; G622-Q624 PolarHBondContact O-N 2.88Å
623	W	77.5	Confident	77.5	Confident	54 Å²	54	97 Å²	97	21%	0.205	50%	0.504	C	S	.	.			trans	-72	125.4	176	180	84.2	0	0	0	111	M618 M621 E625 Q627 L629	M618-W623 HydrophobicContact CB-CB 4.06Å; M618-W623 HydrophobicContact CB-CD2 4.21Å; M618-W623 HydrophobicContact CB-CE3 3.95Å; M618-W623 HydrophobicContact CB-CG 4.29Å; M618-W623 HydrophobicContact CE-CE3 4.41Å; M618-W623 HydrophobicContact CE-CZ3 4.35Å; M618-W623 WeakPolarHBondContact O-CB 3.32Å; M618-W623 PolarHBondContact O-N 3.21Å; M621-W623 PolarHBondContact O-N 3.35Å; W623-E625 HydrophobicContact CH2-CG 4.4Å; W623-E625 HydrophobicContact CZ3-CG 4.5Å; W623-Q627 PolarHBondContact NE1-O 3.49Å; W623-L629 HydrophobicContact CG-CD2 4.46Å
624	Q	80.8	Confident	77.2	Confident	131 Å²	131	94.7 Å²	94.7	61%	0.612	50%	0.496	S	S	*	.			trans	-96	151.8	175.5	-60.2	-174.7	-5.7	0	0	111.7	G622 G626 Q627	G622-Q624 PolarHBondContact O-N 2.88Å; Q624-G626 PolarHBondContact O-N 3.35Å; Q624-G626 VanDerWaalsContact O-N 3.13Å; Q624-Q627 HydrophobicContact CB-CG 4.22Å; Q624-Q627 VanDerWaalsContact N-OE1 3.07Å; Q624-Q627 WeakPolarHBondContact O-CB 3.35Å; Q624-Q627 PolarHBondContact O-N 3.47Å
625	E	73	Confident	76.7	Confident	127 Å²	127	93.9 Å²	93.9	59%	0.593	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	112.2	-179.2	-148.7	153.3	142.6	0	0	109.8	R619 W623	R619-E625 IonicContact CZ-OE2 2.66Å; R619-E625 IonicContact NE-OE2 3.15Å; R619-E625 IonicContact NH2-OE2 3.38Å; R619-E625 PolarHBondContact NH2-OE2 3.2Å; W623-E625 HydrophobicContact CH2-CG 4.4Å; W623-E625 HydrophobicContact CZ3-CG 4.5Å
626	G	72.6	Confident	76.3	Confident	54 Å²	54	100.2 Å²	100.2	56%	0.557	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.8	1.6	-171	0	0	0	0	0	115.7	Q624 T637	Q624-G626 PolarHBondContact O-N 3.35Å; Q624-G626 VanDerWaalsContact O-N 3.13Å; G626-T637 VanDerWaalsContact O-CG2 3.25Å; G626-T637 WeakPolarHBondContact O-CG2 3.4Å
627	Q	75.8	Confident	75.6	Confident	57 Å²	57	96.2 Å²	96.2	27%	0.266	51%	0.509	S	S	.	.			trans	-85.9	141.3	170.4	-86.7	178.2	-23.7	0	0	112.8	W623 Q624	W623-Q627 PolarHBondContact NE1-O 3.49Å; Q624-Q627 HydrophobicContact CB-CG 4.22Å; Q624-Q627 VanDerWaalsContact N-OE1 3.07Å; Q624-Q627 WeakPolarHBondContact O-CB 3.35Å; Q624-Q627 PolarHBondContact O-N 3.47Å
628	G	75.3	Confident	74.5	Confident	2 Å²	2	96.5 Å²	96.5	2%	0.021	51%	0.511	C	S	.	.			trans	-75.9	130.6	174.9	0	0	0	0	0	112.8	G630 N633 G635	G628-G630 PolarHBondContact O-N 3.16Å; G628-N633 WeakPolarHBondContact CA-O 3.39Å; G628-N633 CarbonylContact O-C 3.32Å; G628-N633 VanDerWaalsContact O-C 3.32Å; G628-N633 VanDerWaalsContact O-CA 3.26Å; G628-N633 WeakPolarHBondContact O-CA 2.97Å; G628-G635 WeakPolarHBondContact CA-O 3.18Å
629	L	70	Confident	73.3	Confident	125 Å²	125	99.8 Å²	99.8	65%	0.654	54%	0.535	S	S	*	.	S	Bend	trans	-67.4	103.2	176	-74.3	167.8	0	0	0	112	M618 W623	M618-L629 HydrophobicContact SD-CD1 4.48Å; W623-L629 HydrophobicContact CG-CD2 4.46Å
630	G	73.2	Confident	72	Confident	41 Å²	41	101.9 Å²	101.9	42%	0.423	55%	0.552	S	S	.	*	S	Bend	trans	179.5	163.6	174.3	0	0	0	0	0	112.9	G628 Q632 N633	G628-G630 PolarHBondContact O-N 3.16Å; G630-Q632 PolarHBondContact O-N 2.95Å; G630-N633 PolarHBondContact O-N 3.33Å
631	R	74.8	Confident	70	Confident	260 Å²	260	102.4 Å²	102.4	98%	0.981	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-17.2	-175.3	-169.4	177.1	-179.8	-167.4	0.9	114.7
632	Q	78.6	Confident	68.3	Low	140 Å²	140	102.5 Å²	102.5	65%	0.654	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	23.2	176.9	-65.6	-179.7	-15.3	0	0	111.8	G630 Q634	G630-Q632 PolarHBondContact O-N 2.95Å; Q632-Q634 HydrophobicContact CB-CG 4.16Å; Q632-Q634 PolarHBondContact O-N 2.87Å; Q632-Q634 VanDerWaalsContact O-N 3.17Å
633	N	72.7	Confident	66.2	Low	92 Å²	92	109.6 Å²	109.6	49%	0.492	56%	0.56	S	S	.	*	S	Bend	trans	59.8	16.2	-174.5	-57.2	-25.5	0	0	0	115.9	G628 G630 G635	G628-N633 WeakPolarHBondContact CA-O 3.39Å; G628-N633 CarbonylContact O-C 3.32Å; G628-N633 VanDerWaalsContact O-C 3.32Å; G628-N633 VanDerWaalsContact O-CA 3.26Å; G628-N633 WeakPolarHBondContact O-CA 2.97Å; G630-N633 PolarHBondContact O-N 3.33Å; N633-G635 VanDerWaalsContact C-N 3.31Å; N633-G635 PolarHBondContact O-N 3.19Å
634	Q	74.8	Confident	64.1	Low	151 Å²	151	112 Å²	112	71%	0.706	58%	0.581	S	S	*	*			trans	-85	15.6	-175.2	-70.7	165.3	10.2	0	0	114.9	Q632	Q632-Q634 HydrophobicContact CB-CG 4.16Å; Q632-Q634 PolarHBondContact O-N 2.87Å; Q632-Q634 VanDerWaalsContact O-N 3.17Å
635	G	67.8	Low	61.9	Low	21 Å²	21	111 Å²	111	22%	0.216	58%	0.579	C	S	.	*	S	Bend	trans	-67.4	158.9	171.9	0	0	0	0	0	111.6	G628 N633 T637	G628-G635 WeakPolarHBondContact CA-O 3.18Å; N633-G635 VanDerWaalsContact C-N 3.31Å; N633-G635 PolarHBondContact O-N 3.19Å; G635-T637 PolarHBondContact O-N 3.19Å
636	I	67.2	Low	60	Low	136 Å²	136	111.8 Å²	111.8	70%	0.697	59%	0.587	S	S	*	*			trans	-63.3	125.1	172.3	-57.9	175.4	0	0	0	108.1	D638	I636-D638 WeakPolarHBondContact CG2-O 3.39Å
637	T	68.7	Low	58.1	Low	79 Å²	79	116.1 Å²	116.1	49%	0.485	60%	0.597	S	S	.	*			trans	-85.9	-35.1	-177.4	48.4	0	0	0	0	112.7	G626 G635	G626-T637 VanDerWaalsContact O-CG2 3.25Å; G626-T637 WeakPolarHBondContact O-CG2 3.4Å; G635-T637 PolarHBondContact O-N 3.19Å
638	D	60.9	Low	56.3	Low	117 Å²	117	121.8 Å²	121.8	63%	0.626	63%	0.63	S	S	*	*	S	Bend	trans	-80.7	148	-178.3	-54.8	-33.7	0	0	0	110.1	I636 I640	I636-D638 WeakPolarHBondContact CG2-O 3.39Å; D638-I640 PolarHBondContact O-N 2.91Å
639	P	56	Low	54.4	Low	108 Å²	108	128.2 Å²	128.2	70%	0.701	66%	0.661	S	S	*	*			trans	-56.9	136	164.5	27.2	-33.6	0	0	0	108.3	T641	P639-T641 VanDerWaalsContact C-N 3.34Å; P639-T641 PolarHBondContact O-N 3.33Å
640	I	52.9	Low	52.7	Low	146 Å²	146	130.1 Å²	130.1	75%	0.749	67%	0.67	S	S	*	*			trans	-61.3	103.1	171.5	-62	176.5	0	0	0	106.4	D638 E642	D638-I640 PolarHBondContact O-N 2.91Å; I640-E642 VanDerWaalsContact C-N 3.3Å; I640-E642 PolarHBondContact O-N 3.12Å
641	T	43.2	Very low	50.8	Low	103 Å²	103	133 Å²	133	63%	0.632	68%	0.675	S	S	*	*			trans	-70.6	93	177	38.8	0	0	0	0	107.5	P639 W643	P639-T641 VanDerWaalsContact C-N 3.34Å; P639-T641 PolarHBondContact O-N 3.33Å; T641-W643 PolarHBondContact O-N 3.14Å
642	E	39	Very low	48.8	Very low	152 Å²	152	128.3 Å²	128.3	71%	0.71	67%	0.668	S	S	*	*			trans	-57.1	107.3	165.2	-176	164.6	-127.5	0	0	106.9	I640 V644	I640-E642 VanDerWaalsContact C-N 3.3Å; I640-E642 PolarHBondContact O-N 3.12Å; E642-V644 VanDerWaalsContact C-N 3.28Å; E642-V644 PolarHBondContact O-N 3.17Å
643	W	35.6	Very low	46.5	Very low	206 Å²	206	128.1 Å²	128.1	78%	0.78	67%	0.667	S	S	*	*			trans	-65.8	96.5	172.2	-85.3	73.4	0	0	0	106.9	T641 L645	T641-W643 PolarHBondContact O-N 3.14Å; W643-L645 HydrophobicContact CB-CD1 4.27Å; W643-L645 HydrophobicContact CB-CG 4.25Å; W643-L645 HydrophobicContact CE3-CD1 4.28Å; W643-L645 HydrophobicContact CE3-CD2 4.2Å; W643-L645 HydrophobicContact CE3-CG 4.06Å; W643-L645 PolarHBondContact O-N 3.13Å
644	V	34	Very low	44.5	Very low	105 Å²	105	128.1 Å²	128.1	64%	0.636	68%	0.68	S	S	*	*			trans	-70.3	60.9	166.2	-169.5	0	0	0	0	108.6	E642 N646	E642-V644 VanDerWaalsContact C-N 3.28Å; E642-V644 PolarHBondContact O-N 3.17Å; V644-N646 PolarHBondContact O-N 3.42Å
645	L	33.7	Very low	42.5	Very low	109 Å²	109	126 Å²	126	57%	0.571	67%	0.67	S	S	*	*			trans	-65.7	120.2	158.4	-74.7	165.2	0	0	0	106	W643 N647	W643-L645 HydrophobicContact CB-CD1 4.27Å; W643-L645 HydrophobicContact CB-CG 4.25Å; W643-L645 HydrophobicContact CE3-CD1 4.28Å; W643-L645 HydrophobicContact CE3-CD2 4.2Å; W643-L645 HydrophobicContact CE3-CG 4.06Å; W643-L645 PolarHBondContact O-N 3.13Å; L645-N647 PolarHBondContact O-N 3.28Å
646	N	32.9	Very low	41	Very low	144 Å²	144	136.9 Å²	136.9	77%	0.77	71%	0.705	S	S	*	*	S	Bend	trans	-53.4	126.1	170.8	-70.6	-55.8	0	0	0	108.7	V644	V644-N646 PolarHBondContact O-N 3.42Å
647	N	33.9	Very low	39.4	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	70%	0.702	S	S	*	*	S	Bend	trans	82.3	116.7	-166.1	-49.1	-78.2	0	0	0	115	L645 M649	L645-N647 PolarHBondContact O-N 3.28Å; N647-M649 PolarHBondContact O-N 3.03Å
648	N	37.1	Very low	38	Very low	177 Å²	177	141.4 Å²	141.4	95%	0.947	71%	0.713	S	S	*	*			trans	-62.4	87.3	-178.2	-64.4	-8.9	0	0	0	113.2
649	M	35.3	Very low	36.9	Very low	137 Å²	137	140.9 Å²	140.9	68%	0.675	73%	0.725	S	S	*	*			trans	-119.3	88.3	169.5	-177.1	148.7	62.6	0	0	110.7	N647 L651	N647-M649 PolarHBondContact O-N 3.03Å; M649-L651 HydrophobicContact CE-CD1 3.94Å; M649-L651 HydrophobicContact CG-CB 4.22Å; M649-L651 HydrophobicContact CG-CD1 4.01Å; M649-L651 HydrophobicContact CG-CG 3.72Å; M649-L651 PolarHBondContact O-N 3.47Å; M649-L651 HydrophobicContact SD-CD1 3.77Å; M649-L651 HydrophobicContact SD-CG 3.91Å
650	I	34.7	Very low	36.4	Very low	165 Å²	165	139.7 Å²	139.7	85%	0.846	73%	0.732	S	S	*	*			trans	-71.4	80.3	157.6	-56.9	179.1	0	0	0	107.2	L652	I650-L652 PolarHBondContact O-N 3.09Å
651	L	33.7	Very low	35.9	Very low	100 Å²	100	138 Å²	138	52%	0.524	73%	0.729	S	S	.	*			trans	-71.6	117.3	154	-93	167.4	0	0	0	107.2	M649 Q653	M649-L651 HydrophobicContact CE-CD1 3.94Å; M649-L651 HydrophobicContact CG-CB 4.22Å; M649-L651 HydrophobicContact CG-CD1 4.01Å; M649-L651 HydrophobicContact CG-CG 3.72Å; M649-L651 PolarHBondContact O-N 3.47Å; M649-L651 HydrophobicContact SD-CD1 3.77Å; M649-L651 HydrophobicContact SD-CG 3.91Å; L651-Q653 HydrophobicContact CB-CB 4.32Å; L651-Q653 PolarHBondContact O-N 3.45Å
652	L	31.5	Very low	35.7	Very low	162 Å²	162	136.1 Å²	136.1	85%	0.848	73%	0.73	S	S	*	*			trans	-60.7	94	139.7	-79.5	173.9	0	0	0	105.6	I650 A654	I650-L652 PolarHBondContact O-N 3.09Å; L652-A654 PolarHBondContact O-N 3.26Å
653	Q	31.1	Very low	35.6	Very low	136 Å²	136	137 Å²	137	64%	0.636	74%	0.738	S	S	*	*			trans	-75	74	-178.2	-170.2	163.5	-57.4	0	0	109.5	L651 E655	L651-Q653 HydrophobicContact CB-CB 4.32Å; L651-Q653 PolarHBondContact O-N 3.45Å; Q653-E655 HydrophobicContact CG-CG 4.12Å; Q653-E655 PolarHBondContact O-N 3.47Å
654	A	30.1	Very low	35.8	Very low	92 Å²	92	130.6 Å²	130.6	76%	0.76	74%	0.737	S	S	*	*			trans	-58.5	90.1	148.8	0	0	0	0	0	106.6	L652 R656	L652-A654 PolarHBondContact O-N 3.26Å; A654-R656 PolarHBondContact O-N 3.28Å; A654-R656 VanDerWaalsContact O-N 3.09Å
655	E	34	Very low	36.2	Very low	106 Å²	106	130 Å²	130	50%	0.495	74%	0.742	S	S	.	*			trans	-51	119.1	-178.5	-64.4	179.8	138.6	0	0	109.1	Q653 R657	Q653-E655 HydrophobicContact CG-CG 4.12Å; Q653-E655 PolarHBondContact O-N 3.47Å; E655-R657 HydrophobicContact CB-CG 3.89Å; E655-R657 PolarHBondContact O-N 3.09Å; E655-R657 IonicContact OE2-CZ 2.7Å; E655-R657 IonicContact OE2-NE 2.69Å; E655-R657 PolarHBondContact OE2-NE 3.39Å; E655-R657 IonicContact OE2-NH2 2.73Å; E655-R657 PolarHBondContact OE2-NH2 3.47Å
656	R	36.2	Very low	36.3	Very low	251 Å²	251	130.9 Å²	130.9	95%	0.947	76%	0.758	S	S	*	*			trans	-72.3	67	165.3	-73.6	-167.5	177.9	-158	1	109.1	A654 I658	A654-R656 PolarHBondContact O-N 3.28Å; A654-R656 VanDerWaalsContact O-N 3.09Å; R656-I658 PolarHBondContact O-N 3.4Å
657	R	32.6	Very low	36.5	Very low	170 Å²	170	127.9 Å²	127.9	64%	0.642	76%	0.761	S	S	*	*			trans	-56.5	125.2	166.9	-63.6	-176.8	-177.9	-178	-0.3	107.1	E655 A659	E655-R657 HydrophobicContact CB-CG 3.89Å; E655-R657 PolarHBondContact O-N 3.09Å; E655-R657 IonicContact OE2-CZ 2.7Å; E655-R657 IonicContact OE2-NE 2.69Å; E655-R657 PolarHBondContact OE2-NE 3.39Å; E655-R657 IonicContact OE2-NH2 2.73Å; E655-R657 PolarHBondContact OE2-NH2 3.47Å; R657-A659 PolarHBondContact O-N 3.09Å
658	I	40.3	Very low	36.5	Very low	140 Å²	140	125.9 Å²	125.9	72%	0.718	76%	0.764	S	S	*	*			trans	-61	121.1	161.3	-62	170.9	0	0	0	105.6	R656 G660 V661	R656-I658 PolarHBondContact O-N 3.4Å; I658-G660 PolarHBondContact O-N 2.86Å; I658-V661 HydrophobicContact CG2-CG2 4.48Å
659	A	38	Very low	36.4	Very low	105 Å²	105	124.2 Å²	124.2	87%	0.868	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	114.7	-177.4	0	0	0	0	0	109.8	R657	R657-A659 PolarHBondContact O-N 3.09Å
660	G	45.3	Very low	36.7	Very low	83 Å²	83	128.1 Å²	128.1	86%	0.856	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.6	-3.7	174.8	0	0	0	0	0	117.3	I658	I658-G660 PolarHBondContact O-N 2.86Å
661	V	42.9	Very low	36.7	Very low	112 Å²	112	125.1 Å²	125.1	68%	0.679	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-103.2	126.9	179.9	-170	0	0	0	0	111.8	I658	I658-V661 HydrophobicContact CG2-CG2 4.48Å
662	G	37	Very low	37.4	Very low	63 Å²	63	125.5 Å²	125.5	65%	0.649	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-82.8	161.1	-173.8	0	0	0	0	0	115.7	G664	G662-G664 PolarHBondContact O-N 3.18Å
663	L	37.4	Very low	37.8	Very low	169 Å²	169	126.3 Å²	126.3	89%	0.885	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	117.2	176.1	-69.8	139.1	0	0	0	110.7
664	G	41.1	Very low	38.4	Very low	73 Å²	73	127.1 Å²	127.1	75%	0.753	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	149.2	-13	171.2	0	0	0	0	0	117	G662 S666	G662-G664 PolarHBondContact O-N 3.18Å; G664-S666 PolarHBondContact O-N 3.05Å
665	A	42.1	Very low	39.7	Very low	91 Å²	91	126.5 Å²	126.5	75%	0.752	79%	0.785	S	S	*	*			trans	-80.1	99.6	-175.5	0	0	0	0	0	113.3	G667	A665-G667 PolarHBondContact O-N 3.18Å
666	S	35.9	Very low	40.7	Very low	129 Å²	129	123.2 Å²	123.2	90%	0.902	78%	0.776	S	S	*	*			trans	-72.3	114.1	174.8	-62.9	0	0	0	0	112.8	G664	G664-S666 PolarHBondContact O-N 3.05Å
667	G	36	Very low	41.9	Very low	80 Å²	80	114.4 Å²	114.4	83%	0.825	75%	0.753	S	S	*	*			trans	137.5	83.3	161.1	0	0	0	0	0	116.3	A665	A665-G667 PolarHBondContact O-N 3.18Å
668	A	34.2	Very low	43.3	Very low	102 Å²	102	115.5 Å²	115.5	84%	0.843	76%	0.759	S	S	*	*			trans	-148.6	31.6	175.3	0	0	0	0	0	114.8
669	V	35.6	Very low	45	Very low	142 Å²	142	117 Å²	117	86%	0.861	76%	0.76	S	S	*	*			trans	-103.7	97.5	-179.6	-175.4	0	0	0	0	111.3	S671	V669-S671 PolarHBondContact O-N 2.93Å
670	R	41.4	Very low	46.5	Very low	219 Å²	219	117.3 Å²	117.3	83%	0.826	74%	0.743	S	S	*	*			trans	-84.7	92.9	165.7	-89	-172.5	169.1	-169.7	-3.7	109.8
671	S	35.2	Very low	47.6	Very low	102 Å²	102	118.8 Å²	118.8	71%	0.713	73%	0.728	S	S	*	*			trans	-60.4	137.7	171	-174.5	0	0	0	0	111	V669	V669-S671 PolarHBondContact O-N 2.93Å
672	S	48	Very low	49.1	Very low	108 Å²	108	116.4 Å²	116.4	76%	0.755	71%	0.713	S	S	*	*			trans	-120.5	132.3	175.9	-66.5	0	0	0	0	109.5
673	F	40.5	Very low	51.1	Low	180 Å²	180	119.8 Å²	119.8	79%	0.789	71%	0.71	S	S	*	*			trans	-70.1	128.7	-164.5	-86.6	-108.2	0	0	0	114.3
674	V	43	Very low	52.8	Low	153 Å²	153	114.3 Å²	114.3	93%	0.927	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	133.5	164.3	180	0	0	0	0	109.2
675	G	57.1	Low	54.2	Low	78 Å²	78	113.3 Å²	113.3	80%	0.804	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.6	-6.9	175.8	0	0	0	0	0	116.3
676	A	55.8	Low	55.8	Low	37 Å²	37	114.5 Å²	114.5	31%	0.306	67%	0.667	S	S	.	*			trans	-67.3	132.7	-179.7	0	0	0	0	0	112.8	E680 H681	A676-E680 HydrophobicContact CB-CB 4.25Å; A676-H681 PolarHBondContact O-CE1 3.3Å; A676-H681 PolarHBondContact O-ND1 3.37Å; A676-H681 VanDerWaalsContact O-ND1 3.07Å
677	S	61.5	Low	57.8	Low	66 Å²	66	115.7 Å²	115.7	46%	0.462	65%	0.651	S	S	.	*			trans	-62.2	157.9	-176.5	-173.9	0	0	0	0	112.6	K679 E680 H681	S677-K679 PolarHBondContact O-N 2.7Å; S677-K679 VanDerWaalsContact O-N 3.14Å; S677-E680 PolarHBondContact N-OE2 3.08Å; S677-E680 WeakPolarHBondContact O-CA 3.39Å; S677-E680 WeakPolarHBondContact O-CB 3.43Å; S677-E680 PolarHBondContact O-N 2.89Å; S677-H681 PolarHBondContact O-N 3.24Å
678	Y	62	Low	59.4	Low	194 Å²	194	118.1 Å²	118.1	76%	0.761	64%	0.641	S	S	*	*	H	α-helix	trans	-51.4	-37.9	172.6	178.5	-102.9	0	0	0	112.4	E680 H681 V682	Y678-E680 PolarHBondContact O-N 3.07Å; Y678-H681 PolarHBondContact O-N 3.43Å; Y678-V682 HydrophobicContact CD1-CG2 4.47Å; Y678-V682 HydrophobicContact CE1-CG2 4.05Å; Y678-V682 HydrophobicContact CE2-CG2 4.27Å; Y678-V682 WeakPolarHBondContact O-CG2 3.46Å; Y678-V682 PolarHBondContact O-N 3.4Å
679	K	75.7	Confident	61.1	Low	171 Å²	171	120.3 Å²	120.3	74%	0.743	63%	0.632	S	S	*	*	H	α-helix	trans	-62.1	-30.9	175.7	-173.2	177.7	-179.4	-179	0	112.9	S677 K683	S677-K679 PolarHBondContact O-N 2.7Å; S677-K679 VanDerWaalsContact O-N 3.14Å; K679-K683 WeakPolarHBondContact O-CB 3.32Å; K679-K683 PolarHBondContact O-N 3.28Å
680	E	69.1	Low	63.1	Low	111 Å²	111	121.5 Å²	121.5	52%	0.519	63%	0.626	S	S	.	*	H	α-helix	trans	-85.8	-40.3	-178.9	-62.1	176.3	121.8	0	0	111.1	A676 S677 Y678 V682 K683 A684	A676-E680 HydrophobicContact CB-CB 4.25Å; S677-E680 PolarHBondContact N-OE2 3.08Å; S677-E680 WeakPolarHBondContact O-CA 3.39Å; S677-E680 WeakPolarHBondContact O-CB 3.43Å; S677-E680 PolarHBondContact O-N 2.89Å; Y678-E680 PolarHBondContact O-N 3.07Å; E680-V682 VanDerWaalsContact C-N 3.34Å; E680-V682 PolarHBondContact O-N 3.2Å; E680-K683 CarbonylContact O-C 3.58Å; E680-K683 WeakPolarHBondContact O-CA 3.47Å; E680-K683 PolarHBondContact O-N 3.26Å; E680-A684 WeakPolarHBondContact O-CB 3.1Å; E680-A684 PolarHBondContact O-N 3.07Å
681	H	68.5	Low	64.7	Low	114 Å²	114	117.4 Å²	117.4	53%	0.528	62%	0.616	S	S	.	*	H	α-helix	trans	-54.9	-46.6	169.6	-86.8	86.5	0	0	0	112	A676 S677 Y678 K683 A684 A685	A676-H681 PolarHBondContact O-CE1 3.3Å; A676-H681 PolarHBondContact O-ND1 3.37Å; A676-H681 VanDerWaalsContact O-ND1 3.07Å; S677-H681 PolarHBondContact O-N 3.24Å; Y678-H681 PolarHBondContact O-N 3.43Å; H681-K683 VanDerWaalsContact C-N 3.33Å; H681-K683 PolarHBondContact O-N 2.94Å; H681-A684 PolarHBondContact O-N 3.32Å; H681-A685 WeakPolarHBondContact O-CB 3.38Å; H681-A685 PolarHBondContact O-N 2.85Å
682	V	73.9	Confident	66.3	Low	62 Å²	62	117.7 Å²	117.7	38%	0.376	61%	0.613	S	S	.	*	H	α-helix	trans	-62.6	-38.6	174.6	172.5	0	0	0	0	111.7	Y678 E680 A684 L686	Y678-V682 HydrophobicContact CD1-CG2 4.47Å; Y678-V682 HydrophobicContact CE1-CG2 4.05Å; Y678-V682 HydrophobicContact CE2-CG2 4.27Å; Y678-V682 WeakPolarHBondContact O-CG2 3.46Å; Y678-V682 PolarHBondContact O-N 3.4Å; E680-V682 VanDerWaalsContact C-N 3.34Å; E680-V682 PolarHBondContact O-N 3.2Å; V682-A684 VanDerWaalsContact C-N 3.35Å; V682-L686 HydrophobicContact CG1-CD1 4.1Å; V682-L686 WeakPolarHBondContact O-CB 3.2Å; V682-L686 PolarHBondContact O-N 3.13Å
683	K	78.8	Confident	66.4	Low	135 Å²	135	122.3 Å²	122.3	59%	0.587	63%	0.626	S	S	*	*	H	α-helix	trans	-75.8	-19.1	178.6	-163.5	175.8	-177.4	-176.4	0	113.7	K679 E680 H681 R687	K679-K683 WeakPolarHBondContact O-CB 3.32Å; K679-K683 PolarHBondContact O-N 3.28Å; E680-K683 CarbonylContact O-C 3.58Å; E680-K683 WeakPolarHBondContact O-CA 3.47Å; E680-K683 PolarHBondContact O-N 3.26Å; H681-K683 VanDerWaalsContact C-N 3.33Å; H681-K683 PolarHBondContact O-N 2.94Å; K683-R687 PolarHBondContact O-NE 3.21Å
684	A	72.4	Confident	67.6	Low	53 Å²	53	119.5 Å²	119.5	44%	0.438	62%	0.618	S	S	.	*	H	α-helix	trans	-80.1	-51.2	169.9	0	0	0	0	0	110.5	E680 H681 V682 L686 R687 Q688	E680-A684 WeakPolarHBondContact O-CB 3.1Å; E680-A684 PolarHBondContact O-N 3.07Å; H681-A684 PolarHBondContact O-N 3.32Å; V682-A684 VanDerWaalsContact C-N 3.35Å; A684-L686 VanDerWaalsContact C-N 3.28Å; A684-L686 PolarHBondContact O-N 3.47Å; A684-R687 PolarHBondContact O-N 3.23Å; A684-Q688 PolarHBondContact O-N 3.02Å
685	A	71.5	Confident	68.9	Low	52 Å²	52	117.7 Å²	117.7	43%	0.43	60%	0.601	S	S	.	*	H	α-helix	trans	-59.7	-35.5	178	0	0	0	0	0	113.1	H681 K689	H681-A685 WeakPolarHBondContact O-CB 3.38Å; H681-A685 PolarHBondContact O-N 2.85Å; A685-K689 PolarHBondContact O-N 3.04Å; A685-K689 VanDerWaalsContact O-N 3.1Å
686	L	74.7	Confident	69.6	Low	116 Å²	116	119.9 Å²	119.9	61%	0.607	59%	0.59	S	S	*	*	H	α-helix	trans	-65.6	-39.1	172.4	-87.7	164.9	0	0	0	113.1	V682 A684 F690	V682-L686 HydrophobicContact CG1-CD1 4.1Å; V682-L686 WeakPolarHBondContact O-CB 3.2Å; V682-L686 PolarHBondContact O-N 3.13Å; A684-L686 VanDerWaalsContact C-N 3.28Å; A684-L686 PolarHBondContact O-N 3.47Å; L686-F690 PolarHBondContact O-N 3.2Å
687	R	79.2	Confident	70.4	Confident	154 Å²	154	124.8 Å²	124.8	58%	0.581	61%	0.607	S	S	*	*	H	α-helix	trans	-70.6	-43	175.7	-83.9	-172.2	-84.6	-169	2.1	111.7	K683 A684 K689 F690 E691	K683-R687 PolarHBondContact O-NE 3.21Å; A684-R687 PolarHBondContact O-N 3.23Å; R687-K689 VanDerWaalsContact C-N 3.27Å; R687-K689 PolarHBondContact O-N 3.32Å; R687-F690 CarbonylContact O-C 2.85Å; R687-F690 WeakPolarHBondContact O-CA 3.23Å; R687-F690 WeakPolarHBondContact O-CB 3.33Å; R687-F690 PolarHBondContact O-N 3.27Å; R687-E691 PolarHBondContact O-N 3.17Å
688	Q	70.1	Confident	71	Confident	131 Å²	131	128.4 Å²	128.4	61%	0.612	62%	0.616	S	S	*	*	H	α-helix	trans	-60.3	-37.3	177.8	-164.4	174.3	13.1	0	0	112	A684 F690 E691 T692	A684-Q688 PolarHBondContact O-N 3.02Å; Q688-F690 VanDerWaalsContact C-N 3.29Å; Q688-F690 PolarHBondContact O-N 2.95Å; Q688-E691 PolarHBondContact O-N 3.18Å; Q688-T692 WeakPolarHBondContact O-CG2 3.45Å; Q688-T692 PolarHBondContact O-N 3.21Å; Q688-T692 PolarHBondContact O-OG1 2.95Å
689	K	69.8	Low	71.6	Confident	149 Å²	149	124.1 Å²	124.1	65%	0.648	61%	0.606	S	S	*	*	H	α-helix	trans	-66.7	-25.9	171.3	-79.9	-167.8	172.3	-167.8	0	114.6	A685 R687 T692 M693	A685-K689 PolarHBondContact O-N 3.04Å; A685-K689 VanDerWaalsContact O-N 3.1Å; R687-K689 VanDerWaalsContact C-N 3.27Å; R687-K689 PolarHBondContact O-N 3.32Å; K689-T692 WeakPolarHBondContact CA-OG1 3.38Å; K689-T692 PolarHBondContact O-OG1 3.02Å; K689-M693 WeakPolarHBondContact O-CE 3.42Å
690	F	77.6	Confident	71.3	Confident	167 Å²	167	120.7 Å²	120.7	73%	0.732	60%	0.596	S	S	*	*	H	α-helix	trans	-86.8	-17.8	178.5	-150.1	-82.7	0	0	0	112.3	L686 R687 Q688	L686-F690 PolarHBondContact O-N 3.2Å; R687-F690 CarbonylContact O-C 2.85Å; R687-F690 WeakPolarHBondContact O-CA 3.23Å; R687-F690 WeakPolarHBondContact O-CB 3.33Å; R687-F690 PolarHBondContact O-N 3.27Å; Q688-F690 VanDerWaalsContact C-N 3.29Å; Q688-F690 PolarHBondContact O-N 2.95Å
691	E	75.2	Confident	71.4	Confident	133 Å²	133	121.5 Å²	121.5	62%	0.621	60%	0.602	S	S	*	*	S	Bend	trans	-86.6	-4.8	169.4	-68.9	176.5	-175.4	0	0	112.7	R687 Q688	R687-E691 PolarHBondContact O-N 3.17Å; Q688-E691 PolarHBondContact O-N 3.18Å
692	T	67.5	Low	71.7	Confident	107 Å²	107	122.1 Å²	122.1	66%	0.656	61%	0.609	S	S	*	*			trans	-117.1	15.2	-179.4	59.8	0	0	0	0	114	Q688 K689	Q688-T692 WeakPolarHBondContact O-CG2 3.45Å; Q688-T692 PolarHBondContact O-N 3.21Å; Q688-T692 PolarHBondContact O-OG1 2.95Å; K689-T692 WeakPolarHBondContact CA-OG1 3.38Å; K689-T692 PolarHBondContact O-OG1 3.02Å
693	M	49.5	Very low	71.5	Confident	206 Å²	206	127.5 Å²	127.5	100%	1.015	63%	0.63	S	S	*	*			trans	-127.4	0	171.8	-73.2	-171.1	-64.5	0	0	109.3	K689	K689-M693 WeakPolarHBondContact O-CE 3.42Å

Retrieved 693 of 693 residues in 1314.6 ms (Link to these results)

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